# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-18T22:40:43+02:00
# 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 'Acta Crystallographica, Section E') AND volume = 61 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
"1100133","7.119","0.008","11.532","0.006","12.49","0.007","107.14","0.05","95.43","0.07","92.03","0.06","973.3","1.3","280","2","280","2","","","","","","","","5","P -1","-P 1","2","Bis(p-toluidinium) tetrachlorozincate(II)","Bis(p-toluidinium) tetrachlorozincate(II)","","- C14 H20 Cl4 N2 Zn -","- C14 H20 Cl4 N2 Zn -","- C28 H40 Cl8 N4 Zn2 -","2","1","","Rademeyer, M.","Bis(p-toluidinium) tetrachlorozincate(II)","Acta Crystallographica Section E","2005","61","","m304","m306","10.1107/S1600536805000747","","","0.71073","MoKα","","0.0789","0.0436","","","0.094","0.106","","","","","","0.895","","","","has coordinates","277831","2022-09-14","14:31:32",""
"1101077","8.2437","0.0002","8.2437","0.0002","8.2437","0.0002","90","","90","","90","","560.23","0.02","295","","","","","","","","","","Synthetic","3","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Li O4 V2 -","- Li O4 V2 -","- Li8 O32 V16 -","8","0.0416667","MG6039","Matsushita, Yoshitaka; Yamaura, Jun-Ichi; Ueda, Yutaka","Lithium divanadate spinel, LiV~2~O~4~","Acta Crystallographica, Section E","2005","61","8","i137","i139","10.1107/S1600536805020155","","","0.71073","MoKα","","","0.0261","","","","0.0762","","","","","","0.845","","","","has coordinates","282068","2023-03-26","10:11:44",""
"2200000","8.506","0.0007","7.4661","0.0007","10.733","0.001","90","","102.626","0.002","90","","665.13","0.1","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","ricciocarpin A","","","- C15 H20 O3 -","- C15 H20 O3 -","- C30 H40 O6 -","2","1","AC6193","Wang, Yanmei; Tan, Geok-Kheng; Koh, Lip-Lin; Harrison, Leslie J.","Ricciocarpin A","Acta Crystallographica Section E","2005","61","11","o3800","o3801","10.1107/S1600536805028011","","","0.71073","MoKα","","0.0654","0.0613","","","0.1441","0.1462","","","","","","1.192","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200001","8.92","0.004","16.282","0.008","18.504","0.009","90","","90","","90","","2687","2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-Methyl 4-methyl-2-(1H-pyrrole-2-carboxamido)pentanoate","","- C12 H18 N2 O3 -","- C12 H18 N2 O3 -","- C96 H144 N16 O24 -","8","2","AC6205","Xiang-Chao Zeng; Po-Run Liu","(<i>S</i>)-Methyl 4-methyl-2-(1<i>H</i>-pyrrole-2-carboxamido)pentanoate","Acta Crystallographica Section E","2005","61","11","o3726","o3727","10.1107/S1600536805032393","","","0.71073","MoKα","","0.0758","0.0419","","","0.1013","0.1202","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200002","18.564","0.003","10.6834","0.0017","28.51","0.004","90","","90","","90","","5654.3","1.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2-(4-Chloro-3-methylphenoxy)-3-(4-chlorophenyl)-5-methyl- 8,9,10,11-tetrahydro-1-benzothieno[2',3':2,3]pyrido[4,5-d]pyrimidin-4(3H)-one","","- C28 H23 Cl4 N3 O2 S -","- C28 H23 Cl4 N3 O2 S -","- C224 H184 Cl32 N24 O16 S8 -","8","1","AC6207","Liu, Jian-Chao; He, Hong-Wu; Ding, Ming-Wu","2-(4-Chloro-3-methylphenoxy)-3-(4-chlorophenyl)-5-methyl-8,9,10,11-tetrahydro-1-benzothieno[2',3':2,3]pyrido[4,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one dichloromethane solvate","Acta Crystallographica Section E","2005","61","11","o3686","o3687","10.1107/S1600536805032381","","","0.71073","MoKα","","0.1142","0.087","","","0.195","0.2112","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200003","12.613","0.007","6.701","0.004","22.383","0.012","90","","94.086","0.01","90","","1887","1.8","273","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","aqua{6,6'-dimethoxy-2,2'-[1,2-ethanediylbis(nitrilomethylidyne)]diphenolato- κ^2^N,O}oxovanadium(IV) monohydrate","","- C18 H22 N2 O7 V -","- C18 H22 N2 O7 V -","- C72 H88 N8 O28 V4 -","4","1","AC6209","Buqin Jing; Lianzhi Li; Daqi Wang; Tao Xu; Xinglin Guo","Aqua[<i>N</i>,<i>N</i>'-ethylenebis(<i>o</i>-vanillylideniminato-κ^2^<i>N</i>,<i>O</i>)]oxovanadium(IV) monohydrate","Acta Crystallographica Section E","2005","61","11","m2244","m2246","10.1107/S1600536805031843","","","0.71073","MoKα","","0.0965","0.0485","","","0.1021","0.1259","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200004","5.419","0.002","7.438","0.002","17.814","0.003","90","","92.94","0.02","90","","717.1","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Phenylalanine benzoic acid solvate","","- C16 H17 N O4 -","- C16 H17 N O4 -","- C32 H34 N2 O8 -","2","1","AT6033","J. Suresh; R. V. Krishnakumar; S. Natarajan","<small>L</small>-Phenylalanine‒benzoic acid (1/1)","Acta Crystallographica Section E","2005","61","11","o3625","o3627","10.1107/S1600536805031661","","","0.71073","MoKα","","0.112","0.071","","","0.164","0.187","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200005","6.388","0.001","14.182","0.002","21.107","0.003","90","","90","","90","","1912.2","0.5","293","","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Cyproterone","6-chloro-1,2-dihydro-17-hydroxy-3'H-cyclopropa[a]pregna-1,4,6-triene- 3,20-dione","","- C22 H27 Cl O3 -","- C22 H27 Cl O3 -","- C88 H108 Cl4 O12 -","4","1","AT6034","de Ruyck, Jérôme; Henry de Hassonville, Sandrine; Liégeois, Jean-François; Wouters, Johan","Cyproterone and a comparison with its acetate ester","Acta Crystallographica Section E","2005","61","11","o3576","o3578","10.1107/S1600536805031673","","","1.54178","CuKα","","0.0367","0.036","","","0.1018","0.1027","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200006","8.0749","0.0014","19.795","0.003","10.1321","0.0017","90","","98.28","0.002","90","","1602.7","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Z)-3-(2,6-Dichlorophenyl)-1-(pyridin-3-yl)-2-(1H-1,2,4-triazol-1-yl)prop- 2-en-1-one","","- C16 H10 Cl2 N4 O -","- C16 H10 Cl2 N4 O -","- C64 H40 Cl8 N16 O4 -","4","1","AT6036","Liu, Jian-Bing; Dai, Hong; Tao, Wei-Feng; Jin, Zhong; Fang, Jian-Xin","(<i>Z</i>)-3-(2,6-Dichlorophenyl)-1-(pyridin-3-yl)-2-(1<i>H</i>-1,2,4-triazol-1-yl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","11","o3599","o3601","10.1107/S1600536805031454","","","0.71073","MoKα","","0.0407","0.0314","","","0.0828","0.0868","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200007","5.3054","0.0012","7.8287","0.0019","19.88","0.005","86.953","0.004","87.262","0.004","74.451","0.004","793.9","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","N-(2-Hydroxyethyl)pyrazine-2-carboxamide","","- C7 H9 N3 O2 -","- C7 H9 N3 O2 -","- C28 H36 N12 O8 -","4","2","AT6037","Zhang, Ming-Hua; Zheng, Shu-Ling; Zhou, Jian; Liu, Shang-Yuan; Zhao, Zeng-Guo","<i>N</i>-(2-Hydroxyethyl)pyrazine-2-carboxamide","Acta Crystallographica Section E","2005","61","11","o3568","o3570","10.1107/S1600536805031326","","","0.71073","MoKα","","0.094","0.049","","","0.116","0.134","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200008","6.9055","0.0014","7.0086","0.0014","10.074","0.002","71.62","0.03","76.09","0.03","71.93","0.03","434.34","0.18","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","3-Hydroxypyridinium-1-acetate dihydrate","","- C7 H11 N O5 -","- C7 H11 N O5 -","- C14 H22 N2 O10 -","2","1","AT6038","Zhu-Yan Zhang; Li-Hua Huo; Shan Gao; Jing-Gui Zhao","3-Hydroxypyridinium-1-acetate