# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-27T03:37:08+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'New Journal of Chemistry') AND volume = 25 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"5000184","5.28","0.002","12.972","0.005","16.707","0.007","90","","90","","90","","1144.3","","","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","- C18 H12 -","- C18 H12 -","- C72 H48 -","4","1","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1:1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","","","","","","","","","","","","","","","","","","","has coordinates","175430","2020-10-21","18:00:00",""
"7051011","13.152","0.002","18.72","0.003","20.918","0.003","90","","99.4","0.02","90","","5081","1.4","120","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44.5 H27 B4 Cl3 F24 O Ta -","- C44.5 H27 B Cl3 F24 O Ta -","- C178 H108 B4 Cl12 F96 O4 Ta4 -","4","1","","Sabo-Etienne, Sylviane; Rodriguez, Venancio; Donnadieu, Bruno; Chaudret, Bruno; Abou el Makarim, Hassna; Barthelat, Jean-Claude; Ulrich, Stefan; Limbach, Hans-Heinrich; Moïse, Claude","Synthesis, X-ray crystal structure, NMR characterization and theoretical calculations on [Cp2Ta(η2-H2)(CO)]+, the first thermally stable group 5 dihydrogen complex","New Journal of Chemistry","2001","25","1","55","","10.1039/b002073g","","","0.71073","MoK(","","","0.0512","","","0.0623","","","","","0.9868","0.9868","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051012","10.844","0.002","20.697","0.004","22.722","0.005","91.629","0.013","91.462","0.013","101.89","0.012","4985.7","1.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Bis-(Methyltropp)rhodium-hexafluorophosphate","","","- C58 H49 F6 N P3 Rh -","- C58 H49 F6 N P3 Rh -","- C232 H196 F24 N4 P12 Rh4 -","4","2","","Deblon, Stephan; Rüegger, Heinz; Schönberg, Hartmut; Loss, Sandra; Gramlich, Volker; Grützmacher, Hansjörg","Highly distorted d8-rhodium(+I) and d10-rhodium(-I) complexes: synthesis, reactivity, and structures in solution and solid state","New Journal of Chemistry","2001","25","1","83","","10.1039/b002906h","","","0.71073","MoKα","","0.0706","0.0361","","0.0769","0.0721","","","","0.751","0.964","0.964","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051013","45.899","0.051","10.159","0.01","19.773","0.019","90","","102.27","0.08","90","","9009","16","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Allyltropp-methyltropp-rhodium","","","- C56.5 H45.5 Cl1.5 P2 Rh -","- C56.5 H45.5 Cl1.5 P2 Rh -","- C452 H364 Cl12 P16 Rh8 -","8","1","","Deblon, Stephan; Rüegger, Heinz; Schönberg, Hartmut; Loss, Sandra; Gramlich, Volker; Grützmacher, Hansjörg","Highly distorted d8-rhodium(+I) and d10-rhodium(-I) complexes: synthesis, reactivity, and structures in solution and solid state","New Journal of Chemistry","2001","25","1","83","","10.1039/b002906h","","","1.54178","CuKα","","0.0605","0.0455","","0.1218","0.1132","","","","1.073","1.122","1.122","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051014","17.293","0.002","9.7528","0.0013","17.6784","0.0006","90","","115.284","0.0009","90","","2695.9","0.5","180.2","","180.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 N2 O2 P2 Pd -","- C32 H30 N2 O2 P2 Pd -","- C128 H120 N8 O8 P8 Pd4 -","4","1","","Pierre Braunstein; Frédéric Naud; Steven J. Rettig","A new class of anionic phosphinooxazoline ligands in palladium and ruthenium complexes: catalytic properties for the transfer hydrogenation of acetophenone","New J. Chem.","2001","25","1","32","39","10.1039/b004786o","","","0.7107","MoKα","","0.0773","0.0773","","0.0675","","0.0675","","","1.365","","","1.365","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051015","9.743","0.002","13.474","0.007","18.902","0.011","90","","107.08","0.03","90","","2372","2","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","choline tetraphenylborate","","- C29 H34 B N O -","- C29 H34 B N O -","- C116 H136 B4 N4 O4 -","4","1","","Steiner, Thomas; Schreurs, Antoine M. M.; Lutz, Martin; Kroon, Jan","Making very short O‒H···Ph hydrogen bonds: the example of tetraphenylborate salts","New Journal of Chemistry","2001","25","1","174","","10.1039/b004932h","","","0.71073","MoKα","","0.1526","0.0871","","","0.1811","0.2231","","","","","","1.144","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051016","11.2759","0.0006","11.6163","0.0004","13.0526","0.0006","69.066","0.003","70.612","0.002","61.747","0.003","1378.77","0.12","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","triethanolammonium tetraphenylborate dihydrate","","- C30 H40 B N O5 -","- C30 H40 B N O5 -","- C60 H80 B2 N2 O10 -","2","1","","Steiner, Thomas; Schreurs, Antoine M. M.; Lutz, Martin; Kroon, Jan","Making very short O‒H···Ph hydrogen bonds: the example of tetraphenylborate salts","New Journal of Chemistry","2001","25","1","174","","10.1039/b004932h","","","0.71073","MoKα","","0.0692","0.0509","","","0.1121","0.1246","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051017","33.832","0.016","10.11","0.02","17.45","0.04","90","","117.75","0.005","90","","5282","16","125","2","125","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","6-ammonium-n-hexanoic acid tetraphenylborate monohydrate","","- C30 H36 B N O3 -","- C30 H36 B N O3 -","- C240 H288 B8 N8 O24 -","8","1","","Steiner, Thomas; Schreurs, Antoine M. M.; Lutz, Martin; Kroon, Jan","Making very short O‒H···Ph hydrogen bonds: the example of tetraphenylborate salts","New Journal of Chemistry","2001","25","1","174","","10.1039/b004932h","","","0.71073","MoKα","","0.0812","0.0553","","","0.125","0.1408","","","","","","1.104","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051018","7.455","0.003","10.0294","0.0013","10.568","0.005","90","","109.2","0.02","90","","746.2","0.5","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","ferroceneylaspartic acid","","","- C15 H15.668 Fe N O5.334 -","- C15 H15 Fe N O5.334 -","- C30 H30 Fe2 N2 O10.668 -","2","1","","Baker, Murray V.; Kraatz, Heinz-Bernhard; Wilson Quail, J.","Solvent effects on the redox properties of ferrocenoyl-dipeptides","New Journal of Chemistry","2001","25","3","427","","10.1039/b005125j","","","0.71069","MoKα","","0.0296","0.0216","","","0.0544","0.0565","","","","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051019","8.892","0.001","8.892","0.001","8.892","0.001","65.63","0.017","65.63","0.017","65.63","0.017","557.92","0.15","293","2","293","2","","","","","","","","6","R -3 :R","-P 3*","148","K[Re6Se5Cl9](H2O)2","potassium penta-μ~eq~3-seleno-tri-μ~eq~3-chloro- hexachloro-octahedro-hexarhenate(III) dihydrate","","- Cl9 H4 K O2 Re6 Se5 -","- Cl8.9 K O2 Re6 Se5.078 -","- Cl8.9 K O2 Re6 Se5.078 -","1","0.166667","","Santiago Uriel; Kamal Boubekeur; Patrick Batail; Jesus Orduna; André Perrin","Inertness of the [Re6Se5Cl3]5+ cluster core to substitution by OH− in organic solutions: synthesis, structural and liquid secondary ion mass spectroscopy characterization of K(H2O)2[Re6Se5Cl9] and (n-Bu4N)[Re6Se5Cl9] and the crystal structure of (n-Bu4N)2[Re6Se6Cl8]","New J. Chem.","2001","25","5","737","740","10.1039/b005231k","","","0.71073","MoKα","","0.0577","0.0401","","","0.0489","0.0558","","","","","","0.872","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051020","10.775","0.002","17.101","0.003","10.602","0.002","100.83","0.03","99.62","0.03","87.51","0.03","1891.6","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(nBu4N)[Re6Se5Cl9]","tetra-n-butylammonium penta-μ~eq~3-seleno-tri-μ~eq~3-chloro- hexachloro-octahedro-hexarhenate(III)","","- C16 H36 Cl9 N Re6 Se5 -","- C16 H36 Cl9.05 N Re6 Se4.95 -","- C32 H72 Cl18.1 N2 Re12 Se9.9 -","2","1","","Santiago Uriel; Kamal Boubekeur; Patrick Batail; Jesus Orduna; André Perrin","Inertness of the [Re6Se5Cl3]5+ cluster core to substitution by OH− in organic solutions: synthesis, structural and liquid secondary ion mass spectroscopy characterization of K(H2O)2[Re6Se5Cl9] and (n-Bu4N)[Re6Se5Cl9] and the crystal structure of (n-Bu4N)2[Re6Se6Cl8]","New J. Chem.","2001","25","5","737","740","10.1039/b005231k","","","0.71073","MoKα","","0.1","0.0345","","0.1545","","0.1295","","","1.188","","","1.311","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051021","12.833","0.003","11.588","0.002","18.563","0.004","90","","90.04","0.03","90","","2760.5","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(nBu4N)2[Re6Se6Cl8]","bis-tetra-n-butylammonium hexa-μ~eq~3-seleno-di-μ~eq~3-chloro- hexachloro-octahedro-hexarhenate(III)","","- C32 H72 Cl8 N2 Re6 Se6 -","- C32 H72 Cl8.14 N2 Re6 Se5.848 -","- C64 H144 Cl16.28 N4 Re12 Se11.696 -","2","0.5","","Santiago Uriel; Kamal Boubekeur; Patrick Batail; Jesus Orduna; André Perrin","Inertness of the [Re6Se5Cl3]5+ cluster core to substitution by OH− in organic solutions: synthesis, structural and liquid secondary ion mass spectroscopy characterization of K(H2O)2[Re6Se5Cl9] and (n-Bu4N)[Re6Se5Cl9] and the crystal structure of (n-Bu4N)2[Re6Se6Cl8]","New J. Chem.","2001","25","5","737","740","10.1039/b005231k","","","0.71073","MoKα","","0.1272","0.0539","","","0.1588","0.1885","","","","","","1.201","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051022","8.4308","0.0004","10.5457","0.0005","15.6538","0.0008","90","","90","","90","","1391.76","0.12","200","","","","","","","","","","Local laboratory","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O6 -","- C13 H20 O6 -","- C52 H80 O24 -","4","1","","Banwell, Martin G.; Bray, Andrew M.; Edwards, Alison J.; Wong, David J.","Chemoenzymatic synthesis of the epimeric 6C-methyl-D-mannoses from toluene","New Journal of Chemistry","2001","25","1","3","","10.1039/b005312k","","","0.71073","MoKα","","","0.049","","","","0.0224","","","","","","0.9997","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051023","6.9393","0.0005","10.5584","0.0008","19.7333","0.0008","90","","90","","90","","1445.82","0.16","200","","","","","","","","","","Local laboratory","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H22 O6 -","- C13 H22 O6 -","- C52 H88 O24 -","4","1","","Banwell, Martin G.; Bray, Andrew M.; Edwards, Alison J.; Wong, David J.","Chemoenzymatic synthesis of the epimeric 6C-methyl-D-mannoses from toluene","New Journal of Chemistry","2001","25","1","3","","10.1039/b005312k","","","0.71073","MoKα","","","0.0397","","","","0.0463","","","","","","0.9641","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051024","6.5102","0.0002","8.9104","0.0004","23.7859","0.0009","90","","90","","90","","1379.78","0.09","200","","","","","","","","","","Local laboratory","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O6 -","- C13 H20 O6 -","- C52 H80 O24 -","4","1","","Banwell, Martin G.; Bray, Andrew M.; Edwards, Alison J.; Wong, David J.","Chemoenzymatic synthesis of the epimeric 6C-methyl-D-mannoses from toluene","New Journal of Chemistry","2001","25","1","3","","10.1039/b005312k","","","0.71073","MoKα","","","0.0307","","","","0.0204","","","","","","1.049","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051025","9.612","0.009","15.884","0.015","15.884","0.015","105.35","0.02","92.65","0.03","92.65","0.03","2332","4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H46 N8 O4 Zn -","- C47.5 H36 N8 O4 Zn -","- C95 H72 N16 O8 Zn2 -","2","1","","Che, Chi-Ming; Wan, Chun-Wai; Ho, Kin-Ying; Zhou, Zhong-Yun","Strongly luminescent metal‒organic compounds: spectroscopic properties and crystal structure of substituted 1,8-naphthyridine and its zinc(II) complex","New Journal of Chemistry","2001","25","1","63","","10.1039/b005644h","","","0.71073","MoKα","","0.3155","0.0851","","","0.2129","0.3072","","","","","","0.818","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051026","6.632","0.002","19.859","0.002","34.049","0.004","90","","90","","90","","4484.4","1.5","293","2","293","2","","","","","","","","4","P b c 21","P 2c -2b","29","","4-phenil-4-(N-ciclohexyl)imidoyl-6-(4-methylphenyl)- 2-methoxi-3,4-dihydropyridin","","- C26 H30 N2 O -","- C26 H30 N2 O -","- C208 H240 N16 O8 -","8","2","","José Barluenga; Miguel Tomás; Alfredo Ballesteros; Javier Santamaría; Raúl Corzo-Suárez; Santiago García-Granda","Reaction of Fischer alkynylcarbene complexes with 1-azadiene derivatives: unexpected formation of 3,4-dihydropyridines","New J. Chem.","2001","25","1","8","10","10.1039/b005648k","","","0.71073","MoKα","","0.245","0.0591","","","0.1485","0.2829","","","1.029","","","1.306","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051027","6.486","0.004","12.445","0.001","18.327","0.002","90","","90","","90","","1479.3","0.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4S)-4-Benzyl-3-(4,5-dimethyl-3-pyrazolyl)-1,3-oxazolidin-2-one","","- C15 H17 N3 O2 -","- C15 H17 N3 O2 -","- C60 H68 N12 O8 -","4","1","","Marcial Moreno-Mañas; Rosa M. Sebastián; Adelina Vallribera; Juan F. Piniella; Angel Álvarez-Larena; María Luisa Jimeno; José Elguero","Structure of chiral pyrazoles in the solid state and in solution","New J. Chem.","2001","25","2","329","335","10.1039/b005920j","","","0.71069","MoKα","","0.0479","0.0414","","","0.111","0.113","","","","","","1.009","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051028","6.601","0.009","14.743","0.004","18.895","0.009","90","","90","","90","","1839","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4S)-4-Benzyl-3-(4-benzyl-5-methyl-3-pyrazolyl)-1,3-oxazolidin-2-one","","- C21 H21 N3 O2 -","- C21 H21 N3 O2 -","- C84 H84 N12 O8 -","4","1","","Marcial Moreno-Mañas; Rosa M. Sebastián; Adelina Vallribera; Juan F. Piniella; Angel Álvarez-Larena; María Luisa Jimeno; José Elguero","Structure of chiral pyrazoles in the solid state and in solution","New J. Chem.","2001","25","2","329","335","10.1039/b005920j","","","0.71069","MoKα","","0.08","0.0463","","","0.0984","0.1022","","","","","","0.886","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051029","9.309","0.002","12.306","0.004","13.322","0.003","90","","104.8","0.02","90","","1475.5","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2R)-N-(5-methyl-3-pyrazolyl)bornane-10,2-sultam","","- C14 H21 N3 O2 S -","- C14 H21 N3 O2 S -","- C56 H84 N12 O8 S4 -","4","2","","Marcial Moreno-Mañas; Rosa M. Sebastián; Adelina Vallribera; Juan F. Piniella; Angel Álvarez-Larena; María Luisa Jimeno; José Elguero","Structure of chiral pyrazoles in the solid state and in solution","New J. Chem.","2001","25","2","329","335","10.1039/b005920j","","","0.71069","MoKα","","0.033","0.0301","","","0.0816","0.0823","","","","","","1.049","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051030","16.795","0.003","12.09","0.003","17.268","0.002","90","","116.549","0.012","90","","3136.6","1.1","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H29 Cl4 N O3 P Pd -","- C30 H29 Cl4 N O3 P Pd -","- C120 H116 Cl16 N4 O12 P4 Pd4 -","4","1","","Carlos Cativiela; Larry R. Falvello; Juan Carlos Ginés; Rafael Navarro; Esteban P. Urriolabeitia","Synthesis, structure and reactivity of PdII complexes with the terdentate imino alcohol ligand C6H3-3,4-(OMe)2‒C(H)NCH2CH2OH","New J. Chem.","2001","25","2","344","352","10.1039/b006140i","","","0.71073","MoKα","","0.0448","0.034","","","0.0826","0.0864","","","","","","1.032","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051031","23.732","0.002","8.039","0.002","14.922","0.002","90","","90","","90","","2846.8","0.8","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C29 H29 Cl N O7 P Pd -","- C29 H29 Cl N O7 P Pd -","- C116 H116 Cl4 N4 O28 P4 Pd4 -","4","1","","Carlos Cativiela; Larry R. Falvello; Juan Carlos Ginés; Rafael Navarro; Esteban P. Urriolabeitia","Synthesis, structure and reactivity of PdII complexes with the terdentate imino alcohol ligand C6H3-3,4-(OMe)2‒C(H)NCH2CH2OH","New J. Chem.","2001","25","2","344","352","10.1039/b006140i","","","0.71073","MoKα","","0.0927","0.0506","","","0.1054","0.117","","","","","","0.963","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051032","16.504","0.007","7.561","0.005","12.142","0.003","90","","92.54","0.02","90","","1513.7","1.2","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H26 Cl O3 P -","- C13 H26 Cl O3 P -","- C52 H104 Cl4 O12 P4 -","4","1","","Berrigan, Rebecca A.; Russell, Douglas K.; Henderson, William; Leach, Meto T.; Nicholson, Brian K.; Woodward, Gary; Harris, Christopher","Camphene-derived primary and hydroxymethyl phosphines","New Journal of Chemistry","2001","25","2","322","","10.1039/b006252i","","","0.71073","MoKα","","0.0927","0.0467","","0.11","0.0936","","","","1.023","1.104","1.104","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051033","11.344","0.01","12.614","0.016","9.846","0.013","112.43","0.1","96.62","0.1","98.5","0.09","1265","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","nickelbis(triethylphosphine)(eta2‒1,2-octafluoronaphthalene)","","- C22 H30 F8 Ni P2 -","- C22 H30 F8 Ni P2 -","- C44 H60 F16 Ni2 P4 -","2","1","","Braun, Thomas; Cronin, Leroy; Higgitt, Catherine L.; McGrady, John E.; Perutz, Robin N.; Reinhold, Meike","Coordination and oxidative addition of octafluoronaphthalene at a nickel centre: isolation of an intermediate in C‒F bond activation","New Journal of Chemistry","2001","25","1","19","","10.1039/b006368l","","","0.71069","MoKα","","0.0857","0.0442","","0.1334","","0.1114","","","1.014","","","1.04","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051035","20.712","0.004","14.805","0.003","21.362","0.004","90","","111.5","0.03","90","","6095","2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H94 N4 O11 W2 -","- C56 H84 N4 O11 W2 -","- C224 H336 N16 O44 W8 -","4","1","","Wong, Yee-Lok; Yang, Qingchuan; Zhou, Zhong-Yuan; Kay Lee, Hung; Mak, Thomas C. W.; Ng, Dennis K. P.","Synthesis, structure and oxo-transfer properties of dioxotungsten(VI) complexes with pyridine-based NO-and NS-bidentate ligands","New Journal of Chemistry","2001","25","2","353","","10.1039/b006979p","","","0.71073","MoKα","","0.0536","0.0468","","","0.1264","0.1336","","","","","","0.894","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051036","13.467","0.003","24.756","0.005","11.723","0.002","90","","100.04","0.03","90","","3848.5","1.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 N4 O6 W -","- C42 H28 N4 O6 W -","- C168 H112 N16 O24 W4 -","4","1","","Wong, Yee-Lok; Yang, Qingchuan; Zhou, Zhong-Yuan; Kay Lee, Hung; Mak, Thomas C. W.; Ng, Dennis K. P.","Synthesis, structure and oxo-transfer properties of dioxotungsten(VI) complexes with pyridine-based NO-and NS-bidentate ligands","New Journal of Chemistry","2001","25","2","353","","10.1039/b006979p","","","0.71073","MoKα","","0.0777","0.0531","","0.1639","0.1487","","","","1.058","1.056","1.056","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051037","17.66","0.003","16.118","0.001","19.974","0.003","90","","106.76","0.003","90","","5444","1.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53.5 H63.5 N2.5 O4.5 W -","- C53.5 H63.5 N2.5 O4.5 W -","- C214 H254 N10 O18 W4 -","4","1","","Wong, Yee-Lok; Yang, Qingchuan; Zhou, Zhong-Yuan; Kay Lee, Hung; Mak, Thomas C. W.; Ng, Dennis K. P.","Synthesis, structure and oxo-transfer properties of dioxotungsten(VI) complexes with pyridine-based NO-and NS-bidentate ligands","New Journal of Chemistry","2001","25","2","353","","10.1039/b006979p","","","0.71073","MoKα","","0.1285","0.0845","","","0.1741","0.1951","","","","","","1.17","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051038","24.684","0.004","15.202","0.002","25.368","0.004","90","","97.78","0.003","90","","9432","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H68 Fe N18 Ni2 O8 -","- C30 H44 Fe N18 Ni2 O8 -","- C240 H352 Fe8 N144 Ni16 O64 -","8","1","","Lu, Tongbu; Xiang, Hua; Su, Chengyong; Cheng, Peng; Mao, Zongwan; Ji, Liangnian","[NiL]2[Fe(CN)6]·4H2O [L = 3,10-bis(2-hydroxyethyl)-1,3,5,8,10,12-hexaazacyclotetradecane]: a novel three-dimensional iron(II)‒nickel(II) cyanide-bridged bimetallic assembly with a vat-like structure","New Journal of Chemistry","2001","25","2","216","","10.1039/b007406n","","","0.71073","MoKα","","0.1235","0.0789","","","0.1783","0.2047","","","","","","1.035","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051039","39.72","0.04","10.198","0.013","24.59","0.03","90","","123.777","0.01","90","","8279","17","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C45 H40 Cl Cu N2 O4 P2 -","- C45 H40 Cl Cu N2 O4 P2 -","- C360 H320 Cl8 Cu8 N16 O32 P16 -","8","1","","Hati, Sanchita; Patra, Goutam K.; Naskar, Jnan P.; Drew, Michael G. B.; Datta, Dipankar","First structurally characterised metal complex of a 2H-benzimidazole derivative. Copper mediated synthesis of 2,2-dimethyl-2H-benzimidazole from 1,2-phenylenediamine and acetone","New Journal of Chemistry","2001","25","2","218","","10.1039/b007410l","","","0.71073","MoKα","","0.0907","0.0599","","","0.1591","0.1775","","","","","","1.084","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051040","18.0285","0.0013","10.6208","0.0007","7.7084","0.0005","90","","98.223","0.002","90","","1460.81","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 Fe N O2 -","- C18 H15 Fe N O2 -","- C72 H60 Fe4 N4 O8 -","4","1","","Jose A. Mata; Eduardo Peris; Inge Asselberghs; Roel Van Boxel; André Persoons","Syntheses, characterization and second-order nonlinear optical behavior of new ferrocenyl-terminated phenylethenyl oligomers with a pendant nitro group","New J. Chem.","2001","25","2","299","304","10.1039/b007411j","","","0.71073","MoKα","","0.0591","0.0306","","","0.0679","0.0833","","","","","","0.946","","","","has coordinates","192781","2020-10-21","18:00:00",""
"7051041","16.1351","0.0007","16.3746","0.0006","19.6653","0.0007","109.763","0.003","93.411","0.003","90.83","0.003","4877.7","0.3","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C114 H90 Cl4 N8 Ni2 O4 -","- C114 H82 Cl4 N8 Ni2 O4 -","- C228 H164 Cl8 N16 Ni4 O8 -","2","1","","François Jérôme; Jean-Michel Barbe; Claude P. Gros; Roger Guilard; Jean Fischer; Raymond Weiss","Peculiar reactivity of face to face biscorrole and porphyrin‒corrole with a nickel(II) salt. X-Ray structural characterization of a new nickel(II) bisoxocorrole","New J. Chem.","2001","25","1","93","101","10.1039/b007623f","","","0.71073","Mo-Kα","","0.121","0.073","","0.137","","0.107","","","1.348","","","1.04","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051042","8.8875","0.0009","11.9248","0.0012","26.99","0.003","91.405","0.011","94.482","0.011","99.522","0.011","2810.4","0.5","180","2","180","2","","","","","","","synthesized as described","5","P -1","-P 1","2","","","","- C60 H68 I2 N4 O11 -","- C60 H68 I2 N4 O11 -","- C120 H136 I4 N8 O22 -","2","1","","Lacroix, Pascal G.; Lepetit, Christine; Claude Daran, Jean","Switching nonlinear optical properties by proton transfer in hydrogen-bonded merocyanine dyes: a theoretical investigation at the semi-empirical level","New Journal of Chemistry","2001","25","3","451","","10.1039/b007726g","","","0.71073","MoKα","","","0.0282","","","","0.0329","","","","","","0.9349","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051043","13.1025","0.0001","13.5227","0.0001","16.4607","0.0001","94.579","0.001","102.822","0.001","105.621","0.001","2708.33","0.04","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H42 B4 F16 N10 Ru -","- C52 H42 B4 F16 N10 Ru -","- C104 H84 B8 F32 N20 Ru2 -","2","1","","Benniston, Andrew C.; Mackie, Philip R.; Farrugia, Louis J.; Smith, Graeme; Teat, Simon J.; McLean, Andrew J.","Detailed photophysical properties of a functionalized ruthenium(II) polypyridyl complex: through-space solvent effects","New Journal of Chemistry","2001","25","3","458","","10.1039/b007962f","","","0.6849","synchrotron","","0.0772","0.0595","","","0.1555","0.1643","","","","","","0.984","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051044","6.3652","0.0009","35.256","0.011","7.6591","0.0017","90","","108.033","0.017","90","","1634.4","0.7","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H26 F12 N6 P2 -","- C32 H26 F12 N6 P2 -","- C64 H52 F24 N12 P4 -","2","0.5","","Benniston, Andrew C.; Mackie, Philip R.; Farrugia, Louis J.; Smith, Graeme; Teat, Simon J.; McLean, Andrew J.","Detailed photophysical properties of a functionalized ruthenium(II) polypyridyl complex: through-space solvent effects","New Journal of Chemistry","2001","25","3","458","","10.1039/b007962f","","","0.6875","synchrotron","","0.173","0.0973","","","0.1556","0.1812","","","","","","1.068","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051045","7.4721","0.001","7.531","0.001","11.0761","0.0009","93.4149","0.0008","102.042","0.001","100.486","0.001","596.29","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H40 N6 Ni O4 -","- C16 H40 N6 Ni O4 -","- C16 H40 N6 Ni O4 -","1","0.5","","Rahaman Laskar, Inamur; Das, Debasis; Mostafa, Golam; Lu, Tian-Huey; Keng, Tai-Chiun; Wang, Ju-Chun; Ghosh, Ashutosh; Ray Chaudhuri, Nirmalendu","First report on thermally induced nitro→nitrito(O,O) linkage isomerization in diamine complexes of nickel(II) in the solid state: X-ray single crystal structural analyses of nitro and nitrito isomers","New Journal of Chemistry","2001","25","5","764","","10.1039/b008254f","","","0.71073","MoKα","","0.082","0.0803","","0.2157","0.2134","","","","1.094","1.115","1.115","","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051046","10.283","0.0009","19.467","0.002","12.124","0.002","90","","95.4","0.01","90","","2416.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 N6 Ni O4 -","- C16 H40 N6 Ni O4 -","- C64 H160 N24 Ni4 O16 -","4","1","","Rahaman Laskar, Inamur; Das, Debasis; Mostafa, Golam; Lu, Tian-Huey; Keng, Tai-Chiun; Wang, Ju-Chun; Ghosh, Ashutosh; Ray Chaudhuri, Nirmalendu","First report on thermally induced nitro→nitrito(O,O) linkage isomerization in diamine complexes of nickel(II) in the solid state: X-ray single crystal structural analyses of nitro and nitrito isomers","New Journal of Chemistry","2001","25","5","764","","10.1039/b008254f","","","0.71073","MoKα","","0.1082","0.0521","","0.1372","0.1086","","","","1.006","1.048","1.048","","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051047","10.3131","0.0007","19.2548","0.0012","12.0523","0.0008","90","","96.47","0.01","90","","2378.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 N6 Ni O4 -","- C16 H40 N6 Ni O4 -","- C64 H160 N24 Ni4 O16 -","4","1","","Rahaman Laskar, Inamur; Das, Debasis; Mostafa, Golam; Lu, Tian-Huey; Keng, Tai-Chiun; Wang, Ju-Chun; Ghosh, Ashutosh; Ray Chaudhuri, Nirmalendu","First report on thermally induced nitro→nitrito(O,O) linkage isomerization in diamine complexes of nickel(II) in the solid state: X-ray single crystal structural analyses of nitro and nitrito isomers","New Journal of Chemistry","2001","25","5","764","","10.1039/b008254f","","","0.71073","MoKα","","0.0423","0.0404","","0.1095","0.1069","","","","1.05","1.049","1.049","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051049","15.669","0.001","15.669","0.001","11.4392","0.0004","90","","90","","90","","2808.5","0.3","294","","294","","","","","","","","","3","P -4 21 c","P -4 2n","114","","","","- C60 H60 N4 -","- C60 H60 N4 -","- C120 H120 N8 -","2","0.25","","Cédric Klein; Ernest Graf; Mir Wais Hosseini; André De Cian","Design and structural analysis of interpenetrated 3-D co-ordination networks formed by self-assembly using tetrapyridinoocyclophane and silver cations","New J. Chem.","2001","25","2","207","209","10.1039/b008259g","","","0.71073","Mo-Kα","","0.15","0.084","","0.302","","0.119","","","2.938","","","1.128","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051050","24.4478","0.0004","24.4478","0.0004","68.74","0.001","90","","90","","90","","41085.5","1.1","173","","173","","","","","","","","","8","I 41/a c d :2","-I 4bd 2c","142","","","","- C36 H44 Ag Cl2 F6 N2 O5 P -","- C35.75 H30 Ag Cl2 F6 N2 O5 P -","- C1144 H960 Ag32 Cl64 F192 N64 O160 P32 -","32","1","","Cédric Klein; Ernest Graf; Mir Wais Hosseini; André De Cian","Design and structural analysis of interpenetrated 3-D co-ordination networks formed by self-assembly using tetrapyridinoocyclophane and silver cations","New J. Chem.","2001","25","2","207","209","10.1039/b008259g","","","0.71073","Mo-Kα","","0.291","0.134","","0.798","","0.173","","","25.92","","","1.179","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051057","13.612","0.002","15.789","0.004","10.172","0.004","100.5","0.03","102.23","0.02","97.16","0.02","2070.2","1.1","298.