dihydrate","Acta Crystallographica Section E","2005","61","11","o3589","o3591","10.1107/S1600536805031442","","","0.71073","MoKα","","0.0518","0.0402","","","0.1066","0.1128","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200009","5.2027","0.0002","17.8203","0.0007","19.0427","0.0007","90","","90","","90","","1765.52","0.12","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[aqua(2,2'-bipyridine)manganese(II)]-μ~2~-5-nitrobenzene- 1,3-dicarboxylato-κ^3^O:O',O'']","","- C18 H13 Mn N3 O7 -","- C18 H13 Mn N3 O7 -","- C72 H52 Mn4 N12 O28 -","4","1","AT6039","Xie, Gang; Zeng, Ming-Hua; Chen, San-Ping; Gao, Sheng-Li","<i>catena</i>-Poly[[aqua(2,2'-bipyridine)manganese(II)]-μ~2~-5-nitrobenzene-1,3-dicarboxylato-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'']","Acta Crystallographica Section E","2005","61","11","m2273","m2275","10.1107/S1600536805031892","","","0.71073","MoKα","","0.0702","0.0451","","","0.0999","0.1133","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200010","12.932","0.006","7.532","0.003","24.322","0.011","90","","101.236","0.009","90","","2323.6","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Acetyl-4-methyl-2-phenylamino-1,3-thiazole","","- C12 H12 N2 O S -","- C12 H12 N2 O S -","- C96 H96 N16 O8 S8 -","8","2","AT6042","Kasim, Noor Azilah M.; Yamin, Bohari M.","5-Acetyl-4-methyl-2-phenylamino-1,3-thiazole","Acta Crystallographica Section E","2005","61","11","o3794","o3795","10.1107/S160053680503326X","","","0.71073","MoKα","","0.098","0.055","","","0.111","0.125","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200011","9.1978","0.0011","22.423","0.003","14.8597","0.0018","90","","103.287","0.002","90","","2982.7","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triaqua(2,2'-bipyridine)copper(II) 7-oxadibenzofluorene-3,11-disulfonate dihydrate","","- C30 H28 Cu N2 O12 S2 -","- C30 H28 Cu N2 O12 S2 -","- C120 H112 Cu4 N8 O48 S8 -","4","1","BD6010","Guo, Li-Rong; Jiang, Long; Tan, Min-Yu","Triaqua(2,2'-bipyridine)copper(II) 7-oxadibenzofluorene-3,11-disulfonate dihydrate","Acta Crystallographica Section E","2005","61","11","m2259","m2261","10.1107/S1600536805031855","","","0.71073","MoKα","","0.0802","0.0474","","","0.1167","0.1381","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200012","7.3671","0.0017","6.02","0.002","13.689","0.003","90","","105.551","0.012","90","","584.9","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-Tyrosinamide hydrochloride monohydrate","1-carbamoyl-2-(4-hydroxyphenyl)ethylammonium chloride monohydrate","","- C9 H15 Cl N2 O3 -","- C9 H15 Cl N2 O3 -","- C18 H30 Cl2 N4 O6 -","2","1","BH6029","Kolev, Tsonko; Spiteller, Michael; Sheldrick, William S.; Mayer-Figge, Heike; van Almsick, Tobias","<small>L</small>-Tyrosinamide hydrochloride monohydrate","Acta Crystallographica Section E","2005","61","11","o3819","o3821","10.1107/S1600536805033131","","","0.71073","MoKα","","0.0342","0.0292","","","0.076","0.0786","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200013","5.8623","0.0008","8.1322","0.001","30.674","0.004","90","","91.45","0.002","90","","1461.9","0.3","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-2-[(1-benzyl-2-hydroxyethylimino)methyl]-4-nitrophenol","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C64 H64 N8 O16 -","4","2","BH6033","Pradeep, Chullikkattil P.","Intramolecular hydrogen transfer in (<i>S</i>)-2-[(1-benzyl-2-hydroxyethylimino)methyl]-4-nitrophenol, a new chiral Schiff base","Acta Crystallographica Section E","2005","61","11","o3825","o3827","10.1107/S1600536805033581","","","0.71073","MoKα","","0.053","0.0414","","","0.1014","0.1081","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200014","14.565","0.003","16.839","0.003","20.092","0.004","90","","110.47","0.03","90","","4616.6","1.8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","mer-Tris(isothiocyanato)tris(ethyldiphenylphosphine oxide)iron(III)","","- C45 H45 Fe N3 O3 P3 S3 -","- C45 H45 Fe N3 O3 P3 S3 -","- C180 H180 Fe4 N12 O12 P12 S12 -","4","1","BH6034","Olejnik, Zofia; Lis, Tadeusz; Ondrejkovičová, Iveta; Malo, Jozef; Galková, Sylvia","<i>mer</i>-Tris(ethyldiphenylphosphine oxide)tris(isothiocyanato)iron(III)","Acta Crystallographica Section E","2005","61","11","m2314","m2316","10.1107/S1600536805032319","","","0.71073","MoKα","","0.0884","0.047","","","0.1003","0.1139","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204832","8.6898","0.0006","30.008","0.002","8.1262","0.0006","90","","103.622","0.001","90","","2059.4","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[4'-(2-Pyridyl)-2,2':6',2''-terpyridine-κ^3^N,N',N'']thiocyanatocopper(II) thiocynate","","- C22 H14 Cu N6 S2 -","- C22 H14 Cu N6 S2 -","- C88 H56 Cu4 N24 S8 -","4","1","AC6136","Hou, Lei; Li, Dan; Yin, Ye-Gao; Ng, Seik Weng","[4'-(2-Pyridyl)-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']isothiocyanatocopper(II) thiocyanate","Acta Crystallographica Section E","2005","61","1","m21","m22","10.1107/S1600536804031460","","","0.71073","MoKα","","0.067","0.051","","","0.122","0.134","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204833","7.872","0.002","17.463","0.003","5.754","0.002","90","","90","","90","","791","0.4","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","2,7-dihydroxynaphthalene","Naphthalene-2,7-diol","","- C10 H8 O2 -","- C10 H8 O2 -","- C40 H32 O8 -","4","1","AC6141","Rozycka-Sokolowska, Ewa; Marciniak, Bernard; Pavlyuk, Volodymyr","Naphthalene-2,7-diol","Acta Crystallographica Section E","2005","61","1","o114","o115","10.1107/S1600536804032453","","","0.71069","MoKα","","0.0494","0.0375","","","0.1178","0.1212","","","","","","1.196","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204834","7.0974","0.0005","12.6169","0.0008","14.0477","0.0009","115.397","0.001","90.959","0.001","102.666","0.001","1099.92","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(η^6^-N,N-Dimethylaniline)tricarbonylchromium","","- C11 H11 Cr N O3 -","- C11 H11 Cr N O3 -","- C44 H44 Cr4 N4 O12 -","4","2","AC6142","Zeller, Matthias; Hunter, Allen D.","Tricarbonyl(η^6^-<i>N,N</i>-dimethylaniline)chromium(0)","Acta Crystallographica Section E","2005","61","1","m23","m24","10.1107/S1600536804031484","","","0.71073","MoKα","","0.0471","0.0424","","","0.0974","0.0997","","","","","","1.182","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204835","13.2146","0.0017","6.9739","0.0009","16.21","0.002","90","","91.49","0.002","90","","1493.4","0.3","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","N,N,N-trimethyl-l-phenylalaninol bromide triydrate","[(R)-(+)-(1-hydroxy-3-phenylpropan-2-yl)trimethylammonium bromide] sesquihydrate","","- C12 H23 Br N O2.5 -","- C12 H23 Br N O2.5 -","- C48 H92 Br4 N4 O10 -","4","2","AC6143","Fan Chen; Zhi-Min Jin; Mao-Lin Hu","(<i>R</i>)-(+)-(1-Hydroxy-3-phenylpropan-2-yl)trimethylammonium bromide sesquihydrate","Acta Crystallographica Section E","2005","61","1","o72","o74","10.1107/S1600536804031708","","","0.71073","MoKα","","0.0541","0.0401","","","0.091","0.1021","","","","","","0.988","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204836","7.1843","0.0009","8.7554","0.0011","21.31","0.003","90","","90","","90","","1340.4","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","8β-Hydroxy-2,6,6-trimethyl-5βH,10βH-eudesma-1,7(11)-dien-12,8-olide","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","AC6144","Guang-Wen