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H41.5 Ag3 Cl3 N8.5 O12 -","- C31 H40 Ag3 Cl3 N8.5 O12 -","- C62 H80 Ag6 Cl6 N17 O24 -","2","1","","Fei, Bao-Li; Sun, Wei-Yin; Okamura, Taka-aki; Tang, Wen-Xia; Ueyama, Norikazu","Synthesis and crystal structure of a luminescent infinite 2D brick-wall network with two- and three-coordinate silver(I) atoms and ligand-unsupported silver‒silver interactions","New Journal of Chemistry","2001","25","2","210","","10.1039/b008266j","","","0.7107","MoKα","","","0.0421","","","","0.1517","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051058","8.7139","0.0004","12.6362","0.0005","16.8896","0.0007","81.778","0.001","80.395","0.001","78.851","0.001","1787.22","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H29 Cl2 N7 O10 Ru -","- C36 H29 Cl2 N7 O10 Ru -","- C72 H58 Cl4 N14 O20 Ru2 -","2","1","","Rice, Craig R.; Guerrero, Ana; Bell, Zöe R.; Paul, Rowena L.; Motson, Graham R.; Jeffery, John C.; Ward, Michael D.","New hybrid ditopic ligands containing fused phenanthroline and crown ether units","New Journal of Chemistry","2001","25","2","185","","10.1039/b008378j","","","0.71073","MoKα","","0.0451","0.0356","","","0.0888","0.0932","","","","","","1.028","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051059","11.83","0.004","13.271","0.005","17.791","0.006","97.664","0.006","92.213","0.006","115.897","0.006","2475.4","1.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H46 Cl2 N10 O12 Ru -","- C47 H34 Cl2 N9 O12 Ru -","- C94 H68 Cl4 N18 O24 Ru2 -","2","1","","Rice, Craig R.; Guerrero, Ana; Bell, Zöe R.; Paul, Rowena L.; Motson, Graham R.; Jeffery, John C.; Ward, Michael D.","New hybrid ditopic ligands containing fused phenanthroline and crown ether units","New Journal of Chemistry","2001","25","2","185","","10.1039/b008378j","","","0.71073","MoKα","","0.1009","0.0525","","","0.1149","0.1252","","","","","","0.894","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051060","12.748","0.004","13.181","0.004","13.847","0.004","90","0.03","107.04","0.03","90","0.02","2224.6","1.2","173","2","173","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C44 H45 Cl2 F0 N7 Na0 O14 P0 Ru -","- C44 H45 Cl2 N7 O14 Ru -","- C88 H90 Cl4 N14 O28 Ru2 -","2","1","","Rice, Craig R.; Guerrero, Ana; Bell, Zöe R.; Paul, Rowena L.; Motson, Graham R.; Jeffery, John C.; Ward, Michael D.","New hybrid ditopic ligands containing fused phenanthroline and crown ether units","New Journal of Chemistry","2001","25","2","185","","10.1039/b008378j","","","0.71073","MoKα","","0.0795","0.055","","","0.1326","0.1469","","","","","","1.025","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051061","12.485","0.002","13.085","0.004","17.988","0.004","71.249","0.014","76.915","0.016","82.05","0.02","2703.6","1.1","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H50 Cl3 Li N10 O17 Ru -","- C48 H47 Cl3 Li N10 O17 Ru -","- C96 H94 Cl6 Li2 N20 O34 Ru2 -","2","1","","Rice, Craig R.; Guerrero, Ana; Bell, Zöe R.; Paul, Rowena L.; Motson, Graham R.; Jeffery, John C.; Ward, Michael D.","New hybrid ditopic ligands containing fused phenanthroline and crown ether units","New Journal of Chemistry","2001","25","2","185","","10.1039/b008378j","","","0.71073","MoKα","","0.0977","0.0633","","","0.1769","0.1932","","","","","","0.985","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051064","9.593","0.002","10.825","0.002","19.936","0.004","89.54","0.03","80.41","0.03","68.45","0.03","1895.4","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H30 Au2 P2 Se4 W -","- C36 H31 Au2 P2 Se4 W -","- C72 H62 Au4 P4 Se8 W2 -","2","1","","Zhang, Qian-Feng; Leung, Wa-Hung; Song, Ying-Lin; Hong, Mao-Chun; Kennard, Colin H. L.; Xin, Xin-Quan","Skeleton atomic effect on nonlinear optical properties of linear trinuclear heteroselenometallic compounds with univalent coinage metals","New Journal of Chemistry","2001","25","3","465","","10.1039/b008466m","","","0.71073","MoKα","","0.0713","0.0656","","0.1452","0.1213","","","","1.008","1.085","1.085","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051065","17.921","0.007","17.472","0.003","18.196","0.007","90","","95.86","0.02","90","","5668","3","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C54.5 H45 Ag2 Cl P3 Se4 W -","- C54.5 H45 Ag2 Cl P3 Se4 W -","- C218 H180 Ag8 Cl4 P12 Se16 W4 -","4","1","","Zhang, Qian-Feng; Leung, Wa-Hung; Song, Ying-Lin; Hong, Mao-Chun; Kennard, Colin H. L.; Xin, Xin-Quan","Skeleton atomic effect on nonlinear optical properties of linear trinuclear heteroselenometallic compounds with univalent coinage metals","New Journal of Chemistry","2001","25","3","465","","10.1039/b008466m","","","0.71069","MoKα","","0.0921","0.0507","","0.1614","0.112","","","","0.998","1.152","1.152","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051066","12.183","0.0006","12.955","0.0006","14.3375","0.0007","85.988","0.001","89.019","0.001","68.267","0.001","2096.81","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H51 N4 O24 P5 Zn4 -","- C16 H11 N4 O24 P5 Zn4 -","- C32 H22 N8 O48 P10 Zn8 -","2","1","","Ayi, Ayi A.; Choudhury, Amitava; Natarajan, Srinivasan; Rao, C. N. R.","Cyclic acetate dimers formed by C‒H···O hydrogen bonds in an open-framework zinc phosphate-acetate","New Journal of Chemistry","2001","25","2","213","","10.1039/b008498k","","","0.71073","MoKα","","0.0971","0.0661","","0.187","0.1684","","","","0.978","1.088","1.088","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051067","13.334","0.0012","5.8545","0.0005","21.617","0.002","90","","90.761","0.002","90","","1687.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 Cl N2 P -","- C18 H16 Cl N2 P -","- C72 H64 Cl4 N8 P4 -","4","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.71073","MoKα","","0.1537","0.0881","","0.3183","0.1656","","","","1.142","1.197","1.197","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051068","9.849","0.003","11.647","0.003","9.054","0.002","109.31","0.02","95.75","0.03","102.41","0.03","940.6","0.5","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H16 Au Cl2 N2 P -","- C18 H16 Au Cl2 N2 P -","- C36 H32 Au2 Cl4 N4 P2 -","2","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.7107","MoKα","","0.0258","0.0258","","0.0245","","0.0245","","","1.349","","","1.349","","","","has coordinates","191941","2020-10-21","18:00:00",""
"7051069","11.944","0.003","14.623","0.002","16.14","0.002","90","","91.36","0.02","90","","2818.1","0.9","293.2","","293.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 Cl2 N3 P Pd -","- C30 H28 Cl2 N3 P Pd -","- C120 H112 Cl8 N12 P4 Pd4 -","4","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.7107","MoKα","","0.0369","0.0369","","0.0481","","0.0481","","","1.438","","","1.438","","","","has coordinates","191941","2020-10-21","18:00:00",""
"7051070","9.226","0.002","12.365","0.006","8.559","0.004","98.9","0.04","107.85","0.02","106.17","0.03","861.3","0.6","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H16 Cl N2 O P -","- C18 H16 Cl N2 O P -","- C36 H32 Cl2 N4 O2 P2 -","2","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.7107","MoKα","","0.0342","0.0342","","0.0332","","0.0332","","","2.399","","","2.399","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051071","12.8214","0.0001","18.0482","0.0002","17.5951","0.0002","90","","93.954","0.0005","90","","4061.87","0.07","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C36 H32 B2 Cl2 F8 N4 P2 Pt -","- C36 H32 B2 Cl2 F8 N4 P2 Pt -","- C144 H128 B8 Cl8 F32 N16 P8 Pt4 -","4","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.71073","MoKα","","0.0534","0.043","","","0.1176","0.1251","","","","","","0.958","","","","has coordinates","191941","2020-10-21","18:00:00",""
"7051072","8.0095","0.0019","17.599","0.003","8.826","0.002","90","","105.42","0.03","90","","1199.3","0.5","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 N2 O2 -","- C15 H10 N2 O2 -","- C60 H40 N8 O8 -","4","1","","Eastmond, Geoffrey C.; Gilchrist, Thomas L.; Paprotny, Jerzy; Steiner, Alexander","Cyano-activated fluoro displacement reactions in the synthesis of cyanophenoxazines and related compounds","New Journal of Chemistry","2001","25","3","385","","10.1039/b008503k","","","0.71073","MoKα","","0.1225","0.0651","","","0.169","0.194","","","","","","0.918","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051073","8.6688","0.0013","9.4019","0.001","19.222","0.002","90","","90","","90","","1566.7","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H18 O2 -","- C20 H18 O2 -","- C80 H72 O8 -","4","1","","Eastmond, Geoffrey C.; Paprotny, Jerzy; Steiner, Alexander; Swanson, Linda","Synthesis of cyanodibenzo[1,4]dioxines and their derivatives by cyano-activated fluoro displacement reactions","New Journal of Chemistry","2001","25","3","379","","10.1039/b008508l","","","0.71073","MoKα","","0.0407","0.0322","","","0.0712","0.0735","","","","","","0.982","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051074","34.48","0.09","8.96","0.02","17.67","0.03","90","","96.82","0.09","90","","5420","2","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H36 F3 P2 Rh -","- C27 H36 F3 P2 Rh -","- C216 H288 F24 P16 Rh8 -","8","1","","Herber, Ulrich; Guerrero Sanchez, Rita; Gevert, Olaf; Laubender, Matthias; Werner, Helmut","PX3-induced migratory insertion reactions of half-sandwich-type carbenerhodium(I) complexes","New Journal of Chemistry","2001","25","3","396","","10.1039/b008601k","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051075","10.17","0.003","11.177","0.002","17.401","0.003","85.68","0.01","84.78","0.02","88.03","0.02","1963.4","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H51 O3 P2 Rh -","- C45 H51 O3 P2 Rh -","- C90 H102 O6 P4 Rh2 -","2","1","","Herber, Ulrich; Guerrero Sanchez, Rita; Gevert, Olaf; Laubender, Matthias; Werner, Helmut","PX3-induced migratory insertion reactions of half-sandwich-type carbenerhodium(I) complexes","New Journal of Chemistry","2001","25","3","396","","10.1039/b008601k","","","0.71073","MoKα","","0.1115","0.073","","0.1943","0.1633","","","","1.068","1.084","1.084","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051081","9.708","0.003","10.855","0.002","20.083","0.005","82.78","0.02","86.35","0.02","77.9","0.02","2051.4","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H50 Fe2 O6 P2 -","- C44 H50 Fe2 O6 P2 -","- C88 H100 Fe4 O12 P4 -","2","1","","Richard Frantz; Francis Carré; Jean-Olivier Durand; Gérard F. Lanneau","New phosphonates containing a π-conjugated ferrocenyl unit","New J. Chem.","2001","25","2","188","190","10.1039/b008937k","","","0.71069","MoKα","","0.0629","0.0421","","0.112","0.1094","","","","0.939","1.066","1.066","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051082","7.181","0.002","12.321","0.002","14.958","0.003","88.55","0.02","83.61","0.02","86.5","0.02","1312.5","0.5","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H72 Co3 Cu2 N4 O24 -","- C36 H66 Co3 Cu2 N4 O24 -","- C36 H66 Co3 Cu2 N4 O24 -","1","0.5","","Valeriya G. Makhankova; Olga Yu. Vassilyeva; Volodymyr N. Kokozay; Brian W. Skelton; Jan Reedijk; Gerard A. Van Albada; Lorenzo Sorace; Dante Gatteschi","A unique heteropentanuclear CuII2CoIICoIII2 complex, synthesised from metallic Cu and Co acetate in the presence of triethanolamine. Magnetic properties and a strong H-bond stabilised lattice","New J. Chem.","2001","25","5","685","689","10.1039/b009194o","","","0.71073","MoKα","","0.114","0.062","","0.076","","0.066","","","1.19","","","1.318","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051086","14.358","0.0007","14.358","0.0007","37.944","0.002","90","","90","","90","","7822.2","0.7","293","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C50 H37 Co O4 -","- C50 H37 Co O4 -","- C400 H296 Co8 O32 -","8","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.4191","0.0629","","","0.1486","0.2076","","","","","","0.644","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051087","13.2613","0.0004","13.2613","0.0004","33.4406","0.0015","90","","90","","90","","5880.9","0.4","293","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C40 H30 Co O3 -","- C40 H30 Co O3 -","- C320 H240 Co8 O24 -","8","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.1186","0.0331","","","0.0625","0.075","","","","","","0.812","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051088","10.4464","0.0016","14.85","0.002","15.985","0.002","68.894","0.005","80.311","0.005","87.814","0.005","2279.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C51.5 H41.5 Co N1.5 O7 -","- C51.5 H41.5 Co N1.5 O7 -","- C103 H83 Co2 N3 O14 -","2","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.3358","0.0763","","","0.1959","0.2554","","","","","","0.717","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051089","10.622","0.001","12.39","0.001","12.59","0.001","89.4","0.01","112.13","0.01","100.14","0.01","1508.1","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H27 Cs O4 -","- C40 H27 Cs O4 -","- C80 H54 Cs2 O8 -","2","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.0736","0.0475","","","0.134","0.1564","","","","","","0.889","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051090","10.682","0.001","12.214","0.001","12.668","0.001","90","0.01","112.6","0.01","100.03","0.01","1498.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H27 O4 Rb -","- C40 H27 O4 Rb -","- C80 H54 O8 Rb2 -","2","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.1121","0.0657","","","0.1712","0.1998","","","","","","1.032","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051091","23.255","0.003","11.484","0.002","6.936","0.009","90","","90","","90","","1852","2","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C12 H9 N O -","- C12 H9 N O -","- C96 H72 N8 O8 -","8","1","","Touzani, Rachid; Ben-Hadda, Taibi; Elkadiri, Sghir; Ramdani, Abdelkrim; Maury, Olivier; Le Bozec, Hubert; Toupet, Loic; Dixneuf, Pierre H.","Solution, solid state structure and fluorescence studies of 2,3-functionalized quinoxalines: evidence for a π-delocalized keto-enamine form with N‒H···O intramolecular hydrogen bonds","New Journal of Chemistry","2001","25","3","391","","10.1039/b009667i","","","0.71069","MoKα","","0.1056","0.0408","","","0.0957","0.1156","","","","","","0.999","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051092","11.008","0.003","18.305","0.003","10.524","0.006","90","","109.91","0.03","90","","1993.9","1.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C48 H48 N4 O4 -","- C48 H48 N4 O4 -","- C96 H96 N8 O8 -","2","1","","Touzani, Rachid; Ben-Hadda, Taibi; Elkadiri, Sghir; Ramdani, Abdelkrim; Maury, Olivier; Le Bozec, Hubert; Toupet, Loic; Dixneuf, Pierre H.","Solution, solid state structure and fluorescence studies of 2,3-functionalized quinoxalines: evidence for a π-delocalized keto-enamine form with N‒H···O intramolecular hydrogen bonds","New Journal of Chemistry","2001","25","3","391","","10.1039/b009667i","","","0.71069","MoKα","","0.2081","0.0511","","","0.104","0.1465","","","","","","0.905","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051093","8.3994","0.001","14.738","0.002","18.901","0.003","90","","99.35","0.01","90","","2308.7","0.6","293","2","193","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","tetrakis(octanoato O,O')bis(2-aminopyridine)dicopper(II)","","- C42 H72 Cu2 N4 O8 -","- C42 H72 Cu2 N4 O8 -","- C84 H144 Cu4 N8 O16 -","2","0.5","","Lah, Nina; Giester, Gerald; Lah, Jurij; Šegedin, Primož; Leban, Ivan","Copper(II) carboxylates with 2-aminopyridine. Synthesis, characterization and a study of the dimer‒monomer equilibrium in acetonitrile solutions by VIS-spectroscopic and microcalorimetric titrations","New Journal of Chemistry","2001","25","5","753","","10.1039/b009807h","","","0.71073","MoKα","","0.0787","0.0548","","","0.1494","0.1738","","","","","","0.909","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051094","8.427","0.002","25.312","0.005","13.734","0.003","90","","105.42","0.03","90","","2824.1","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(octanoato-O)bis(2-aminopyridine)copper(II)","","- C26 H42 Cu N4 O4 -","- C26 H42 Cu N4 O4 -","- C104 H168 Cu4 N16 O16 -","4","1","","Lah, Nina; Giester, Gerald; Lah, Jurij; Šegedin, Primož; Leban, Ivan","Copper(II) carboxylates with 2-aminopyridine. Synthesis, characterization and a study of the dimer‒monomer equilibrium in acetonitrile solutions by VIS-spectroscopic and microcalorimetric titrations","New Journal of Chemistry","2001","25","5","753","","10.1039/b009807h","","","0.71073","MoKα","","0.129","0.069","","","0.1312","0.1492","","","","","","1.024","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051095","17.676","0.006","18.784","0.008","22.185","0.011","90","","90","","90","","7366","5","200","2","200","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C31 H69 N5 P2 -","- C31 H69 N5 P2 -","- C248 H552 N40 P16 -","8","1","","Baceiredo, Antoine; Bertrand, Guy; Dyer, Philip W.; Fawcett, John; Griep-Raming, Nina; Guerret, Olivier; Hanton, Martin J.; Russell, David R.; Williamson, Anna-Maria","The 'one-pot' syntheses of α,α'-diphosphino-substituted imines: a unique reaction of bulky bis(dialkylamino)chlorophosphines","New Journal of Chemistry","2001","25","4","591","","10.1039/b009867l","","","0.71073","MoKα","","0.163","0.0776","","","0.1628","0.2","","","","","","0.983","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051099","13.342","0.002","16.113","0.002","25.563","0.002","80.02","0.01","77.7","0.01","69.65","0.01","5004.6","1.1","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C89 H111 N5 O3 Ru -","- C89 H111 N5 O3 Ru -","- C178 H222 N10 O6 Ru2 -","2","1","","Maiya, Bhaskar G.; Bampos, Nick; Asok Kumar, A.; Feeder, Neil; Sanders, Jeremy K. M.","A supramolecular array assembled via the complementary binding properties of ruthenium(II) and tin(IV) porphyrins","New Journal of Chemistry","2001","25","6","797","","10.1039/b010148f","","","0.71073","MoKα","","0.1153","0.0779","","","0.2352","0.264","","","","","","1.055","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7051103","9.0532","0.0004","18.5975","0.0009","13.4262","0.0008","90","","92.218","0.002","90","","2258.8","0.2","110","2","110","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C54 H52 N2 P2 S2 -","- C54 H52 N2 P2 S2 -","- C108 H104 N4 P4 S4 -","2","1","","Andrieu, Jacques; Camus, Jean-Michel; Poli, Rinaldo; Richard, Philippe","New chiral α-aminophosphine oxides and sulfides: an unprecedented rhodium-catalyzed ligand epimerization","New Journal of Chemistry","2001","25","8","1015","","10.1039/b100217l","","","0.71069","MoKα","","0.0689","0.0425","","","0.0753","0.0829","","","","","","0.992","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051104","5.804","0.001","16.911","0.003","23.518","0.006","90","","90","","90","","2308.3","0.8","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H26 N O P -","- C27 H26 N O P -","- C108 H104 N4 O4 P4 -","4","1","","Andrieu, Jacques; Camus, Jean-Michel; Poli, Rinaldo; Richard, Philippe","New chiral α-aminophosphine oxides and sulfides: an unprecedented rhodium-catalyzed ligand epimerization","New Journal of Chemistry","2001","25","8","1015","","10.1039/b100217l","","","0.71073","MoKα","","0.0409","0.0358","","","0.0858","0.0891","","","","","","1.045","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051105","8.023","0.0001","8.234","0.0001","33.321","0.0005","90","","90.401","0.0005","90","","2201.18","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H30 Cl2 N2 Ru -","- C23 H30 Cl2 N2 Ru -","- C92 H120 Cl8 N8 Ru4 -","4","1","","Bekir Çetinkaya; Serpil Demir; Ismail Özdemir; Loïc Toupet; David Sémeril; Christian Bruneau; Pierre H. Dixneuf","First ruthenium complexes with a chelating arene carbene ligand as catalytic precursors for alkene metathesis and cycloisomerisation","New J. Chem.","2001","25","4","519","521","10.1039/b100264n","","","0.71069","MoKα","","0.0381","0.0319","","","0.0907","0.0953","","","","","","1.04","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051106","11.6439","0.0001","12.7731","0.0002","15.5221","0.0003","81.983","0.001","71.16","","86.863","0.001","2163.43","0.06","293","2","","","","","","","","","","6","P 1","P 1","1","","","","- C77 H83 Cl16 Co N6 O8 -","- C77 H83 Cl16 Co N6 O8 -","- C77 H83 Cl16 Co N6 O8 -","1","1","","Jean-Pierre Simonato; Sabrina Chappellet; Jacques Pécaut; Paul Baret; Jean-Claude Marchon","Evaluation of cobalt(III) tetramethylchiroporphyrin as an analytical reagent for the determination of enantiomer composition of primary amines and aziridines by 1H NMR spectroscopy","New J. Chem.","2001","25","5","714","720","10.1039/b100268f","","","0.71073","MoKα","","0.0796","0.0632","","0.1702","0.1576","","","","0.995","1.053","1.053","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051107","11.8042","0.0001","11.8042","0.0001","38.5292","0.0001","90","","90","","120","","4649.37","0.06","193","2","","","","","","","","","","6","P 62 2 2","P 62 2 (0 0 4)","180","","","","- C56 H84 Cl Co N6 O12 -","- C56 H74 Cl Co N6 O12 -","- C168 H222 Cl3 Co3 N18 O36 -","3","0.25","","Jean-Pierre Simonato; Sabrina Chappellet; Jacques Pécaut; Paul Baret; Jean-Claude Marchon","Evaluation of cobalt(III) tetramethylchiroporphyrin as an analytical reagent for the determination of enantiomer composition of primary amines and aziridines by 1H NMR spectroscopy","New J. Chem.","2001","25","5","714","720","10.1039/b100268f","","","0.71073","MoKα","","0.0891","0.0684","","","0.1737","0.1857","","","","","","1.304","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051113","9.5318","0.0016","15.85","0.002","10.3573","0.0011","90","","110.16","","90","","1468.9","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,10-Dibromo-4,7-bis-(3-bromo-prop-1-ynyl)-4,7-bisbenzoyloxy-dodeca- 2,8-diyne","","- C30 H26 Br4 O2 -","- C30 H26 Br4 O2 -","- C60 H52 Br8 O4 -","2","0.5","","König, Burkhard; Pitsch, Wolfgang; Dix, Ina; Jones, Peter G.","Synthesis and structure of bicyclic enediynes via twofold carbenoid ring closure","New Journal of Chemistry","2001","25","7","912","916","10.1039/b101572a","","","0.71073","MoKα","","0.1093","0.047","","0.1061","0.0932","","","","0.903","1.1","1.1","","","","","has coordinates","210356","2020-10-21","18:00:00",""
"7051114","9.108","0.004","11.199","0.003","25.19","0.006","96.03","0.03","97.718","0.018","109.5","0.03","2369","1.4","143","2","143","2","","","","","","","","3","P -1","-P 1","2","","1,8-Dibenzoyloxy-bicyclo[6.6.4]octadeca-4,11-diene-2,6,9,13-tetrayne","","- C32 H26 O2 -","- C32 H26 O2 -","- C128 H104 O8 -","4","2","","König, Burkhard; Pitsch, Wolfgang; Dix, Ina; Jones, Peter G.","Synthesis and structure of bicyclic enediynes via twofold carbenoid ring closure","New Journal of Chemistry","2001","25","7","912","916","10.1039/b101572a","","","0.71073","MoKα","","0.1476","0.0612","","0.1446","0.1111","","","","1.018","1.137","1.137","","","","","has coordinates,has disorder","210356","2020-10-21","18:00:00",""
"7051115","11.7417","0.0002","15.7638","0.0002","16.3452","0.0002","61.8921","0.0003","88.7569","0.0008","78.1825","0.0009","2602.21","0.07","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H18 N2 -","- C14 H18 N2 -","- C112 H144 N16 -","8","4","","Trofimenko, Swiatoslaw; Rheingold, Arnold L.; Liable-Sands, Louise M.; María Claramunt, Rosa; López, Concepción; Dolores Santa María, María; Elguero, Jose","The molecular structure of 4-tert-butylpyrazoles in the solid state and in solution: an X-ray, NMR and calorimetric study of the buttressing effect of a 4-tert-butyl substituent","New Journal of Chemistry","2001","25","6","819","","10.1039/b101733k","","","0.71073","MoKα","","0.1115","0.0646","","","0.1678","0.2059","","","","","","1.065","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051116","18.9969","0.001","18.9969","0.001","13.3498","0.001","90","","90","","90","","4817.7","0.5","173","2","173","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C12 H22 N2 -","- C12 H22 N2 -","- C192 H352 N32 -","16","1","","Trofimenko, Swiatoslaw; Rheingold, Arnold L.; Liable-Sands, Louise M.; María Claramunt, Rosa; López, Concepción; Dolores Santa María, María; Elguero, Jose","The molecular structure of 4-tert-butylpyrazoles in the solid state and in solution: an X-ray, NMR and calorimetric study of the buttressing effect of a 4-tert-butyl substituent","New Journal of Chemistry","2001","25","6","819","","10.1039/b101733k","","","0.71073","MoKα","","0.1141","0.0609","","","0.1123","0.1388","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051117","12.7395","0.0004","28.0431","0.0007","12.2071","0.0003","90","","98.0824","0.0019","90","","4317.7","0.2","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C10 H18 N2 -","- C10 H18 N2 -","- C160 H288 N32 -","16","2","","Trofimenko, Swiatoslaw; Rheingold, Arnold L.; Liable-Sands, Louise M.; María Claramunt, Rosa; López, Concepción; Dolores Santa María, María; Elguero, Jose","The molecular structure of 4-tert-butylpyrazoles in the solid state and in solution: an X-ray, NMR and calorimetric study of the buttressing effect of a 4-tert-butyl substituent","New Journal of Chemistry","2001","25","6","819","","10.1039/b101733k","","","0.71073","MoKα","","0.1077","0.0685","","","0.1308","0.1522","","","","","","1.185","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051118","15.049","0.002","15.049","0.002","18.794","0.004","90","","90","","120","","3686.1","1","293","2","293","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C48 H126 Cr2 N30 Ni3 O24 -","- C48 H106.02 Cr2 N30 Ni3 O14 -","- C96 H212.04 Cr4 N60 Ni6 O28 -","2","0.166667","","Xiang, Hua; Gao, Song; Lu, Tong-Bu; Luck, Rudy L.; Mao, Zong-Wan; Chen, Xiao-Ming; Ji, Liang-Nian","[NiL1]3[Cr(CN)6]2·18H2O [L1=3,10-bis(2-hydroxyethyl)- 1,3,5,8,10,12-hexaazacyclotetradecane]: a two-dimensional bimetallic assembly exhibiting antiferromagnetic ordering and metamagnetic behavior","New Journal of Chemistry","2001","25","6","875","","10.1039/b101778k","","","0.71073","MoKα","","0.0748","0.0324","","","0.0859","0.1007","","","","","","1.004","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051119","15.004","0.004","10.412","0.004","16.228","0.002","90","","112.69","0.01","90","","2339","1.1","296","","296","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H33 Cl3 Cu2 N4 O3 Zn -","- C12 H33 Cl3 Cu2 N4 O3 Zn -","- C48 H132 Cl12 Cu8 N16 O12 Zn4 -","4","1","","Elena A. Vinogradova; Olga Yu. Vassilyeva; Volodymyr N. Kokozay; Philip J. Squattrito; Jan Reedijk; Gerard A. Van Albada; Wolfgang Linert; Satish K. Tiwary; Paul R. Raithby","Symmetric and asymmetric trinuclear cores in novel μ-alkoxo-bridged mixed-metal CuII2ZnII complexes: synthesis from zerovalent copper and zinc oxide, structure and magnetism","New J. Chem.","2001","25","7","949","953","10.1039/b101883n","","","0.7107","MoKα","","","0.032","","","","0.031","","","","","","1.68","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051120","15.214","0.003","10.478","0.002","16.526","0.003","90","","113.69","0.03","90","","2412.4","1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H33 Br3 Cu2 N4 O3 Zn -","- C12 H33 Br3 Cu2 N4 O3 Zn -","- C48 H132 Br12 Cu8 N16 O12 Zn4 -","4","1","","Elena A. Vinogradova; Olga Yu. Vassilyeva; Volodymyr N. Kokozay; Philip J. Squattrito; Jan Reedijk; Gerard A. Van Albada; Wolfgang Linert; Satish K. Tiwary; Paul R. Raithby","Symmetric and asymmetric trinuclear cores in novel μ-alkoxo-bridged mixed-metal CuII2ZnII complexes: synthesis from zerovalent copper and zinc oxide, structure and magnetism","New J. Chem.","2001","25","7","949","953","10.1039/b101883n","","","0.71073","MoKα","","0.1024","0.0679","","0.1966","0.1665","","","","1.013","1.07","1.07","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051121","14.288","0.003","19.827","0.004","10.079","0.002","90","","90","","90","","2855.3","1","180","2","180","2","","","","","","","","7","C m c 21","C 2c -2","36","","","","- C17 H33 Cu2 N7 O3 S3 Zn -","- C17 H33 Cu2 N7 O3 S3 Zn -","- C68 H132 Cu8 N28 O12 S12 Zn4 -","4","0.5","","Elena A. Vinogradova; Olga Yu. Vassilyeva; Volodymyr N. Kokozay; Philip J. Squattrito; Jan Reedijk; Gerard A. Van Albada; Wolfgang Linert; Satish K. Tiwary; Paul R. Raithby","Symmetric and asymmetric trinuclear cores in novel μ-alkoxo-bridged mixed-metal CuII2ZnII complexes: synthesis from zerovalent copper and zinc oxide, structure and magnetism","New