Zhang; Cheng-Zhu Liao; Xiang-Quan Ma; Cui-Xian Zhang; Hiroshi Kurihara; Xin-Sheng Yao; Jing-Yu Su; Long-Mei Zeng","8β-Hydroxy-2,6,6-trimethyl-5β<i>H</i>,10β<i>H</i>-eudesma-1,7(11)-dien-12,8-olide","Acta Crystallographica Section E","2005","61","1","o172","o173","10.1107/S1600536804032465","","","0.71073","MoKα","","0.0371","0.0352","","","0.0926","0.0947","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204837","8.2382","0.0002","10.0125","0.0003","7.8277","0.0002","90","","111.998","0.001","90","","598.66","0.03","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(ethylenediamine)nickel(II) dinitrate","","- C4 H16 N6 Ni O6 -","- C4 H16 N6 Ni O6 -","- C8 H32 N12 Ni2 O12 -","2","0.5","AC6145","Krause Bauer, Jeanette A.; Edison, Sara E.; Baldwin, Michael J.","Bis(ethylenediamine)nickel(II) dinitrate","Acta Crystallographica Section E","2005","61","1","m82","m84","10.1107/S1600536804032052","","","1.54178","CuKα","","0.0345","0.0314","","","0.0893","0.0915","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204838","7.4189","0.0018","25.667","0.006","5.9653","0.0015","90","","90","","90","","1135.9","0.5","174","2","174","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","4,4'-diiodobiphenyl","","- C12 H8 I2 -","- C12 H8 I2 -","- C48 H32 I8 -","4","0.5","AC6147","Britton, Doyle","4,4'-Diiodobiphenyl","Acta Crystallographica Section E","2005","61","1","o187","o188","10.1107/S1600536804033331","","","0.71073","MoKα","","0.022","0.02","","","0.042","0.042","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204839","8.2533","0.0011","8.7907","0.0015","11.3643","0.0014","87.199","0.015","84.592","0.014","73.62","0.011","787.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(Acetato-κ^2^O,O')(di-2-pyridylamine-κN)(trifluoroacetato-κO)copper(II)","","- C14 H12 Cu F3 N3 O4 -","- C14 H12 Cu F3 N3 O4 -","- C28 H24 Cu2 F6 N6 O8 -","2","1","BR6170","Zeng, Xi-Rui; Huang, Lin; Lei, Liang-Ping; Tang, Shi-Hua; Peng, Shie-Ming; Lee, Gene-Hsiang","(Acetato-κ^2^<i>O,O</i>')(di-2-pyridylamine-κ<i>N</i>)(trifluoroacetato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2005","61","1","m57","m59","10.1107/S1600536804031514","","","0.71073","MoKα","","0.0477","0.0371","","","0.1162","0.1252","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204840","11.779","0.011","7.363","0.007","12.025","0.011","90","","103.359","0.012","90","","1014.7","1.6","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 O7 Rb S -","- C7 H7 O7 Rb S -","- C28 H28 O28 Rb4 S4 -","4","1","BR6173","Mancheng Hu; Yanping Du; Shuni Li; Yucheng Jiang; Zhihong Liu; Chunyu Geng","Rubidium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","Acta Crystallographica Section E","2005","61","1","m15","m17","10.1107/S1600536804031290","","","0.71073","MoKα","","0.0589","0.0454","","","0.1298","0.1413","","","","","","0.977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204841","13.5565","0.0009","10.2568","0.0007","8.1885","0.0005","90","","99.524","0.001","90","","1122.89","0.13","296","2","296","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Hexaaquamanganese(II) bis[5-(4-cyanophenyl)-2H-tetrazolate]","","- C16 H20 Mn N10 O6 -","- C16 H20 Mn N10 O6 -","- C32 H40 Mn2 N20 O12 -","2","0.25","BR6174","Ma,Zhijie; Tao, Jun; Huang, Rong-Bin; Zhang, Lan-Sun","Hexaaquamanganese(II) bis[5-(4-cyanophenyl)-2<i>H</i>-tetrazolate]","Acta Crystallographica Section E","2005","61","1","m1","m2","10.1107/S160053680403106X","","","0.71073","MoKα","","0.0437","0.0432","","","0.1097","0.1102","","","","","","1.154","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204842","14.74","0.003","10.883","0.002","14.075","0.003","90","","96.91","0.03","90","","2241.4","0.8","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-hydroxypyridinium) naphthalene-1,5-disulfonate dihydrate","","- C20 H22 N2 O10 S2 -","- C20 H22 N2 O10 S2 -","- C80 H88 N8 O40 S8 -","4","1","BT6557","Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","Bis(2-hydroxypyridinium) naphthalene-1,5-disulfonate dihydrate","Acta Crystallographica Section E","2005","61","1","o98","o99","10.1107/S1600536804032313","","","0.71073","MoKα","","0.066","0.044","","","0.113","0.123","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204843","7.683","0.004","11.341","0.008","11.344","0.005","82.12","0.02","71.01","0.02","79.56","0.03","915.9","0.9","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","diaquabis(μ~4~-benzene-1,2,4-tricarboxylato)bis(2,2'-bipyridine)tricadmium(II)","","- C38 H26 Cd3 N4 O14 -","- C38 H26 Cd3 N4 O14 -","- C38 H26 Cd3 N4 O14 -","1","0.5","BT6564","Wang, Xiu-Li; Liu, Fu-Chen; Li, Jian-Rong; Ng, Seik Weng","Polymeric diaquabis(μ~4~-benzene-1,2,4-tricarboxylato)bis(2,2'-bipyridine)tricadmium(II)","Acta Crystallographica Section E","2005","61","1","m123","m125","10.1107/S1600536804032520","","","0.71073","MoKα","","0.026","0.023","","","0.09","0.091","","","","","","1.29","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204844","7.683","0.001","8.549","0.001","9.382","0.001","76.249","0.002","70.14","0.002","72.355","0.002","546.04","0.11","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,2'-Dipropylmalonic acid","","- C9 H16 O4 -","- C9 H16 O4 -","- C18 H32 O8 -","2","1","BT6565","Mondal, S.; Narasegowda, R. S.; Nagaraj, B.; Yathirajan, H. S.; Narasimhamurthy, T.; Rathore, Ravindranath S.","2,2'-Dipropylmalonic acid: intermolecular association <i>via</i> strong O—H···O hydrogen bonds","Acta Crystallographica Section E","2005","61","1","o151","o153","10.1107/S1600536804033045","","","0.71073","MoKα","","0.0628","0.0505","","","0.14","0.1503","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204845","7.0046","0.0008","13.1146","0.0014","8.4316","0.0009","90","","109.753","0.002","90","","728.97","0.14","273","2","273","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(3R,6S,6aR,9S,9aS)-6,6a,9-Trihydroxy-3,6,9a- trimethylperhydroazuleno[1,2-b]furan-2-one","","- C15 H24 O5 -","- C15 H24 O5 -","- C30 H48 O10 -","2","1","BT6566","G. Y. S. K. Swamy; K. Ravikumar; Biswanath Das; G. Mahender","(3<i>R</i>*,6<i>S</i>*,6<i>aR</i>*,9<i>S</i>*,9<i>aS</i>*)-6,6a,9-Trihydroxy-3,6,9a-trimethylperhydroazuleno[1,2-<i>b</i>]furan-2-one","Acta Crystallographica Section E","2005","61","1","o121","o123","10.1107/S1600536804032532","","","0.71073","MoKα","","0.0374","0.0368","","","0.0871","0.0874","","","","","","1.157","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204846","22.563","0.005","5.464","0.001","17.901","0.004","90","","126.02","0.03","90","","1785","0.9","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Trisodium [hydrogen bis(5-sulfonatosalicylate)] monohydrate","","- C14 H11 Na3 O13 S2 -","- C14 H11 Na3 O13 S2 -","- C56 H44 Na12 O52 S8 -","4","0.5","BT6571","Zhu, Zhi-Biao; Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","Hydrogen trisodium bis(5-sulfonatosalicylate) monohydrate","Acta Crystallographica Section E","2005","61","1","m192","m194","10.1107/S1600536804033604","","","0.71073","MoKα","","0.032","0.03","","","0.087","0.089","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204847","25.152","0.005","9.76","0.002","15.557","0.003","90","","123.01","0.03","90","","3202.5","1.6","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N-(2-Hydroxy-1-naphthalidene)phenylalanine","(2-carboxy-1-phenylethyl)iminiomethylene-1-naphth-2-olate","","- C20 