J. Chem.","2001","25","7","949","953","10.1039/b101883n","","","0.71073","MoKα","","0.1166","0.0635","","","0.1096","0.1311","","","","","","1.005","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051122","7.1504","0.0001","13.5269","0.0002","13.5587","0.0002","63.756","0.001","80.888","0.001","81.243","0.001","1156.39","0.03","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Trimesic acid. phloroglucinol","","","- C24 H18 O15 -","- C24 H18 O15 -","- C48 H36 O30 -","2","1","","Liu, Rong; Mok, Kum-Fun; Valiyaveettil, Suresh","Solid-state self-assembly of a complex from 1,3,5-benzenetricarboxylic acid and 1,3,5-trihydroxybenzene: influence of strong O‒H···O and C‒H···O hydrogen bonds","New Journal of Chemistry","2001","25","7","890","","10.1039/b102098f","","","0.71073","MoKα","","0.0447","0.0368","","","0.1069","0.1112","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051128","12.374","0.002","10.334","0.002","9.428","0.002","90","","92.83","0.03","90","","1204.1","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","C6 H17 N O6 P2, H2 O","N-n-pentylaminomethane-1.1-diphosphonic acid","","- C6 H19 N O7 P2 -","- C6 H19 N O7 P2 -","- C24 H76 N4 O28 P8 -","4","1","","Ewa Matczak-Jon; Wanda Sawka-Dobrowolska; Paweł Kafarski; Veneta Videnova-Adrabińska","Molecular organization and solution properties of N-substituted aminomethane-1,1-diphosphonic acids","New J. Chem.","2001","25","11","1447","1457","10.1039/b102282m","","","0.71073","MoKα","","0.0731","0.0363","","","0.0596","0.0678","","","","","","0.885","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051129","7.167","0.001","7.535","0.001","10.052","0.002","98.14","0.01","99.1","0.01","99.59","0.01","520.6","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","C5 H13 N O6 P2, H2 O","N-pyrrolidinemethane-1,1-diphosphonic acid","","- C5 H15 N O7 P2 -","- C5 H15 N O7 P2 -","- C10 H30 N2 O14 P4 -","2","1","","Ewa Matczak-Jon; Wanda Sawka-Dobrowolska; Paweł Kafarski; Veneta Videnova-Adrabińska","Molecular organization and solution properties of N-substituted aminomethane-1,1-diphosphonic acids","New J. Chem.","2001","25","11","1447","1457","10.1039/b102282m","","","0.71073","MoKα","","0.0374","0.0341","","","0.0909","0.0928","","","","","","1.082","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051130","11.128","0.002","8.248","0.002","13.527","0.003","90","","101.97","0.03","90","","1214.6","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(3-carboxy-2-pyridyl)aminomethane-1,1-diphosphonic acid","","- C7 H12 N2 O9 P2 -","- C7 H12 N2 O9 P2 -","- C28 H48 N8 O36 P8 -","4","1","","Ewa Matczak-Jon; Wanda Sawka-Dobrowolska; Paweł Kafarski; Veneta Videnova-Adrabińska","Molecular organization and solution properties of N-substituted aminomethane-1,1-diphosphonic acids","New J. Chem.","2001","25","11","1447","1457","10.1039/b102282m","","","0.71073","MoKα","","0.0685","0.0438","","","0.0925","0.0983","","","","","","1.082","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051131","7.313","0.001","15.94","0.003","9.421","0.002","90","","97.49","0.03","90","","1088.8","0.4","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","N-(5-methyl-2-pyridyl)aminomethane-1,1-diphosphonic acid","","- C7 H12 N2 O6 P2 -","- C7 H12 N2 O6 P2 -","- C28 H48 N8 O24 P8 -","4","2","","Ewa Matczak-Jon; Wanda Sawka-Dobrowolska; Paweł Kafarski; Veneta Videnova-Adrabińska","Molecular organization and solution properties of N-substituted aminomethane-1,1-diphosphonic acids","New J. Chem.","2001","25","11","1447","1457","10.1039/b102282m","","","0.71073","MoKα","","0.0909","0.089","","","0.2504","0.25","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051135","7.729","0.008","10.712","0.002","13.985","0.004","90","","101.65","0.04","90","","1134","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H9 Cl N4 O Pd -","- C9 H9 Cl N4 O Pd -","- C36 H36 Cl4 N16 O4 Pd4 -","4","1","","José Elguero; Ana Guerrero; Felipe Gómez de la Torre; Antonio de la Hoz; Félix A. Jalón; Blanca R. Manzano; Ana Rodríguez","New complexes with pyrazole-containing ligands and different metallic centres. Comparative study of their fluxional behaviour involving M‒N bond rupture","New J. Chem.","2001","25","8","1050","1060","10.1039/b102318g","","","0.71073","MoKα","","0.0819","0.0435","","","0.1026","0.1199","","","","","","0.883","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051136","7.623","0.004","10.1347","0.0008","11.927","0.001","66.511","0.008","79.73","0.02","81.53","0.02","828.6","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H11 F3 N4 O3 Pd S -","- C12 H11 F3 N4 O3 Pd S -","- C24 H22 F6 N8 O6 Pd2 S2 -","2","1","","José Elguero; Ana Guerrero; Felipe Gómez de la Torre; Antonio de la Hoz; Félix A. Jalón; Blanca R. Manzano; Ana Rodríguez","New complexes with pyrazole-containing ligands and different metallic centres. Comparative study of their fluxional behaviour involving M‒N bond rupture","New J. Chem.","2001","25","8","1050","1060","10.1039/b102318g","","","0.7107","MoKα","","0.0768","0.0595","","","0.1762","0.2064","","","","","","1.011","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051137","10.075","0.001","9.034","0.002","22.973","0.007","90","","92.7","0.02","90","","2088.6","0.8","296","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H9 Co Mo O10 Ru S -","- C16 H9 Co Mo O10 Ru S -","- C64 H36 Co4 Mo4 O40 Ru4 S4 -","4","1","","Zhang Yu-hua; Yuan Jian-chao; Yin Yuan-qi; Zhou Zhong-yuan; Albert S. C. Chan","Synthesis and reactions of chiral clusters containing an SRuCoMo core","New J. Chem.","2001","25","7","939","944","10.1039/b102368n","","","0.71073","MoKα","","","0.03","","","0.042","","","","","1.23","1.23","","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7051138","7.67","0.003","22.001","0.01","13.392","0.006","90","","92.23","0.009","90","","2258.2","1.7","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H11 Co Mo O11 Ru S -","- C18 H11 Co Mo O11 Ru S -","- C72 H44 Co4 Mo4 O44 Ru4 S4 -","4","1","","Zhang Yu-hua; Yuan Jian-chao; Yin Yuan-qi; Zhou Zhong-yuan; Albert S. C. Chan","Synthesis and reactions of chiral clusters containing an SRuCoMo core","New J. Chem.","2001","25","7","939","944","10.1039/b102368n","","","0.71073","MoKα","","0.088","0.0594","","","0.1462","0.1659","","","","","","0.955","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051139","7.43","0.003","14.002","0.005","15.206","0.006","114.78","0.02","80.67","0.03","98.49","0.03","1411.7","1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H27 B Cu F4 N4 O P -","- C30 H27 B Cu F4 N4 O P -","- C60 H54 B2 Cu2 F8 N8 O2 P2 -","2","1","","Douce, Laurent; Charbonnière, Loïc; Cesario, Michèle; Ziessel, Raymond","Phosphine oxide functionalised with two bipyridine subunits: a novel ligand for the engineering of sterically hindered complexes","New Journal of Chemistry","2001","25","8","1024","","10.1039/b102520c","","","0.7107","MoKα","","0.1109","0.0683","","0.1953","","0.1668","","","1.033","","","1.112","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051140","10.3346","0.0003","10.5105","0.0003","17.3351","0.0004","90","","90","","90","","1882.97","0.09","173","0.1","173","0.1","","","","","","","","3","P n c a","-P 2a 2n","60","","","","- C23 H22 S2 -","- C23 H22 S2 -","- C92 H88 S8 -","4","0.5","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0434","0.0374","","","0.0979","0.1026","","","","","","1.057","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051141","10.9684","0.0007","10.2645","0.0006","16.6081","0.001","90","","91.0448","0.0031","90","","1869.5","0.2","173","0.1","173","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 S2 -","- C23 H22 S2 -","- C92 H88 S8 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0869","0.0633","","","0.1246","0.1311","","","","","","1.228","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051142","10.2631","0.0008","10.4883","0.0005","15.9213","0.0012","90","","90","","90","","1713.8","0.2","173","0.1","173","0.1","","","","","","","","2","P 21 n b","P -2bc 2a","33","","","","- C23 H22 -","- C23 H22 -","- C92 H88 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0494","0.0371","","","0.0657","0.0688","","","","","","1.085","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051143","9.669","0.0006","9.669","0.0006","18.4244","0.0009","90","","90","","90","","1722.49","0.17","173","0.1","173","0.1","","","","","","","","2","P 41","P 4w","76","","","","- C23 H22 -","- C23 H22 -","- C92 H88 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0486","0.0386","","","0.0785","0.0818","","","","","","1.08","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051144","11.7142","0.0006","13.7436","0.0005","13.8602","0.0006","90","","90","","90","","2231.43","0.17","173","0.1","173","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H22 Ag F3 O3 S -","- C24 H22 Ag F3 O3 S -","- C96 H88 Ag4 F12 O12 S4 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0588","0.0435","","","0.0633","0.0658","","","","","","1.095","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051145","10.8557","0.0003","55.1676","0.0018","15.8584","0.0004","90","","90.312","0.0012","90","","9497.2","0.5","173","0.1","173","0.1","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C99 H88 Ag4 F12 O13 S4 -","- C99 H88 Ag4 F12 O13 S4 -","- C396 H352 Ag16 F48 O52 S16 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0691","0.0618","","","0.1559","0.1617","","","","","","1.027","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051146","8.6112","0.0003","8.8243","0.0003","9.2589","0.0003","75.17","0.002","71.033","0.003","63.78","0.002","591.64","0.04","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H11 N S Se -","- C13 H11 N S Se -","- C26 H22 N2 S2 Se2 -","2","1","","Boryczka, Stanisław; Rozenberg, Mark S.; Schreurs, Antoine M. M.; Kroon, Jan; Starikov, Evgeni B.; Steiner, Thomas","A short C‒H···N hydrogen bond with a very strong IR spectroscopic effect","New Journal of Chemistry","2001","25","9","1111","","10.1039/b102727c","","","0.71073","MoKα","","0.0471","0.0407","","","0.1047","0.1089","","","","","","1.029","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051149","14.5678","0.0004","21.2602","0.0001","7.8893","0.0002","90","","90","","90","","2443.43","0.09","293","2","293","2","","","","","","","","6","F m m 2","F 2 -2","42","","","","- Cd Cl0.75 H2.5 Na0.75 O6 P1.5 -","- Cd Cl0.75 H2.5 Na0.75 O6 P1.5 -","- Cd16 Cl12 H40 Na12 O96 P24 -","16","1","","Jayaraman, Krishnamoorthy; Choudhury, Amitava; Vaidhyanathan, Ramanathan; Rao, C. N. R.","A layered chlorophosphate, Na3[Cd4Cl3(HPO4)2(H2PO4)4], containing Na+ ions in the interlamellar space","New Journal of Chemistry","2001","25","9","1199","","10.1039/b103278j","","","0.71073","MoKα","","0.0216","0.0199","","0.045","0.0444","","","","1.027","1.037","1.037","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051154","9.738","0.001","18.582","0.002","12.564","0.001","90","","98.84","0.02","90","","2246.5","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 N O3 P2 S -","- C24 H21 N O3 P2 S -","- C96 H84 N4 O12 P8 S4 -","4","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0933","0.0475","","","0.0907","0.1173","","","","","","1.235","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051155","9.745","0.002","18.799","0.004","12.423","0.002","90","","98.21","0.03","90","","2252.5","0.8","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 N O3 P2 Se -","- C24 H21 N O3 P2 Se -","- C96 H84 N4 O12 P8 Se4 -","4","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.112","0.0571","","","0.1239","0.1714","","","","","","1.111","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051156","18.491","0.004","23.2","0.005","9.642","0.002","90","","98.59","0.03","90","","4089.9","1.5","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H25 N O3 P2 Se -","- C18 H25 N O3 P2 Se -","- C144 H200 N8 O24 P16 Se8 -","8","2","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0472","0.034","","","0.0857","0.0895","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051157","23.236","0.005","9.654","0.002","22.026","0.004","90","","108.97","0.03","90","","4672.5","1.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H21 N O2 P2 S Se -","- C24 H21 N O2 P2 S Se -","- C192 H168 N8 O16 P16 S8 Se8 -","8","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0492","0.0342","","","0.0939","0.1014","","","","","","1.015","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051158","23.166","0.005","9.633","0.002","22.06","0.004","90","","109.23","0.03","90","","4648.2","1.8","130","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H21 N O2 P2 S2 -","- C24 H21 N O2 P2 S2 -","- C192 H168 N8 O16 P16 S16 -","8","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.043","0.0332","","","0.0936","0.0993","","","","","","1.066","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051159","8.494","0.002","9.173","0.002","13.751","0.003","97.97","0.03","104.38","0.03","92.35","0.03","1024.