H17 N O3 -","- C20 H17 N O3 -","- C160 H136 N8 O24 -","8","1","BT6572","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","1-[(2-Carboxy-1-phenylethyl)iminiomethylene]naphth-2-olate","Acta Crystallographica Section E","2005","61","1","o192","o194","10.1107/S1600536804033616","","","0.71073","MoKα","","0.075","0.048","","","0.115","0.127","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204848","5.8699","0.0005","9.1235","0.0008","9.3113","0.0008","86.746","0.002","77.125","0.002","87.728","0.002","485.15","0.07","120","2","120","2","","","","","","","","6","P -1","-P 1","2","Sodium pamidronate monohydrate","sodium 3-ammonium-1-hydroxypropylidene-1,1-bisphosphonate monohydrate","","- C3 H12 N Na O8 P2 -","- C3 H12 N Na O8 P2 -","- C6 H24 N2 Na2 O16 P4 -","2","1","BV6006","Stahl, Kenny; Treppendahl, Svend P.; Preikschat, Herbert; Fischer, Erik","Sodium 3-ammonio-1-hydroxypropylidene-1,1-bisphosphonate monohydrate","Acta Crystallographica Section E","2005","61","1","m132","m134","10.1107/S1600536804032568","","","0.71073","MoKα","","0.0497","0.0449","","","0.108","0.1112","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204849","12.8062","0.0007","8.1242","0.0004","12.4333","0.0008","90","","100.61","0.002","90","","1271.45","0.12","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 Cl2 N8 Ni -","- C24 H32 Cl2 N8 Ni -","- C48 H64 Cl4 N16 Ni2 -","2","0.5","BV6007","W. G. Piyal Ariyananda; Richard E. Norman","Tetrakis(1,2-diaminobenzene)-κ^2^<i>N</i>;κ^4^<i>N,N</i>'-nickel(II) dichloride","Acta Crystallographica Section E","2005","61","1","m187","m189","10.1107/S1600536804033574","","","0.7107","MoKα","","0.0681","0.0625","","0.1258","","0.1097","","","0.9827","","","1.0224","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204850","13.047","0.002","11.6893","0.0014","7.8244","0.0012","90","","109.954","0.017","90","","1121.7","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Poly[[[triaquaerbium(III)]-μ~3~-succinato] chloride dihydrate]","Poly[[[triaquaerbium(III)]-μ~3~-succinato] chloride dihydrate]","","- C4 H14 Cl Er O9 -","- C4 H14 Cl Er O9 -","- C16 H56 Cl4 Er4 O36 -","4","0.5","CF6390","Nika, Wassiliki; Pantenburg, Ingo; Meyer, Gerd","Poly[[[triaquaerbium(III)]-μ~3~-succinato] chloride dihydrate]","Acta Crystallographica Section E","2005","61","1","m138","m140","10.1107/S1600536804032635","","","0.71073","MoKα","","0.0237","0.0202","","","0.0504","0.0511","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204851","7.7315","0.0003","6.2859","0.0003","10.4209","0.0006","90","","102.102","0.0017","90","","495.19","0.04","190","","190","","","","","","","","","3","P 1 21 1","P 2yb","4","","3,4-O-Isoprpylidene-D-arabinono-1,5-lactone","","- C9 H14 O5 -","- C9 H14 O5 -","- C18 H28 O10 -","2","1","CF6391","Punzo, Francesco; Watkin, David J.; Jenkinson, Sarah F.; Fleet, George W. J.","3,4-<i>O</i>-Isopropylidene-2-<i>C</i>-methyl-<small>D</small>-arabinono-1,5-lactone","Acta Crystallographica Section E","2005","61","1","o127","o129","10.1107/S1600536804032659","","","0.71073","MoKα","","0.0326","0.0306","","0.0784","0.0769","0.0784","","","","","","0.9927","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204852","19.395","0.003","7.5786","0.0011","7.393","0.0011","90","","98.607","0.003","90","","1074.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[(2-Chlorophenyl)methylenehydrazinocarbonyl]-1H-1,2,4-triazole","","- C10 H8 Cl N5 O -","- C10 H8 Cl N5 O -","- C40 H32 Cl4 N20 O4 -","4","1","CI6470","Fu-You Pan; Jian-Guo Yang","3-[(2-Chlorophenyl)methylenehydrazinocarbonyl]-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","1","o63","o64","10.1107/S1600536804027151","","","0.71073","MoKα","","0.095","0.0597","","","0.1228","0.1378","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204853","9.985","0.0008","13.644","0.0011","16.3425","0.0014","90","","101.292","0.001","90","","2183.3","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-(2-Chlorophenyl)-2-((1E)-[4-(dimethylamino)phenyl]methyleneamino)-4,7- dihydro-1-benzothiophene-3-carboxamide","","- C24 H22 Cl N3 O S -","- C24 H22 Cl N3 O S -","- C96 H88 Cl4 N12 O4 S4 -","4","1","CI6479","G. N. Anil Kumar; M .K. Kokila; Puttaraja; S.Mohan; K. S. Majunath shetty; Manohar V. Kulkarni","<i>N</i>-(2-Chlorophenyl)-2-{(1<i>E</i>)-[4-(dimethylamino)phenyl]methyleneamino}-4,7-dihydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","1","o69","o71","10.1107/S1600536804031988","","","0.71073","MoKα","","0.0815","0.0692","","","0.1515","0.1577","","","","","","1.239","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204854","11.28","0.005","11.884","0.005","10.657","0.005","90","","114.169","0.005","90","","1303.4","1","150","","150","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-Hydroxy-1,3-di-p-tolylpropenone","","- C17 H16 O2 -","- C17 H16 O2 -","- C68 H64 O8 -","4","0.5","CI6484","Dege, Necmi; Yıldım, İsmail; Güldeste, Ayhan; İnaç, Hasan; Koca, İrfan; Nermin, Kahveci; Özyetiş, Ahmet; Büyükgüngör, Orhan","3-Hydroxy-1,3-di-<i>p</i>-tolylpropenone","Acta Crystallographica Section E","2005","61","1","o60","o62","10.1107/S1600536804030107","","","0.71073","MoKα","","0.0473","0.039","","","0.112","0.1167","","","","","","1.09","","","","has coordinates","198748","2020-10-21","18:00:00",""
"2204855","13.532","0.002","13.532","0.002","6.746","0.002","90","","90","","90","","1235.3","0.4","295","2","295","2","","","","","","","","3","I -4","I -4","82","","Tetrakis(phenylethynyl)germanium(IV)","","- C32 H20 Ge -","- C32 H20 Ge -","- C64 H40 Ge2 -","2","0.25","CI6492","Churakov, Andrei V.; Karlov, Sergey S.; Yakubova, Elmira Kh.; Selina, Anastasia A.; Zaitseva, Galina S.","Tetrakis(phenylethynyl)germanium(IV)","Acta Crystallographica Section E","2005","61","1","m52","m54","10.1107/S1600536804031241","","","0.71073","MoKα","","0.0309","0.0276","","","0.0642","0.0654","","","","","","1.149","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204856","10.352","0.002","8.7608","0.0018","13.811","0.003","90","","90","","90","","1252.5","0.4","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","catena-Poly[[silver(I)-μ-tris(2-aminoethyl)amine-κ^4^N,N',N'':N'''] perchlorate]","","- C6 H18 Ag Cl N4 O4 -","- C6 H18 Ag Cl N4 O4 -","- C24 H72 Ag4 Cl4 N16 O16 -","4","1","CI6493","Liu, Zhao-Di; Zhu, Hai-Liang","<i>catena</i>-Poly[[silver(I)-μ-tris(2-aminoethyl)amine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'':<i>N</i>'''] perchlorate]","Acta Crystallographica Section E","2005","61","1","m44","m46","10.1107/S160053680403168X","","","0.71073","MoKα","","0.0487","0.0362","","","0.0864","0.0919","","","","","","0.948","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204857","9.837","0.0007","10.1922","0.0008","10.9181","0.0008","94.327","0.001","92.633","0.001","97.719","0.001","1079.9","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N,N'-Bis(p-methoxyphenyl)-2,2'-(p-phenylenedioxy)diacetamide","","- C24 H24 N2 O6 -","- C24 H24 N2 O6 -","- C48 H48 N4 O12 -","2","1","CI6494","Wen, Yong-Hong; Zhang, Shu-Sheng; Liang, Juan; Li, Xue-Mei","<i>N</i>,<i>N</i>'-Bis(<i>p</i>-methoxyphenyl)-2,2'-(<i>p</i>-phenylenedioxy)diacetamide","Acta Crystallographica Section E","2005","61","1","o96","o97","10.1107/S1600536804032180","","","0.71073","MoKα","","0.0883","0.0676","","","0.1698","0.1849","","","","","","1.043","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204858","5.2957","0.0003","16.2732","0.0009","13.9411","0.0008","90","","93.2","0.001","90","","1199.54","0.12","150","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene methanol disolvate","","- C28 H34 N4 O2 -","- C28 H34 N4 O2 -","- C56 H68 N8 O4 -","2","0.5","CI6495","Ai-Miao Qin; Xiang-Dong Pi; Cheng-Yong Su","1,4-Bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene methanol disolvate","Acta Crystallographica Section E","2005","61","1","o137","o138","10.1107/S1600536804032684","","","0.71073","MoKα","","","0.0405","","","","0.1034","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204859","14.271","0.0006","14.9228","0.0006","29.8597","0.0012","90","","90","","90","","6359","0.4","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,4,10,16,21-Pentaaza-7,13,24-triazoniabicyclo[8.8.8]hexacosane monohydrate clathrate trichloride hexahydrate","","- C18 H59 Cl3 N8 O7 -","- C18 H59 Cl3 N8 O7 -","- C144 H472 Cl24 N64 O56 -","8","1","CI6496","Farrell, David; McKee, Vickie; Nelson, Jane","1,4,10,16,21-Pentaaza-7,13,24-triazoniabicyclo[8.8.8]hexacosane monohydrate clathrate trichloride hexahydrate","Acta Crystallographica Section E","2005","61","1","o81","o83","10.1107/S1600536804032088","","","0.71073","MoKα","","0.0554","0.0376","","","0.0897","0.1023","","","","","","1.034","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204860","12.872","0.002","9.282","0.003","24.761","0.007","90","","90","","90","","2958.4","1.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonamide","","- C16 H14 N2 O3 S -","- C16 H14 N2 O3 S -","- C128 H112 N16 O24 S8 -","8","1","CI6497","S. M. Malathy Sony; P. Charles; M. N. Ponnuswamy; H. S. Yathirajan","Valdecoxib, a non-steroidal anti-inflammatory drug","Acta Crystallographica Section E","2005","61","1","o108","o110","10.1107/S1600536804032118","","","0.71073","MoKα","","0.1534","0.0554","","","0.1378","0.1788","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204861","8.493","0.003","9.446","0.003","12.144","0.004","91.367","0.005","109.463","0.007","100.148","0.005","900.6","0.5","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","6-Amino-4-[4-(dimethylamino)phenyl]-3-methyl-1-phenylpyrazolo[3,4-b]pyridine- 5-carbonitrile","","- C22 H20 N6 -","- C22 H20 N6 -","- C44 H40 N12 -","2","1","CI6499","Zhu, Song-Lei; Tu, Shu-Jiang; Zou, Xiang; Li, Tuan-Jie","6-Amino-4-[4-(dimethylamino)phenyl]-3-methyl-1-phenylpyrazolo[3,4-<i>b</i>]pyridine-5-carbonitrile","Acta Crystallographica Section E","2005","61","1","o29","o30","10.1107/S1600536804031642","","","0.7107","MoKα","","0.0495","0.0414","","","0.0983","0.1031","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204862","6.833","0.0006","10.3313","0.001","16.1635","0.0015","90","","94.486","0.002","90","","1137.55","0.18","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-Pivaloyl-2-amino-6-hydroxymethylpyridine","N-[6-(Hydroxymethyl)pyridin-2-yl]-2,2-dimethylpropanamide","","- C11 H16 N2 O2 -","- C11 H16 N2 O2 -","- C44 H64 N8 O8 -","4","1","CI6500","Shyamaprosad Goswami; Swapan Dey; Suchada Chantrapromma; Hoong-Kun Fun","<i>N</i>-[6-(Hydroxymethyl)pyridin-2-yl]-2,2-dimethylpropanamide","Acta Crystallographica Section E","2005","61","1","o105","o107","10.1107/S1600536804032398","","","0.71073","MoKα","","0.0727","0.0528","","","0.131","0.1461","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204863","10.98","0.004","12.499","0.004","12.865","0.004","90","","90","","90","","1765.6","1","123.1","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H28 O2 -","- C23 H28 O2 -","- C92 H112 O8 -","4","1","CI6502","Masataka Watanabe; Taisuke Matsumoto; Shuntaro Mataka; Thies Thiemann","3-Methoxy-19-norpentara-1,3,5(10),17(20)-tetraen-21-one","Acta Crystallographica Section E","2005","61","1","o169","o171","10.1107/S160053680403363X","","","0.7107","MoKα","","","0.034","","","","0.073","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204864","6.8829","0.0014","23.589","0.005","7.7372","0.0015","90","","95.66","0.03","90","","1250.1","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(Hydroxyimino)butan-2-one (4-methoxybenzoyl)hydrazone","","- C12 H15 N3 O3 -","- C12 H15 N3 O3 -","- C48 H60 N12 O12 -","4","1","CI6504","Shan Gao; Zhao-Peng Deng; Li-Hua Huo; Hui Zhao","3-(Hydroxyimino)butan-2-one 4-methoxybenzoylhydrazone","Acta Crystallographica Section E","2005","61","1","o124","o126","10.1107/S1600536804032672","","","0.71073","MoKα","","0.059","0.0428","","","0.124","0.1334","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204865","9.4212","0.0006","12.8792","0.0009","10.0568","0.0007","90","","105.609","0.001","90","","1175.26","0.14","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","trans-2,2-Dimethyl-6-phenyltetrahydropyran-3-ol","trans-2,2-Dimethyl-6-phenyl-3,4,5,6-tetrahydro-2H-pyran-3-ol","","- C13 H18 O2 -","- C13 H18 O2 -","- C52 H72 O8 -","4","1","CV6413","Hartung, Jens; Svoboda, Ingrid; Schmidt, Philipp; Murso, Alexander","<i>trans</i>-2,2-Dimethyl-6-phenyl-3,4,5,6-tetrahydro-2<i>H</i>-pyran-3-ol","Acta Crystallographica Section E","2005","61","1","o33","o34","10.1107/S1600536804031551","","","0.71073","MoKα","","0.0714","0.0685","","","0.1389","0.1404","","","","","","1.281","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204866","14.001","0.0002","7.0811","0.0001","15.6584","0.0003","90","","106.213","0.001","90","","1490.67","0.04","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,4',5,5'-Tetrakis(methylsulfanyl)tetrathiafulvalene","","- C10 H12 S8 -","- C10 H12 S8 -","- C40 H48 S32 -","4","1","CV6415","Lei Wang; Jing-Ping Zhang; Bin Zhang","4,4',5,5'-Tetrakis(methylsulfanyl)tetrathiafulvalene","Acta Crystallographica Section E","2005","61","1","o65","o66","10.1107/S1600536804031769","","","0.71073","MoKα","","0.0541","0.0309","","","0.0739","0.0793","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204867","13.8829","0.0009","7.2027","0.0005","15.4632","0.001","90","","92.142","0.002","90","","1545.15","0.18","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","1-Chloro-2,2-dimethyl-1,3-diphenylpent-4-ene","1-Chloro-2,2-dimethyl-1,3-diphenylpent-4-ene","","- C19 H21 Cl -","- C19 H21 Cl -","- C76 H84 Cl4 -","4","1","CV6418","Hartung, Jens; Špehar, Kristina; Murso, Alexander; Svoboda, Ingrid","1-Chloro-2,2-dimethyl-1,3-diphenylpent-4-ene","Acta Crystallographica Section E","2005","61","1","o147","o148","10.1107/S1600536804032386","","","0.71073","MoKα","","0.07","0.0554","","","0.1071","0.1129","","","","","","1.131","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204868","13.269","0.002","16.085","0.002","5.7278","0.0004","90","","90","","90","","1222.5","0.3","173","2","173","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","cis-3-bromo-2,2-dimethyl-5-phenyltetrahydropyran","cis-(3R,5R)-3-Bromo-2,2-dimethyl-5-phenyltetrahydropyran","","- C13 H17 Br O -","- C13 H17 Br O -","- C52 H68 Br4 O4 -","4","1","CV6419","Hartung, Jens; Svoboda, Ingrid; Schmidt, Philipp; Pfeiffer, Matthias","<i>cis</i>-(3<i>R</i>,5<i>R</i>)-3-Bromo-2,2-dimethyl-5-phenyltetrahydropyran","Acta