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H25 N O2 P2 S2 -","- C18 H25 N O2 P2 S2 -","- C36 H50 N2 O4 P4 S4 -","2","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.1081","0.0771","","","0.1908","0.2127","","","","","","1.089","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051160","10.154","0.002","17.574","0.004","22.213","0.004","90","","90","","90","","3963.8","1.4","150","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 N P2 S2 -","- C18 H25 N P2 S2 -","- C144 H200 N8 P16 S16 -","8","2","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0324","0.0275","","","0.0737","0.0763","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051161","9.974","0.002","13.675","0.003","15.078","0.003","76.93","0.03","70.93","0.03","68.82","0.03","1798.7","0.8","120","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H16 N O3 P S -","- C19 H16 N O3 P S -","- C76 H64 N4 O12 P4 S4 -","4","2","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0523","0.0334","","","0.078","0.0817","","","","","","0.963","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051162","10.678","0.002","9.294","0.002","23.112","0.005","90","","99.24","0.03","90","","2263.9","0.8","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 N O3 P2 Pd0.5 S -","- C24 H20 N O3 P2 Pd0.5 S -","- C96 H80 N4 O12 P8 Pd2 S4 -","4","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0315","0.0249","","","0.0638","0.065","","","","","","1.065","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051163","11.605","0.002","12.181","0.002","15.93","0.003","110.77","0.03","91.19","0.03","106.59","0.03","1999.1","0.9","130","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H48 N2 O6 P4 Pd S2 -","- C36 H48 N2 O6 P4 Pd S2 -","- C72 H96 N4 O12 P8 Pd2 S4 -","2","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.1212","0.0422","","","0.103","0.122","","","","","","0.982","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051164","10.698","0.002","10.89","0.002","11.22","0.002","108.78","0.03","105.07","0.03","95.4","0.03","1172.2","0.5","130","2","130","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H20 N O2 P2 Pd0.5 S2 -","- C24 H20 N O2 P2 Pd0.5 S2 -","- C48 H40 N2 O4 P4 Pd S4 -","2","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0641","0.0448","","","0.1172","0.1255","","","","","","1.012","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051165","10.829","0.002","22.4","0.004","10.007","0.002","90","","98.22","0.03","90","","2402.5","0.8","130","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C24 H21 N O5 P2 S -","- C24 H21 N O5 P2 S -","- C96 H84 N4 O20 P8 S4 -","4","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0441","0.0332","","","0.0853","0.089","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051166","8.776","0.011","10.233","0.016","18.853","0.024","90","","90","","90","","1693","4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","13-isopropyl-7-oxo-podocarpe-5,8,11,13-tetraen-4,6-carbolactone 12","","- C20 H22 O3 -","- C20 H22 O3 -","- C80 H88 O12 -","4","1","","Silvia M. C. S. Monteiro; Armando J. D. Silvestre; Artur M. S. Silva; José A. S. Cavaleiro; Vitor Félix; Michael G. B. Drew","Synthesis and structural characterisation of ring B oxidised derivatives of dehydroabietic acid","New J. Chem.","2001","25","8","1091","1097","10.1039/b103737b","","","0.71073","MoKα","","0.1163","0.0828","","","0.2126","0.2296","","","","","","1.155","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051171","8.162","0.001","14.249","0.001","13.862","0.001","90","","94.77","0.02","90","","1606.6","0.3","295","1","295","1","","","","","","","ethanolic synthesis","5","C 1 2/c 1","-C 2yc","15","","bis(pyridinium) tetrabromocuprate(II)","","- C10 H12 Br4 Cu N2 -","- C10 H12 Br4 Cu N2 -","- C40 H48 Br16 Cu4 N8 -","4","0.5","","Luque, Antonio; Sertucha, Jon; Castillo, Oscar; Román, Pascual","Crystal packing and physical properties of pyridinium tetrabromocuprate(II) complexes assembled via hydrogen bonds and aromatic stacking interactions","New Journal of Chemistry","2001","25","9","1208","","10.1039/b104085p","","","0.71069","MoKα","","0.071","0.043","","0.097","","0.05","","","1.43","","","1.19","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051172","18.789","0.003","8.744","0.002","15.518","0.003","90","","135.15","0.03","90","","1798","1.1","295","1","295","1","","","","","","","ethanolic synthesis","5","C 1 2/c 1","-C 2yc","15","","bis(2-methylpyridinium) tetrabromocuprate(II)","","- C12 H16 Br4 Cu N2 -","- C12 H16 Br4 Cu N2 -","- C48 H64 Br16 Cu4 N8 -","4","0.5","","Luque, Antonio; Sertucha, Jon; Castillo, Oscar; Román, Pascual","Crystal packing and physical properties of pyridinium tetrabromocuprate(II) complexes assembled via hydrogen bonds and aromatic stacking interactions","New Journal of Chemistry","2001","25","9","1208","","10.1039/b104085p","","","0.71069","MoKα","","0.071","0.042","","0.101","","0.045","","","1.48","","","1.11","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051173","9.165","0.001","13.592","0.002","14.404","0.003","90","","102.41","0.02","90","","1752.4","0.5","295","1","295","1","","","","","","","ethanolic synthesis","5","P 1 21/n 1","-P 2yn","14","","bis(3-methylpyridinium) tetrabromocuprate(II)","","- C12 H16 Br4 Cu N2 -","- C12 H16 Br4 Cu N2 -","- C48 H64 Br16 Cu4 N8 -","4","1","","Luque, Antonio; Sertucha, Jon; Castillo, Oscar; Román, Pascual","Crystal packing and physical properties of pyridinium tetrabromocuprate(II) complexes assembled via hydrogen bonds and aromatic stacking interactions","New Journal of Chemistry","2001","25","9","1208","","10.1039/b104085p","","","0.71069","MoKα","","0.081","0.04","","0.077","","0.04","","","1.43","","","1.16","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051174","8.483","0.002","9.399","0.002","13.227","0.002","96.29","0.03","91.29","0.03","116.41","0.02","935.8","0.4","295","1","295","1","","","","","","","ethanolic synthesis","5","P -1","-P 1","2","","bis(4-methylpyridinium) tetrabromocuprate(II)","","- C12 H16 Br4 Cu N2 -","- C12 H16 Br4 Cu N2 -","- C24 H32 Br8 Cu2 N4 -","2","1","","Luque, Antonio; Sertucha, Jon; Castillo, Oscar; Román, Pascual","Crystal packing and physical properties of pyridinium tetrabromocuprate(II) complexes assembled via hydrogen bonds and aromatic stacking interactions","New Journal of Chemistry","2001","25","9","1208","","10.1039/b104085p","","","0.71069","MoKα","","0.087","0.045","","0.101","","0.045","","","1.54","","","1.2","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051175","13.0469","0.0014","14.126","0.0016","14.2105","0.0016","90","","91.11","0.002","90","","2618.5","0.5","293","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C12 H42 Co10 N8 O43 P10 -","- C12 H48 Co10 N8 O43 P10 -","- C24 H96 Co20 N16 O86 P20 -","2","1","","Yanxiong Ke; Gaofei He; Jianmin Li; Yugen Zhang; Sheming Lu","A new mixed divalent metal phosphate with zeolite thomsonite framework topology","New J. Chem.","2001","25","12","1627","1630","10.1039/b104331p","","","0.71073","MoKα","","0.0496","0.043","","","0.1017","0.1038","","","","","","1","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051181","9.497","0.006","9.41","0.002","18.232","0.008","90","","100.01","0.03","90","","1604.5","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H21 Cu N5 O4 -","- C13 H21 Cu N5 O4 -","- C52 H84 Cu4 N20 O16 -","4","1","","Sarathi Mukherjee, Partha; Dalai, Sudipta; Mostafa, Golam; Lu, Tian-Huey; Rentschler, Eva; Ray Chaudhuri, Nirmalendu","Synthesis, crystal structure, and magnetic properties of two new Cu(II) complexes with end-to-end azido bridging ligands","New Journal of Chemistry","2001","25","9","1203","","10.1039/b104596m","","","0.71069","MoKα","","0.1381","0.0422","","","0.1128","0.1857","","","","","","1.009","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051182","9.0852","0.001","16.2398","0.0018","10.8913","0.0012","90","","96.881","0.002","90","","1595.3","0.3","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H17 Cl Cu N6 O4 -","- C11 H17 Cl Cu N6 O4 -","- C44 H68 Cl4 Cu4 N24 O16 -","4","1","","Sarathi Mukherjee, Partha; Dalai, Sudipta; Mostafa, Golam; Lu, Tian-Huey; Rentschler, Eva; Ray Chaudhuri, Nirmalendu","Synthesis, crystal structure, and magnetic properties of two new Cu(II) complexes with end-to-end azido bridging ligands","New Journal of Chemistry","2001","25","9","1203","","10.1039/b104596m","","","0.71073","MoKα","","0.0666","0.0434","","","0.1089","0.1161","","","","","","1.068","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051183","6.9395","0.0014","7.6083","0.0015","12.502","0.003","104.45","0.03","93.03","0.03","95.46","0.03","634.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","(CN)EDT-TTF","4-cyano-4',5'-ethylendithio-tetrathiafulvalene","","- C9 H5 N S6 -","- C9 H5 N S6 -","- C18 H10 N2 S12 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0828","0.0559","","","0.1283","0.134","","","","","","1.274","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051184","7.9359","0.0016","9.4229","0.0019","11.957","0.002","99.04","0.03","94.56","0.03","103.7","0.03","851.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(EDT-TTF-CN), (I3)","Bis (3-cyano -3',4'-ethylenedithiotetrathiafulvalene, triiodide)","","- C9 H5 I3 N S6 -","- C9 H5 I3 N S6 -","- C18 H10 I6 N2 S12 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0538","0.0254","","","0.045","0.0505","","","","","","0.718","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051185","8.0545","0.0016","8.0611","0.0016","23.587","0.005","86.78","0.03","86.82","0.03","76.11","0.03","1482.9","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(EDT-TTF-CN)2, (I3)","Bis(3-cyano -3',4'-ethylenedithiotetrathiafulvalene), triiodide","","- C18 H10 I3 N2 S12 -","- C18 I3 N2 S12 -","- C36 I6 N4 S24 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0814","0.0359","","","0.1058","0.1326","","","","","","0.697","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051186","6.399","0.0013","28.687","0.006","11.222","0.002","90","","106.13","0.03","90","","1978.9","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(EDT-TTF-CN), InBr4","3-cyano -3',4'-ethylenedithiotetrathiafulvalene, tetrabromoindate (III)","","- C9 H5 Br4 In N S6 -","- C9 H5 Br4 In N S6 -","- C36 H20 Br16 In4 N4 S24 -","4","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0508","0.0276","","","0.0577","0.0611","","","","","","0.771","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051187","6.293","0.0013","28.506","0.006","11.126","0.002","90","","106.52","0.03","90","","1913.5","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","EDT-TTF-CN, FeBr4","3-cyano -3',4'-ethylenedithiotetrathiafulvalene, tetrabromoferrate (III)","","- C9 H5 Br4 Fe N S6 -","- C9 H5 Br4 Fe N S6 -","- C36 H20 Br16 Fe4 N4 S24 -","4","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.1397","0.0486","","","0.0938","0.1043","","","","","","1.637","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051188","7.7596","0.0016","8.325","0.0017","16.245","0.003","93.98","0.03","93.63","0.03","114.98","0.03","944","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","EDT-TTF-CN, AuBr4","3-cyano -3',4'-ethylenedithiotetrathiafulvalene, tetrabromoaurate (III)","","- C9 H5 Au Br4 N S6 -","- C9 H Au Br4 N S6 -","- C18 H2 Au2 Br8 N2 S12 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0648","0.0445","","","0.1089","0.1139","","","","","","0.931","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051189","10.191","0.002","11.443","0.002","13.372","0.003","102.05","0.03","103.82","0.03","93.63","0.03","1470.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(EDT-TTF-CN)2, Mo6Br14, (CH3CN)4","Bis (3-cyano -3',4'-ethylenedithiotetrathiafulvalene), hexabromo-octa-mu3-bromohexamolybdate (II), acetonitrile solvate","","- C26 H22 Br14 Mo6 N6 S12 -","- C26 H14 Br14 Mo6 N6 S12 -","- C26 H14 Br14 Mo6 N6 S12 -","1","0.5","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0655","0.0273","","","0.0453","0.0511","","","","","","0.709","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051190","9.9799","0.001","11.3713","0.001","13.3427","0.001","101.938","0.01","104.094","0.01","93.366","0.01","1427.3","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","(EDT-TTF-CN)2, Mo6Cl8Br6, (CH3CN)4","Bis (3-cyano -3',4'-ethylenedithiotetrathiafulvalene), hexabromo-octa-mu3-chlorohexamolybdate (II), acetonitrile solvate","","- C13 H11 Br3 Cl4 Mo3 N3 S6 -","- C13 H7 Br3 Cl4 Mo3 N3 S6 -","- C26 H14 Br6 Cl8 Mo6 N6 S12 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.1705","0.0622","","","0.1788","0.2044","","","","","","1.163","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051192","22.273","0.0011","23.3463","0.0012","7.1583","0.0002","90","","93.96","0.003","90","","3713.4","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H64 Cu2 N24 O4 -","- C56 H64 Cu2 N24 O4.008 -","- C112 H128 Cu4 N48 O8.016 -","2","0.25","","Iwayan Dasna; Stéphane Golhen; Lahcène Ouahab; Nathalie Daro; Jean-Pascal Sutter","Synthesis, X-ray crystal structures and magnetic properties of CuII and MnII complexes containing imino nitroxide radicals and a dicyanamide anion","New J. Chem.","2001","25","12","1572","1576","10.1039/b104773f","","","0.71073","MoKα","","0.0805","0.0594","","","0.1931","0.2081","","","","","","1.056","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051193","7.1089","0.0002","9.9495","0.0003","13.2518","0.0006","69.3961","0.0014","88.9996","0.0014","71.461","0.002","827.1","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H36 Mn N12 O4 -","- C28 H32 Mn N12 O4.07 -","- C28 H32 Mn N12 O4.07 -","1","0.5","","Iwayan Dasna; Stéphane Golhen; Lahcène Ouahab; Nathalie Daro; Jean-Pascal Sutter","Synthesis, X-ray crystal structures and magnetic properties of CuII and MnII complexes containing imino nitroxide radicals and a dicyanamide anion","New J. Chem.","2001","25","12","1572","1576","10.1039/b104773f","","","0.71073","MoKα","","0.0672","0.0462","","","0.1201","0.1378","","","","","","1.029","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051194","10.724","0.001","11.0215","0.0006","12.758","0.001","73.832","0.005","73.892","0.004","71.608","0.004","1344.24","0.18","296","1","296","1","","","","","","","","9","P -1","-P 1","2","","","","- C50 H40 Cl6 Fe2 N2 Ni O4 P2 S2 -","- C50 H40 Cl6 Fe2 N2 Ni O4 P2 S2 -","- C50 H40 Cl6 Fe2 N2 Ni O4 P2 S2 -","1","0.5","","Pinkas, Jiří; Bastl, Zdeněk; Šlouf, Miroslav; Podlaha, Jaroslav; Štěpnička, Petr","Preparation and solid-state characterization of nickel(II) complexes with 1'-(diphenylphosphino)ferrocenecarboxylic acid","New Journal of Chemistry","2001","25","9","1215","","10.1039/b104780a","","","0.71073","MoKα","","0.1196","0.0679","","","0.1645","0.192","","","","","","1.05","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7051195","13.272","0.003","15.701","0.003","16.934","0.003","107","0.03","110.32","0.03","98.76","0.03","3035.2","1.6","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C63 H86 Cl F6 O4 P3 Ru -","- C63 H86 Cl F6 O4 P3 Ru -","- C126 H172 Cl2 F12 O8 P6 Ru2 -","2","1","","Jung, Stefan; Brandt, Carsten D.; Werner, Helmut","A cationic allenylideneruthenium(II) complex with two bulky hemilabile phosphine ligands","New Journal of Chemistry","2001","25","9","1101","","10.1039/b104787f","","","0.71073","MoKα","","0.091","0.0484","","","0.1093","0.1248","","","","","","0.87","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7051197","13.1254","0.0002","48.0683","0.0007","12.8677","0.0002","90","","90","","90","","8118.4","0.2","110","2","110","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C82 H74 Cl5 Cu3 N9 O21 -","- C82 H74 Cl5 Cu3 N9 O21 -","- C328 H296 Cl20 Cu12 N36 O84 -","4","1","","Patra, Goutam K.; Goldberg, Israel; Chowdhury, Sanjoy K.; Maiti, Bikas C.; Sarkar, Amitabha; Bangal, Prakriti R.; Chakravorti, Sankar; Chattopadhyay, Nitin; Tocher, Derek A.; Drew, Michael G. B.; Mostafa, Golam; Chowdhury, Shubhamoy; Datta, Dipankar","A new photoluminescent CuI2N6 chromophore","New Journal of Chemistry","2001","25","11","1371","","10.1039/b105442m","","","0.7107","MoKα","","0.0878","0.0514","","","0.1123","0.1283","","","","","","1.022","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051198","16.6277","0.0016","8.2069","0.0007","15.1464","0.0016","90","","116.113","0.011","90","","1855.9","0.4","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 N2 O2 -","- C23 H22 N2 O2 -","- C92 H88 N8 O8 -","4","1","","Uznanski, Pawel; Amiens, Catherine; Donnadieu, Bruno; Coppel, Yannick; Chaudret, Bruno","Oxidation of photochromic spirooxazines by coinage metal cations. Part I. Reaction with AgNO3: formation and characterisation of silver particles","New Journal of Chemistry","2001","25","12","1486","1494","10.1039/b105446p","","","0.71073","MoKα","","0.059","0.0403","","","0.0932","0.1023","","","","","","1.01","","","","has coordinates","275230","2022-05-08","23:08:07",""
"7051199","27.659","0.003","8.4635","0.0011","16.5591","0.0017","90","","100.371","0.012","90","","3813","0.8","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C23 H22 N2 O2 -","- C23 H22 N2 O2 -","- C184 H176 N16 O16 -","8","1","","Uznanski, Pawel; Amiens, Catherine; Donnadieu, Bruno; Coppel, Yannick; Chaudret, Bruno","Oxidation of photochromic spirooxazines by coinage metal cations. Part I. Reaction with AgNO3: formation and characterisation of silver particles","New Journal of Chemistry","2001","25","12","1486","1494","10.1039/b105446p","","","0.71073","MoKα","","0.1192","0.0471","","","0.1156","0.1527","","","","","","0.94","","","","has coordinates","275230","2022-05-08","23:08:07",""
"7051200","13.45","0.003","20.456","0.004","7.667","0.002","90","","96.61","0.03","90","","2095.4","0.8","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 N2 O2 -","- C27 H24 N2 O2 -","- C108 H96 N8 O8 -","4","1","","Uznanski, Pawel; Amiens, Catherine; Donnadieu, Bruno; Coppel, Yannick; Chaudret, Bruno","Oxidation of photochromic spirooxazines by coinage metal cations. Part I. Reaction with AgNO3: formation and characterisation of silver particles","New Journal of Chemistry","2001","25","12","1486","1494","10.1039/b105446p","","","0.71073","MoKα","","0.1302","0.0603","","","0.1441","0.1799","","","","","","0.902","","","","has coordinates","275230","2022-05-08","23:08:07",""
"7051201","10.3622","0.0009","15.331","0.0015","13.5407","0.0012","90","","103.856","0.01","90","","2088.5","0.3","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H23 N3 O4 -","- C24 H23 N3 O4 -","- C96 H92 N12 O16 -","4","1","","Uznanski, Pawel; Amiens, Catherine; Donnadieu, Bruno; Coppel, Yannick; Chaudret, Bruno","Oxidation of photochromic spirooxazines by coinage metal cations. Part I. Reaction with AgNO3: formation and characterisation of silver particles","New Journal of Chemistry","2001","25","12","1486","1494","10.1039/b105446p","","","0.71073","MoKα","","0.0523","0.0399","","","0.1011","0.1088","","","","","","1.018","","","","has coordinates","275230","2022-05-08","23:08:07",""
"7051202","12.5891","0.0016","13.6746","0.0015","14.2577","0.0018","114.178","0.013","97.965","0.015","98.965","0.014","2155.3","0.6","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H18 Au Cl3 N O -","- C22 H18 Au Cl3 N2 O -","- C88 H72 Au4 Cl12 N8 O4 -","4","2","","Pawel Uznanski; Catherine Amiens; Manuel Bardaji; Bruno Donnadieu; Yannick Coppel; Bruno Chaudret; Antonio Laguna","Oxidation of photochromic spirooxazines by coinage metal cations. Part II. Oxidation by gold(III) compounds and synthesis of gold colloids","New J. Chem.","2001","25","12","1495","1499","10.1039/b105447n","","","0.71073","MoKα","","0.0777","0.0364","","","0.0648","0.0737","","","","","","0.873","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051203","6.81","0.001","18.326","0.001","7.39","0.001","90","","100.35","0.01","90","","907.27","0.19","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","perfluoronaphthalene anthracene complex (1:1)","","- C24 H10 F8 -","- C24 H10 F8 -","- C48 H20 F16 -","2","0.5","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1 : 1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","0.71073","MoKα","","0.0953","0.0401","","","0.0741","0.086","","","","","","0.932","","","","has coordinates","219075","2020-10-21","18:00:00",""
"7051204","6.776","0.002","18.18","0.006","7.666","0.003","90","","102.45","0.01","90","","922.1","0.5","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","perfluoronaphthalene phenanthrene complex (1:1)","","- C24 H10 F8 -","- C24 H10 F8 -","- C48 H20 F16 -","2","0.5","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1 : 1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","0.71073","MoKα","","0.1003","0.0492","","","0.1095","0.1302","","","","","","1.011","","","","has coordinates","219075","2020-10-21","18:00:00",""
"7051205","6.725","0.001","8.864","0.001","9.488","0.001","107.51","0.01","105.23","0.01","106.82","0.01","476.9","0.12","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","perfluoronaphthalene pyrene complex (1:1)","","- C26 H10 F8 -","- C26 H10 F8 -","- C26 H10 F8 -","1","0.5","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1 : 1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","0.71073","MoKα","","0.0771","0.0442","","","0.1017","0.1153","","","","","","1.014","","","","has coordinates","219075","2020-10-21","18:00:00",""
"7051206","7.132","0.004","10.122","0.002","14.614","0.005","90","","102.22","0.02","90","","1031.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H14 N8 Ni -","- C5 H14 N8 Ni -","- C20 H56 N32 Ni4 -","4","1","","Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia","Synthesis of N3−/SCN− bridged polynuclear complexes of nickel(II) using N,N,N'-trimethylethane-1,2-diamine as a blocking ligand: low temperature magnetic study and single crystal structure of [Ni(μ1,1-N3)(μ1,3-N3)(N,N,N'-Me3en)]n","New J. Chem.","2001","25","12","1577","1582","10.1039/b105770g","","","0.71069","MoKα","","0.1373","0.0504","","0.1395","0.1008","","","","1.005","1.07","1.07","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051207","12.698","0.002","10.1097","0.0014","15.698","0.005","90","","90","","90","","2015.2","0.8","293","2","293","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C10 H28 F6 N5 Ni O2 P -","- C10 H28 F6 N5 Ni O2 P -","- C40 H112 F24 N20 Ni4 O8 P4 -","4","1","","Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia","Synthesis of N3−/SCN− bridged polynuclear complexes of nickel(II) using N,N,N'-trimethylethane-1,2-diamine as a blocking ligand: low temperature magnetic study and single crystal structure of [Ni(μ1,1-N3)(μ1,3-N3)(N,N,N'-Me3en)]n","New J. Chem.","2001","25","12","1577","1582","10.1039/b105770g","","","0.71069","MoKα","","0.0434","0.0372","","0.1184","0.0945","","","","1.057","1.078","1.078","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051208","12.8728","0.0011","15.8948","0.0012","18.2031","0.0014","90","","90","","90","","3724.5","0.5","153","2","153","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C36 H54 Cu F6 N2 O3 P -","- C36 H54 Cu F6 N2 O3 P -","- C144 H216 Cu4 F24 N8 O12 P4 -","4","1","","Fraysse, Sandrine; von Zelewsky, Alex; Stoeckli-Evans, Helen","A stable chiral diolefin complex of CuI with predetermined configuration at the metal centre","New Journal of Chemistry","2001","25","11","1374","","10.1039/b105870n","","","0.71073","MoKα","","0.1819","0.0567","","","0.0816","0.1123","","","","","","0.65","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051209","8.213","0.0004","9.912","0.0004","11.531","0.0005","98.303","0.002","94.06","0.003","96.414","0.002","919.44","0.07","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,3,7-Triphenylcyclopenta[c]pyran","","- C26 H18 O -","- C26 H18 O -","- C52 H36 O2 -","2","1","","Banciu, Mircea D.; Castellano, Eduardo E.; Ellena, Javier; Haiduc, Ionel; Draghici, Constantin; Balaban, Alexandru T.","Serendipitous, one-pot formation of 2,3,7-triphenylcyclopenta[c]pyran from 1,2-diphenylethanedione (“benzil”) and cyclopentadiene","New Journal of Chemistry","2001","25","11","1472","","10.1039/b105878a","","x-ray","0.7107","MoKα","","0.0671","0.0471","","","0.125","0.1548","","","","","","1.113","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051210","20.72","0.02","19.67","0.03","12.796","0.015","90","","101.478","0.01","90","","5111","11","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C91 H118 Cl6 O16 S8 -","- C91 H104 Cl6 O16 S8 -","- C182 H208 Cl12 O32 S16 -","2","0.25","","Matthews, Susan E.; Felix, Vitor; Drew, Michael G. B.; Beer, Paul D.","Thiacalix[4]tube: synthesis, X-ray crystal structure and preliminary binding studies Electronic supplementary information (ESI) available: full experimental details, including synthesis and characterisation of 4 and 5, and the crystallographic study of 6. See http://www.rsc.org/suppdata/nj/b1/b106094p/","New Journal of Chemistry","2001","25","11","1355","","10.1039/b106094p","","","0.71073","MoKα","","0.2254","0.1054","","","0.2868","0.3628","","","","","","0.921","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051211","10.145","0.004","10.82","0.004","16.051","0.009","90","","96.949","0.005","90","","1749","1.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H25 N4 -","- C19 H25 N4 -","- C76 H100 N16 -","4","1","","Olivier Maury; Jean-Paul Guégan; Thierry Renouard; Adam Hilton; Philippe Dupau; Nicolas Sandon; Loïc Toupet; Hubert Le Bozec","Design and synthesis of 4,4'-π-conjugated[2,2']-bipyridines: a versatile class of tunable chromophores and fluorophores","New J. Chem.","2001","25","12","1553","1566","10.1039/b106096c","","","0.71069","MoKα","","0.1568","0.0521","","","0.1378","0.1732","","","","","","0.946","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051212","11.915","0.003","12.05","0.004","13.544","0.002","105.67","0.02","99.141","0.01","93.4","0.02","1837.8","0.8","293","2","293","2","","","","","","","","3","P 1","P 1","1","","","","- C84 H108 N8 -","- C83 H106 N8 -","- C83 H106 N8 -","1","1","","Olivier Maury; Jean-Paul Guégan; Thierry Renouard; Adam Hilton; Philippe Dupau; Nicolas Sandon; Loïc Toupet; Hubert Le Bozec","Design and synthesis of 4,4'-π-conjugated[2,2']-bipyridines: a versatile class of tunable chromophores and fluorophores","New J. Chem.","2001","25","12","1553","1566","10.1039/b106096c","","","0.71069","MoKα","","0.2044","0.0776","","","0.2287","0.3179","","","","","","0.928","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051213","7.309","0.003","7.698","0.005","25.101","0.007","90","","92.13","0.02","90","","1411.3","1.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N3 -","- C16 H18 N3 -","- C64 H72 N12 -","4","1","","Olivier Maury; Jean-Paul Guégan; Thierry Renouard; Adam Hilton; Philippe Dupau; Nicolas Sandon; Loïc Toupet; Hubert Le Bozec","Design and synthesis of 4,4'-π-conjugated[2,2']-bipyridines: a versatile class of tunable chromophores and fluorophores","New J. Chem.","2001","25","12","1553","1566","10.1039/b106096c","","","0.71069","MoKα","","0.2724","0.0633","","","0.1429","0.2056","","","","","","0.896","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051214","7.2313","0.0012","8.9917","0.0015","9.4175","0.0016","84.667","0.003","81.705","0.003","73.315","0.003","579.57","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 Br Cu N2 -","- C12 H8 Br Cu N2 -","- C24 H16 Br2 Cu2 N4 -","2","1","","Bosch, Eric; Barnes, Charles L.","Crystal structure of kinetic and thermodynamic coordination networks formed between 3,3′-dipyridylethyne and copper bromide","New Journal of Chemistry","2001","25","11","1376","","10.1039/b106221m","","","0.71073","MoKα","","0.0566","0.0462","","","0.1178","0.1246","","","","","","1.032","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051215","8.582","0.0007","17.6497","0.0013","7.3216","0.0006","90","","91.72","0.002","90","","1108.5","0.15","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Br Cu N2 -","- C12 H8 Br Cu N2 -","- C48 H32 Br4 Cu4 N8 -","4","1","","Bosch, Eric; Barnes, Charles L.","Crystal structure of kinetic and thermodynamic coordination networks formed between 3,3′-dipyridylethyne and copper bromide","New Journal of Chemistry","2001","25","11","1376","","10.1039/b106221m","","","0.71073","MoKα","","0.0527","0.0342","","","0.0785","0.085","","","","","","1.056","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051216","8.157","0.004","19.586","0.011","7.404","0.002","90","","92.8","0.03","90","","1181.5","0.9","298","2","298","2","","","","","","","see Experimental","5","P 1 21/c 1","-P 2ybc","14","Silver Assembly","","","- C12 H8.5 Ag1.5 N2 O4 -","- C12 H8.5 Ag1.5 N2 O4 -","- C48 H34 Ag6 N8 O16 -","4","1","","Briccyle Cova; Alexander Briceño; Reinaldo Atencio","An unusual harmonisation of metal-based assemblies to achieve a mesoporous solid. Synthesis and crystal structure of a new silver(I) isonicotinate array","New J. Chem.","2001","25","12","1516","1519","10.1039/b106297m","","","0.71069","MoKα","","0.0215","0.0203","","0.0527","0.052","","","","1.184","1.195","1.195","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051219","13.0362","0.0006","8.7731","0.0004","16.834","0.0006","90","","107.289","0.002","90","","1838.28","0.14","200","","200","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Cd(L2)2(MeOH)2](ClO4)2","","- C32 H40 Cd Cl2 N8 O10 -","- C32 H40 Cd Cl2 N8 O10 -","- C64 H80 Cd2 Cl4 N16 O20 -","2","0.5","","Sui, Bin; Fan, Jian; Okamura, Taka-aki; Sun, Wei-Yin; Ueyama, Norikazu","Anion exchange properties of a two-dimensional coordination framework of cadmium(II) with 1,3-bis(imidazol-1-ylmethyl)-5-methylbenzene","New Journal of Chemistry","2001","25","11","1379","1381","10.1039/b106750h","","","0.71069","MoKα","","0.0484","0.0355","","","0.0886","0.0918","","","","","","1.008","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051220","17.405","0.004","11.06","0.002","8.286","0.0017","90","","101.83","0.03","90","","1561.2","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H20 N4 O2 -","- C15 H20 N4 O2 -","- C60 H80 N16 O8 -","4","0.5","","Sui, Bin; Fan, Jian; Okamura, Taka-aki; Sun, Wei-Yin; Ueyama, Norikazu","Anion exchange properties of a two-dimensional coordination framework of cadmium(II) with 1,3-bis(imidazol-1-ylmethyl)-5-methylbenzene","New Journal of Chemistry","2001","25","11","1379","1381","10.1039/b106750h","","","0.71073","MoKα","","0.0685","0.0441","","","0.1177","0.1322","","","","","","1.011","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051221","18.112","0.01","10.86","0.005","23.781","0.01","90","","90","","90","","4678","4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C14 H27 Ag2 Cl2 N9 O8 -","- C14 H27 Ag2 Cl2 N9 O8 -","- C112 H216 Ag16 Cl16 N72 O64 -","8","1","","Zheng, Shao-Liang; Tong, Ming-Liang; Zhu, Hai-Liang; Chen, Xiao-Ming","Four two-dimensional highly undulating silver(I)–hexamethylenetetramine co-ordination networks containing micropores","New Journal of Chemistry","2001","25","11","1425","","10.1039/b107193a","","","0.71073","MoKα","","0.0946","0.0492","","","0.108","0.1289","","","","","","1.035","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051222","11.488","0.003","10.395","0.003","19.527","0.007","90","","90","","90","","2331.9","1.