Crystallographica Section E","2005","61","1","o15","o16","10.1107/S1600536804030995","","","0.71073","MoKα","","0.0434","0.0308","","","0.0684","0.0726","","","","","","1.068","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204869","8.8112","0.0009","14.1852","0.0014","9.1367","0.0009","90","","111.867","0.001","90","","1059.82","0.18","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","dichloro (furaldehyde)phenylenediamine copper(II)","Dichloro[2-(2-furyl)-1H-benzimidazole-κN^3^]copper(II)","","- C22 H16 Cl2 Cu N4 O2 -","- C22 H16 Cl2 Cu N4 O2 -","- C44 H32 Cl4 Cu2 N8 O4 -","2","0.5","CV6420","Du, Gui-Xiang; Li, Jun; Zhang, Feng-Xing","Dichloro[2-(2-furyl)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]copper(II)","Acta Crystallographica Section E","2005","61","1","m119","m120","10.1107/S1600536804031009","","","0.71073","MoKα","","0.0263","0.0235","","","0.0675","0.0685","","","","","","1.109","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204870","9.4088","0.0006","10.2617","0.0008","12.6689","0.0008","90","","90","","90","","1223.19","0.15","193","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1S,2R,4R,5R)-tert-Butyl N-(4-hydroxymethyl-6-oxabicyclo[3.1.0]hex-2-yl)carbamate","","- C11 H19 N O4 -","- C11 H19 N O4 -","- C44 H76 N4 O16 -","4","1","CV6423","von Meltzer, Martin; Marsch, Michael; Carell, Thomas; Harms, Klaus","(1<i>S</i>,2<i>R</i>,4<i>R</i>,5<i>R</i>)-<i>tert</i>-Butyl <i>N</i>-(4-hydroxymethyl-6-oxabicyclo[3.1.0]hex-2-yl)carbamate","Acta Crystallographica Section E","2005","61","1","o23","o24","10.1107/S1600536804031563","","","0.71073","MoKα","","","0.0319","","","","0.0867","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204871","6.3","0.002","7.737","0.002","10.386","0.003","90","","106.712","0.004","90","","484.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,2-Bis(1,3-dithiolan-2-ylidene)hydrazine","","- C6 H8 N2 S4 -","- C6 H8 N2 S4 -","- C12 H16 N4 S8 -","2","0.5","CV6424","Liang-zhong Xu; Hai-Zhen Xu; Shuang-Hua Yang; Chun-Li Li; Kai Zhou","1,2-Bis(1,3-dithiolan-2-ylidene)hydrazine","Acta Crystallographica Section E","2005","61","1","o31","o32","10.1107/S1600536804031575","","","0.71073","MoKα","","0.0548","0.0456","","","0.1202","0.1304","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204872","9.5514","0.0004","18.0919","0.0008","35.497","0.002","90","","95.17","0.001","90","","6109","0.5","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","μ-Phthalato-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]","","- C68 H82 O4 Sn2 -","- C68 H82 O4 Sn2 -","- C272 H328 O16 Sn8 -","4","1","CV6425","Tian, Lai-Jin; Sun, Yu-Xi; Yang, Min; Ng, Seik Weng","μ-Phthalato-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]","Acta Crystallographica Section E","2005","61","1","m74","m75","10.1107/S1600536804031952","","","0.71073","MoKα","","0.0866","0.055","","","0.1042","0.1153","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204873","7.015","0.004","7.759","0.004","18.638","0.009","89.456","0.009","84.369","0.009","68.346","0.008","937.9","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Hydroxy-3-methoxybenzaldehyde 2,4-dinitropheylhydrazone dimethylformamide solvate","","- C17 H19 N5 O7 -","- C17 H19 N5 O7 -","- C34 H38 N10 O14 -","2","1","CV6426","Jing, Zuo-Liang; Yu, Ming; Chen, Xin; Diao, Chun-Hua; Deng, Qi-Liang; Fan, Zhi","2-Hydroxy-3-methoxybenzaldehyde 2,4-dinitrophenylhydrazone dimethylformamide solvate","Acta Crystallographica Section E","2005","61","1","o145","o146","10.1107/S1600536804032878","","","0.71073","MoKα","","0.1233","0.0555","","","0.1253","0.165","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204874","11.5299","0.0005","12.9081","0.0005","17.4774","0.0009","90","","94.538","0.004","90","","2593","0.2","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[1,3-Bis(2-pyridylimino)isoindolinato-κ^3^N,N',N'']chloro(1,2-dicyanobenzene- κN)(dimethyl sulfoxide-κS)ruthenium(II)","","- C28 H22 Cl N7 O Ru S -","- C28 H22 Cl N7 O Ru S -","- C112 H88 Cl4 N28 O4 Ru4 S4 -","4","1","CV6427","Tamil Selvi Pitchumony; Helen Stoeckli-Evans","[1,3-Bis(2-pyridylimino)isoindolinato-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']chloro(1,2-dicyanobenzene-κ<i>N</i>)(dimethyl sulfoxide-κ<i>S</i>)ruthenium(II)","Acta Crystallographica Section E","2005","61","1","m69","m71","10.1107/S1600536804031812","","","0.71073","MoKα","","0.0485","0.0406","","","0.0888","0.0942","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204875","21.731","0.002","8.1038","0.0007","15.1428","0.0016","90","","121.595","0.002","90","","2271.4","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2,2'-Bipyridine)bis(hydrogen isophthalato)zinc(II)","","- C26 H18 N2 O8 Zn -","- C26 H18 N2 O8 Zn -","- C104 H72 N8 O32 Zn4 -","4","0.5","CV6428","You-Fu Zhou; Wan-Juan Lin; Yong-Gui Huang; Mao-Chun Hong","(2,2'-Bipyridine)bis(hydrogen isophthalato)zinc(II)","Acta Crystallographica Section E","2005","61","1","m177","m179","10.1107/S1600536804033318","","","0.71073","MoKα","","","0.0814","","","0.1424","0.1686","","","","","","1.281","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204876","9.238","0.008","11.112","0.011","12.164","0.012","93.904","0.014","100.206","0.013","104.154","0.015","1183.5","1.9","163","2","163","2","","","","","","","","5","P -1","-P 1","2","","N-(4-ferrocenylphenyl)-4-piperidino-1,8-naphthalimide","","- C33 H28 Fe N2 O2 -","- C33 H28 Fe N2 O2 -","- C66 H56 Fe2 N4 O4 -","2","1","CV6430","McAdam, C. John; Robinson, Brian H.; Simpson, Jim","<i>N</i>-(4-Ferrocenylphenyl)-4-piperidino-1,8-naphthalimide","Acta Crystallographica Section E","2005","61","1","m110","m112","10.1107/S1600536804032271","","","0.71073","MoKα","","0.0956","0.045","","","0.0806","0.0905","","","","","","0.89","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204877","8.1984","0.0004","9.7549","0.0005","11.8636","0.0006","70.971","0.001","75.508","0.001","72.077","0.001","841.48","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","di-μ-adipato-κ^6^O,O':O'';O:O',O''-bis[aqua(1,10-phenanthroline- κ^2^N,N')zinc(II)]","","- C36 H36 N4 O10 Zn2 -","- C36 H36 N4 O10 Zn2 -","- C36 H36 N4 O10 Zn2 -","1","0.5","CV6431","Ding, Cai-Feng; Zhang, Shu-Sheng; Zhu, Mei; Li, Xue-Mei; Xu, Hong; Ouyang, Ping-Kai","Di-μ-adipato-κ^6^<i>O</i>,<i>O</i>':<i>O</i>'';<i>O</i>:<i>O</i>',<i>O</i>''-bis[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>)zinc(II)]","Acta Crystallographica Section E","2005","61","1","m147","m148","10.1107/S160053680403288X","","","0.71073","MoKα","","0.025","0.0239","","","0.0646","0.0653","","","","","","1.084","","","","has coordinates,has Fobs","197922","2020-10-21","18:00:00",""
"2204878","12.535","0.003","7.856","0.002","16.253","0.003","90","","90","","90","","1600.5","0.6","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","5-(N,N-Diethylamino)-4,6-diphenyl-1,2,3-triazine","","- C19 H20 N4 -","- C19 H20 N4 -","- C76 H80 N16 -","4","1","DN6169","Rozycka-Sokolowska, Ewa; Girek, Tomasz; Marciniak, Bernard; Pavlyuk, Volodymyr; Drabowicz, Jozef; Matsumoto, Kyoshi","5-(<i>N</i>,<i>N</i>-Diethylamino)-4,6-diphenyl-1,2,3-triazine","Acta Crystallographica Section E","2005","61","1","o93","o95","10.1107/S1600536804032003","","","0.71069","MoKα","","0.0435","0.0346","","","0.0861","0.0875","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204879","13.908","0.0008","13.8441","0.0008","14.4835","0.0009","90","","93.173","0.003","90","","2784.4","0.3","130","","130","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(2,2'-bipyridine)[1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(piperazin-4-ium- 1-yl)quinoline-3-carboxylato]nitratocopper(II) nitrate dihydrate","","- C26 H30 Cu F N7 O11 -","- C26 H30 Cu F N7 O11 -","- C104 H120 Cu4 F4 N28 O44 -","4","1","DN6179","Yong-Qin Wei; Zhang-Feng Zhou; Bo-Tao Zhuang; Ke-Chen Wu; Cai-Ping Liu; Ming-Xi Zhang","The mixed-ligand copper(II) complex (2,2'-bipyridine)[1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(piperazin-4-ium-1-yl)quinoline-3-carboxylato]nitratocopper(II) nitrate dihydrate","Acta Crystallographica Section E","2005","61","1","m66","m68","10.1107/S1600536804031861","","","0.71073","MoKα","","0.038","0.034","","","0.0782","0.0805","","","","","","1.087","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204880","27.158","0.002","9.0145","0.0007","18.1825","0.0015","90","","111.918","0.002","90","","4129.6","0.6","133","2","133","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-poly[[μ-cyano-1:2C:N-[1,3-bis(tetramethylguanidino)propane- 1κ^2^N,N']dicopper(II)]-μ-cyano-2:1'C:N]","","- C15 H30 Cu2 N8 -","- C15 H30 Cu2 N8 -","- C120 H240 Cu16 N64 -","8","1","DN6182","Herres-Pawlis, Sonja; Flörke, Ulrich; Henkel, Gerald","<i>catena</i>-Poly[[μ-cyano-[1,3-bis(tetramethylguanidino)propane]dicopper(I)]-μ-cyano]","Acta Crystallographica Section E","2005","61","1","m79","m81","10.1107/S160053680403199X","","","0.71073","MoKα","","0.0711","0.0391","","","0.0706","0.0778","","","","","","0.844","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204881","12.452","0.002","12.619","0.002","12.654","0.002","90","","96.002","0.001","90","","1977.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[silver(I)-μ~2~-2-methylpyrazine-μ~2~-trifluoroacetato], a re-investigation","","- C7 H6 Ag F3 N2 O2 -","- C7 H6 Ag F3 N2 O2 -","- C56 H48 Ag8 F24 N16 O16 -","8","2","DN6183","Zhu, Guang-Jun; You, Zhong-Lu; Zhu, Hai-Liang","Poly[silver(I)-μ~2~-2-methylpyrazine-μ~2~-trifluoroacetato], a reinvestigation","Acta Crystallographica Section E","2005","61","1","m87","m88","10.1107/S160053680403209X","","","0.71073","MoKα","","0.0559","0.0397","","","0.0888","0.0959","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2204882","11.298","0.003","11.841","0.002","12.776","0.003","108.28","0.02","112.84","0.02","98.71","0.02","1420.9","0.7","293","","293","","","","","","","","","5","P -1","-P 1","2","1-Chloro-4-propoxythioxanthone","1-Chloro-4-propoxy-10-thiaanthracen-9-one","","- C16 H13 Cl O2 S -","- C16 H13 Cl O2 S -","- C64 H52 Cl4 O8 S4 -","4","2","DN6184","Xuan-Gan Liu; Wei-Xiao Hu; Guo-Wu Rao","1-Chloro-4-propoxythioxanthone","Acta Crystallographica Section E","2005","61","1","o149","o150","10.1107/S1600536804031770","","","0.71073","MoKα","","0.0837","0.0419","","","0.1087","0.1281","","","","","","1.014","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204883","10.811","0.002","5.4155","0.0005","20.21","0.005","90","","98.871","0.001","90","","1169.1","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5,5-Dimethyl-2-oxo-tetrahydrofuran-3-yl benzoate","2,2-Dimethyl-5-oxo-2,3,4,5-tetrahydrofuran-3-yl benzoate","","- C13 H14 O4 -","- C13 H14 O4 -","- C52 H56 O16 -","4","1","FL6132","Hartung, Jens; Svoboda, Ingrid; Schmidt, Philipp; Pfeiffer, Matthias","2,2-Dimethyl-5-oxo-2,3,4,5-tetrahydrofuran-3-yl benzoate","Acta Crystallographica Section E","2005","61","1","o35","o36","10.1107/S1600536804031587","","","0.71073","MoKα","","0.0566","0.0391","","","0.0877","0.0953","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204884","16.029","0.011","12.985","0.009","21.106","0.014","90","","103.768","0.012","90","","4267","5","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","μ-4,4'-Di-4-pyridyldiazene-κ^2^N:N'- bis{[1,1,1-tris(diphenylphosphinomethyl)ethane-κP^3^]copper(I)} bis(tetrafluoroboride) dichloromethane solvate","","- C93 H88 B2 Cl2 Cu2 F8 N4 P6 -","- C93 H86 B2 Cl2 Cu2 F8 N4 P6 -","- C186 H172 B4 Cl4 Cu4 F16 N8 P12 -","2","0.5","FL6133","Yu, Mingming; Li, Zhanxian; Fu, Wenfu; Zhang, Junfeng","μ-4,4'-Di-4-pyridyldiazene-κ^2^<i>N</i>:<i>N</i>'-bis{[1,1,1-tris(diphenylphosphinomethyl)ethane-κ<i>P</i>^3^]copper(I)} bis(tetrafluoroborate) dichloromethane solvate","Acta Crystallographica Section E","2005","61","1","m98","m100","10.1107/S1600536804031903","","","0.71073","MoKα","","0.0933","0.0483","","","0.1227","0.1457","","","","","","1.049","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204885","9.3546","0.0002","10.7074","0.0002","19.9204","0.0005","90","","90","","90","","1995.3","0.08","160","2","160","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","17-allyl-16,17a-dioxo-17-aza-D-homoestra-1,3,5(10)-trien-3-yl acetate","","- C23 H27 N O4 -","- C23 H27 N O4 -","- C92 H108 N4 O16 -","4","1","FL6136","Hema, R.; Parthasarathi, V.; Ranju Bansal; Linden, Anthony","17-Allyl-16,17a-dioxo-17-aza-<small>D</small>-homoestra-1,3,5(10)-trien-3-yl acetate","Acta Crystallographica Section E","2005","61","1","o160","o162","10.1107/S1600536804033173","","","0.71073","MoKα","","0.0662","0.0467","","","0.1138","0.1279","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204886","5.8718","0.0019","10.202","0.003","10.629","0.003","97.621","0.006","101.621","0.006","93.951","0.006","615.2","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","N,N,N',N'-tetrabenzylethylenediamine","","- C30 H32 N2 -","- C30 H32 N2 -","- C30 H32 N2 -","1","0.5","GH6008","Zhaohui Pan; Mingjie Zhang; Dongyan Yuan; Penggao Ma","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrabenzylethylenediamine","Acta Crystallographica Section E","2005","61","1","o185","o186","10.1107/S1600536804033215","","","0.71073","MoKα","","0.0882","0.0453","","","0.1357","0.1807","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204887","8.566","0.006","8.807","0.007","18.729","0.017","90","","101.37","","90","","1385.2","1.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","catena-Poly[[(dihydrogenphosphato)silver(I)]-μ-4,4'-bipyridine] dihydrate]","","- C10 H14 Ag N2 O6 P -","- C10 H14 Ag N2 O6 P -","- C40 H56 Ag4 N8 O24 P4 -","4","1","HB6097","Wang, Li-Shi; Yang, Shi-Ping; Zhang, Jin-Feng","<i>catena</i>-Poly[[[(dihydrogenphosphato)silver(I)]-μ-4,4'-bipyridine] dihydrate]","Acta Crystallographica Section E","2005","61","1","m25","m26","10.1107/S1600536804031435","","","0.71073","MoKα","","0.1483","0.0908","","","0.2475","0.3281","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204888","8.0952","0.0005","13.957","0.0008","14.1416","0.0008","93.925","0.001","91.488","0.001","103.777","0.001","1546.7","0.16","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[(4'-phenyl-2,2':6',2''-terpyridine-κ^3^N)copper(II)]- μ-terephthalato-κ^2^O:O'] terephthalic acid]","","- C37 H25 Cu N3 O8 -","- C37 H25 Cu N3 O8 -","- C74 H50 Cu2 N6 O16 -","2","1","HB6119","Tu, Qi-Dong; Yin, Ye-Gao; Li, Dan; Huang, Xiao-Chun; Ng, Seik Weng","<i>catena</i>-Poly[[[(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>)copper(II)]-μ-terephthalato-κ^2^<i>O</i>:<i>O</i>'] terephthalic acid]","Acta Crystallographica