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C9 H15 Ag N4 O4 -","- C9 H15 Ag N4 O4 -","- C72 H120 Ag8 N32 O32 -","8","1","","Zheng, Shao-Liang; Tong, Ming-Liang; Zhu, Hai-Liang; Chen, Xiao-Ming","Four two-dimensional highly undulating silver(I)–hexamethylenetetramine co-ordination networks containing micropores","New Journal of Chemistry","2001","25","11","1425","","10.1039/b107193a","","","0.71073","MoKα","","0.0738","0.0527","","","0.1384","0.154","","","","","","1.011","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051223","11.717","0.004","11.741","0.006","10.478","0.007","90","","90","","90","","1441.5","1.3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C13 H19 Ag N4 O3 -","- C13 H19 Ag N4 O3 -","- C52 H76 Ag4 N16 O12 -","4","1","","Zheng, Shao-Liang; Tong, Ming-Liang; Zhu, Hai-Liang; Chen, Xiao-Ming","Four two-dimensional highly undulating silver(I)–hexamethylenetetramine co-ordination networks containing micropores","New Journal of Chemistry","2001","25","11","1425","","10.1039/b107193a","","","0.71073","MoKα","","0.0612","0.0523","","","0.1319","0.1404","","","","","","1.03","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051224","11.62","0.006","10.807","0.005","23.145","0.012","90","","90","","90","","2906","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H19 Ag N4 O4 -","- C13 H19 Ag N4 O4 -","- C104 H152 Ag8 N32 O32 -","8","1","","Zheng, Shao-Liang; Tong, Ming-Liang; Zhu, Hai-Liang; Chen, Xiao-Ming","Four two-dimensional highly undulating silver(I)–hexamethylenetetramine co-ordination networks containing micropores","New Journal of Chemistry","2001","25","11","1425","","10.1039/b107193a","","","0.71073","MoKα","","0.1137","0.0566","","","0.1149","0.1362","","","","","","1.024","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051225","11.2163","0.0013","9.612","0.0012","12.786","0.002","90","","91.796","0.006","90","","1377.8","0.3","223","2","223","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Rhodizonic acid dihydrate","","","- C6 H6 O8 -","- C6 H6 O8 -","- C48 H48 O64 -","8","1","","Braga, Dario; Cojazzi, Gianna; Maini, Lucia; Grepioni, Fabrizia","Reversible solid-state interconversion of rhodizonic acid H2C6O6 into H6C6O8 and the solid-state structure of the rhodizonate dianion C6O62‒ (aromatic or non-aromatic?)","New Journal of Chemistry","2001","25","10","1221","","10.1039/b107317f","","","0.71073","MoKα","","0.1436","0.0592","","","0.1194","0.1462","","","","","","0.73","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051226","12.522","0.004","8.354","0.004","3.761","0.003","90","","96.93","0.05","90","","390.6","0.4","223","2","223","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","Rubidium rhodizonate","","","- C6 O6 Rb2 -","- C6 O6 Rb2 -","- C12 O12 Rb4 -","2","0.25","","Braga, Dario; Cojazzi, Gianna; Maini, Lucia; Grepioni, Fabrizia","Reversible solid-state interconversion of rhodizonic acid H2C6O6 into H6C6O8 and the solid-state structure of the rhodizonate dianion C6O62‒ (aromatic or non-aromatic?)","New Journal of Chemistry","2001","25","10","1221","","10.1039/b107317f","","","0.71073","MoKα","","0.0545","0.0374","","","0.1006","0.1061","","","","","","1.003","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051228","15.246","0.003","22.372","0.004","21.359","0.004","90","","100.2","0.03","90","","7170","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 Cl2 Cu N6 O11 -","- C36 H30 Cl2 Cu N6 O11 -","- C288 H240 Cl16 Cu8 N48 O88 -","8","2","","Tong, Ming-Liang; Wu, Ying-Miao; Zheng, Shao-Liang; Chen, Xiao-Ming; Yuen, Tan; Lin, Chuan-Long; Huang, Xiaoying; Li, Jing","A three-dimensional honeycomb-like network constructed with novel one-dimensional S-shaped chains via hydrogen bonding and π‒π interactions","New Journal of Chemistry","2001","25","12","1482","1485","10.1039/b107655h","","","0.71073","MoKα","","0.1111","0.0487","","","0.1278","0.1584","","","","","","0.968","","","","has coordinates","180544","2020-10-21","18:00:00",""
"7052468","11.8719","0.0015","7.8232","0.0012","12.9433","0.0016","90","","99.176","0.015","90","","1186.7","0.3","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 N2 O2 -","- C15 H10 N2 O2 -","- C60 H40 N8 O8 -","4","1","","Eastmond, Geoffrey C.; Gilchrist, Thomas L.; Paprotny, Jerzy; Steiner, Alexander","Cyano-activated fluoro displacement reactions in the synthesis of cyanophenoxazines and related compounds","New Journal of Chemistry","2001","25","3","385","","10.1039/b008503k","","","0.71073","MoKα","","0.1212","0.1113","","","0.2915","0.2972","","","","","","1.131","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052469","27.732","0.006","7.833","0.002","19.416","0.004","90","","106.8","0.03","90","","4037.6","1.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13 H7 N O2 -","- C13 H7 N O2 -","- C208 H112 N16 O32 -","16","2","","Eastmond, Geoffrey C.; Paprotny, Jerzy; Steiner, Alexander; Swanson, Linda","Synthesis of cyanodibenzo[1,4]dioxines and their derivatives by cyano-activated fluoro displacement reactions","New Journal of Chemistry","2001","25","3","379","","10.1039/b008508l","","","0.71073","MoKα","","0.1394","0.0464","","","0.0927","0.1124","","","","","","0.661","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052470","10.6409","0.0015","5.9763","0.0007","16.382","0.002","90","","102.504","0.017","90","","1017.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H6 F N O4 -","- C12 H6 F N O4 -","- C48 H24 F4 N4 O16 -","4","1","","Eastmond, Geoffrey C.; Paprotny, Jerzy; Steiner, Alexander; Swanson, Linda","Synthesis of cyanodibenzo[1,4]dioxines and their derivatives by cyano-activated fluoro displacement reactions","New Journal of Chemistry","2001","25","3","379","","10.1039/b008508l","","","0.71073","MoKα","","0.051","0.0373","","","0.102","0.1089","","","","","","1.021","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052471","9.2675","0.0003","8.1573","0.0003","13.8649","0.0005","90","","102.968","0.001","90","","1021.42","0.06","130","1","130","1","","","","","","","","4","P 1 21 1","P 2yb","4","","7,7-di(S(+)-2-(methoxy)pyrrolidino)-8,8-dicyanoquinodimethane","","- C22 H28 N4 O2 -","- C22 H28 N4 O2 -","- C44 H56 N8 O4 -","2","1","","Srinivasa Gopalan, R.; Kulkarni, Giridhar U.; Ravi, M.; Rao, C. N. R.","A charge density study of an intramolecular charge-transfer quinoid compound with strong NLO properties","New Journal of Chemistry","2001","25","9","1108","","10.1039/b103117c","","","0.71073","MoKα","","0.2382","0.1383","","0.2175","0.1803","","","","1.632","1.835","1.835","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052472","6.923","0.002","17.925","0.003","8.08","0.003","90","","104.39","0.01","90","","971.2","0.5","295","2","295","2","","","","","","","","3","I2/m","","","","perfluoronaphthalene phenanthrene complex (1:1)","","- C24 H10 F8 -","","","2","","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1 : 1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","0.71073","MoKα","","","","","","","","","","","","","","","","","","219075","2020-10-21","18:00:00",""
"7052473","22.9235","0.0007","9.9309","0.0005","12.8363","0.0007","90","0.01","101.078","0.003","90","0.01","2867.7","0.2","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H38 N4 O2 -","- C33 H38 N4 O2 -","- C132 H152 N16 O8 -","4","1","","Baouid, Abdesselam; Elhazazi, Saïd; Hasnaoui, Aïssa; Compain, Philippe; Lavergne, Jean-Pierre; Huet, François","Highly peri-, regio- and diastereoselective 1,3-dipolar cycloaddition of mesitonitrile oxide to 1,7-dimethyl-2,3-dihydro-1H-1,4-diazepines: unexpected one-step formation of a new triheterocyclic framework","New Journal of Chemistry","2001","25","12","1479","1481","10.1039/B107409C","","","0.71073","MoKα","","","0.073","","","","0.083","","","","","","1.575","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7052475","7.9346","0.0004","18.6728","0.0009","13.9672","0.0007","90","","104.485","0.003","90","","2003.62","0.17","80","2","80","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H27 Au Cl4 O8 -","- C10 H27 Au Cl4 O8 -","- C40 H108 Au4 Cl16 O32 -","4","1","","Calleja, Maria; Mason, Sax A.; Paul D. Prince; Steed, Jonathan W.; Wilkinson, Clive","Single crystal neutron and X-ray diffraction studies of (H7O3)[AuCl4]·15-crown-5","New Journal of Chemistry","2001","25","12","1475","1478","10.1039/B108935H","","neutron","1.2316","neutron","","0.0508","0.0381","","","0.0804","0.0851","","","","","","1.078","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7052476","7.9441","0.0007","18.6964","0.0016","13.9886","0.001","90","","104.347","0.003","90","","2012.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H27 Au Cl4 O8 -","- C10 H27 Au Cl4 O8 -","- C40 H108 Au4 Cl16 O32 -","4","1","","Calleja, Maria; Mason, Sax A.; Paul D. Prince; Steed, Jonathan W.; Wilkinson, Clive","Single crystal neutron and X-ray diffraction studies of (H7O3)[AuCl4]·15-crown-5","New Journal of Chemistry","2001","25","12","1475","1478","10.1039/B108935H","","","0.71073","MoKα","","0.0462","0.0358","","","0.0789","0.083","","","","","","1.107","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7052515","11.88","0.0009","15.0636","0.0012","20.7172","0.0017","93.716","0.002","93.872","0.002","107.226","0.002","3519.1","0.5","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C77 H66 Al N O8 Si6 -","- C77 H66 Al N O8 Si6 -","- C154 H132 Al2 N2 O16 Si12 -","2","1","","Gun'ko, Yurii K.; Reilly, Roisin; Kessler, Vadim G.","A convenient route to anionic and cyclic aluminosiloxanes: crystal structures of [PyH][Al{OSiPh2(OSiPh2)2O}2] and the first twelve-membered organic aluminosilicate Al2Si4O6 ring","New Journal of Chemistry","2001","25","4","528","530","10.1039/b009556g","","","0.71073","MoKα","","0.115","0.054","","","0.1125","0.1284","","","","","","0.925","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052516","14.275","0.004","16.322","0.004","16.56","0.004","90","","113.911","0.006","90","","3527.3","1.6","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H64 Al2 Cl2 O7 Si4 -","- C64 Al2 Cl2 O10 Si4 -","- C128 Al4 Cl4 O20 Si8 -","2","0.5","","Gun'ko, Yurii K.; Reilly, Roisin; Kessler, Vadim G.","A convenient route to anionic and cyclic aluminosiloxanes: crystal structures of [PyH][Al{OSiPh2(OSiPh2)2O}2] and the first twelve-membered organic aluminosilicate Al2Si4O6 ring","New Journal of Chemistry","2001","25","4","528","","10.1039/b009556g","","","0.71073","MoKα","","0.1696","0.0782","","","0.1792","0.2024","","","","","","1.151","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052517","26.559","0.003","6.373","0.001","8.079","0.001","90","","90","","90","","1367.5","0.3","569.4","","569.4","","","","","","","","","4","P n m a","-P 2ac 2n","62","(1,2-dihydro-N-tolyl-4,6-dimethylpyrimidin-2-ones) HNO3 salt","","","- C13 H15 N3 O4 -","- C8.5 H12.5 N1.5 O2 -","- C34 H50 N6 O8 -","4","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0644","0.064","","0.061","","0.061","","","3.835","","","3.83","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7052518","26.88","0.003","6.348","0.001","8.102","0.001","90","","90","","90","","1382.5","0.3","296.2","","296.2","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H12 Cl N3 O4 -","- C12 H12 Cl N3 O4 -","- C48 H48 Cl4 N12 O16 -","4","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0593","0.059","","0.063","","0.063","","","2.895","","","2.9","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052519","6.801","0.001","12.199","0.001","7.327","0.001","90","","90","","90","","607.89","0.13","296.2","","296.2","","","","","","","","Local laboratory","5","P m n 21","P 2ac -2","31","","","","- C12 H13 Cl N2 O -","- C12 H13 Cl N2 O -","- C24 H26 Cl2 N4 O2 -","2","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0398","0.04","","0.052","","0.052","","","2.008","","","2.01","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7052520","7.3047","0.0007","6.7669","0.0006","13.444","0.002","90","","105.59","0.01","90","","640.09","0.13","296.2","","296.2","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C13 H15 Cl N2 O -","- C13 H15 Cl N2 O -","- C26 H30 Cl2 N4 O2 -","2","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0365","0.037","","0.043","","0.043","","","3.015","","","3.02","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052521","7.313","0.001","6.668","0.002","13.644","0.002","90","","105.23","0.01","90","","642","0.2","296.2","","296.2","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C12 H12 Cl2 N2 O -","- C8 H10 Cl N O0.5 -","- C16 H20 Cl2 N2 O -","2","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0384","0.038","","0.041","","0.041","","","2.693","","","2.69","","","","has coordinates","180079","2020-10-21","18:00:00",""