Section E","2005","61","1","m103","m105","10.1107/S1600536804031940","","","0.71073","MoKα","","0.054","0.043","","","0.113","0.127","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204889","5.7221","0.0004","10.3906","0.0008","10.4865","0.0008","117.442","0.001","101.677","0.0008","92.951","0.001","534.31","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(2-amino-4,6-dimethylpyrimidine)(cadmium(II)thiocyante)","catena-Poly[[[diaquacadmium(II)]-di-μ-thiocyanato] bis(2-amino-4,6-dimethylpyrimidine)]","","- C14 H22 Cd N8 O2 S2 -","- C14 H22 Cd N8 O2 S2 -","- C14 H22 Cd N8 O2 S2 -","1","0.5","HB6125","Packianathan Thomas Muthiah; Madhukar Hemamalini; Ray J. Butcher","<i>catena</i>-Poly[[[diaquacadmium(II)]-di-μ-thiocyanato] bis(2-amino-4,6-dimethylpyrimidine)]","Acta Crystallographica Section E","2005","61","1","m63","m65","10.1107/S1600536804031721","","","0.71073","MoKα","","0.0342","0.0326","","","0.0853","0.0863","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204890","14.3214","0.0014","24.855","0.002","29.709","0.003","90","","90","","90","","10575.2","1.7","180","2","180","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Dipotassium hexakis({2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}nickel(II)) tetracyanonickel(II) methanol hexasolvate dihydrate","","- C106 H112 K2 N16 Ni7 O20 -","- C106 H112 K2 N16 Ni7 O20 -","- C424 H448 K8 N64 Ni28 O80 -","4","0.5","HB6126","Skovgaard, Signe; Bond, Andrew D.; McKenzie, Christine J.","Dipotassium hexakis({2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}nickel(II)) tetracyanonickelate(II) methanol hexasolvate dihydrate","Acta Crystallographica Section E","2005","61","1","m135","m137","10.1107/S160053680403154X","","","0.7107","MoKα","","0.1476","0.0547","","","0.1138","0.1451","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204891","9.2704","0.0019","11.161","0.002","11.456","0.002","108.72","0.03","106.56","0.03","90.39","0.03","1069.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[bis[[tetraaquacobalt(II)]-μ-4,4'-bipyridine-κ^2^N:N']] bis(3-carboxylatophenoxyacetate) dihydrate]","","- C38 H48 Co2 N4 O20 -","- C38 H48 Co2 N4 O20 -","- C38 H48 Co2 N4 O20 -","1","0.5","HB6127","Zhao, Jing-Gui; Gu, Chang-Sheng; Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei","<i>catena</i>-Poly[[[tetraaquacobalt(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 3-carboxylatophenoxyacetate monohydrate]","Acta Crystallographica Section E","2005","61","1","m33","m35","10.1107/S1600536804031447","","","0.71073","MoKα","","0.0827","0.0453","","","0.0914","0.1014","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204892","11.462","0.004","12.478","0.004","13.23","0.005","95.491","0.006","115.07","0.005","110.291","0.005","1540.6","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","μ-oxo-bis({2,2-[propane-1,2-diylbis(nitrilomethylidyne)]diphenolato}iron(III))","","- C34 H32 Fe2 N4 O5 -","- C34 H32 Fe2 N4 O5 -","- C68 H64 Fe4 N8 O10 -","2","1","HB6129","You, Zhong-Lu; Tang, Lu-Lu; Zhu, Hai-Liang","A dinuclear oxygen-bridged Schiff base iron(III) complex derived from <i>N</i>,<i>N</i>'-bis(2-hydroxybenzylidene)-1,2-diaminopropane","Acta Crystallographica Section E","2005","61","1","m36","m38","10.1107/S1600536804031368","","","0.71073","MoKα","","0.1124","0.0555","","","0.1315","0.1607","","","","","","0.906","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204893","17.416","0.005","7.624","0.005","17.667","0.005","90","","90","","90","","2345.8","1.8","100","","100","","","","","","","","","6","P c a 21","P 2c -2ac","29","","Dichlorobis[1-(2-ethoxyethyl)-1H-benzimidazole-κN^3^]nickel(II)","","- C22 H28 Cl2 N4 Ni O2 -","- C22 H28 Cl2 N4 Ni O2 -","- C88 H112 Cl8 N16 Ni4 O8 -","4","1","HB6130","Mehmet Akkurt; Selvi Karaca; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","Dichlorobis[1-(2-ethoxyethyl)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]nickel(II)","Acta Crystallographica Section E","2005","61","1","m41","m43","10.1107/S1600536804031356","","","0.71073","MoKα","","0.0279","0.0267","","","0.0686","0.0691","","","","","","1.067","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204894","14.509","0.005","6.9285","0.0019","12.806","0.003","90","","95.62","0.04","90","","1281.1","0.6","293","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tricarbonyl(η^5^-cyclopentadienyl)(3-iodopropyl)tungsten(II)","","- C11 H11 I O3 W -","- C11 H11 I O3 W -","- C44 H44 I4 O12 W4 -","4","1","HB6131","Holger B. Friedrich; Martin O. Onani; Melanie Rademeyer","Tricarbonyl(η^5^-cyclopentadienyl)(3-iodopropyl)tungsten(II)","Acta Crystallographica Section E","2005","61","1","m144","m146","10.1107/S1600536804032362","","","0.71073","MoKα","","0.0387","0.0318","","","0.0758","0.0784","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204895","23.5075","0.0013","13.9199","0.001","11.531","0.008","90","","90","","90","","3773","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-(2,6-Dichlorobenzylamino)-3,5-diphenyl-4H-1,2,4-triazole","","- C21 H16 Cl2 N4 -","- C21 H16 Cl2 N4 -","- C168 H128 Cl16 N32 -","8","1","HG6107","Atalay, Şehriman; Yavuz, Metin; Bekircan, Olcay; Alpay Karaoǧlu, Şengül; Şahinbaş, Esra; Şaşmaz, Selami","4-(2,6-Dichlorobenzylamino)-3,5-diphenyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","1","o90","o92","10.1107/S1600536804032179","","","0.71073","MoKα","","0.0912","0.0356","","","0.0688","0.0791","","","","","","0.752","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204896","8.335","0.003","10.034","0.003","20.017","0.006","90","","91.81","0.006","90","","1673.3","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[5,6:14,15-Dibenzo-1,4,8,12-tetraazacyclopentadeca-7,13-diene- 2,3-dione(2-)]nickel(II) monohydrate","","- C19 H18 N4 Ni O3 -","- C19 H18 N4 Ni O3 -","- C76 H72 N16 Ni4 O12 -","4","1","HG6112","Xiu-Li Wang; Ya-Qiu Sun","[5,6:14,15-Dibenzo-1,4,8,12-tetraazacyclopentadeca-7,13-diene-2,3-dione(2‒)]nickel(II) monohydrate","Acta Crystallographica Section E","2005","61","1","m171","m173","10.1107/S1600536804032969","","","0.71073","MoKα","","0.0436","0.03","","","0.0649","0.0697","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204897","8.595","0.002","8.868","0.002","11.628","0.003","77.197","0.004","79.27","0.004","73.478","0.004","821.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5,6-Dimethoxy-1-(toluene-4-sulfonyl)benzo[c]isoxazol-3(1H)-one","","- C16 H15 N O6 S -","- C16 H15 N O6 S -","- C32 H30 N2 O12 S2 -","2","1","HG6116","Shang, Zhenhua; Zhao, Kang","5,6-Dimethoxy-1-(4-tolylsulfonyl)benzo[<i>c</i>]isoxazol-3(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","1","o132","o133","10.1107/S160053680403260X","","","0.71073","MoKα","","0.0699","0.0414","","","","0.1263","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204898","14.1386","0.0002","9.9659","0.0001","18.2523","0.0003","90","","90.2765","0.0005","90","","2571.79","0.06","123","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Chlorobenzoylamino)-4-(8-chloro-5H-dibenzo[b,e][1,4]diazepin-11-yl)- 1-methylhexahydropyrazin-1-ium dichloromethane solvate","","- C26 H25 Cl4 N5 O -","- C26 H25 Cl4 N5 O -","- C104 H100 Cl16 N20 O4 -","4","1","HG6118","Capuano, Ben; Crosby, Ian T.; Egan, Simon J.; Fallon, Gary D.; Lloyd, Edward J.; Neve, Juliette E.","4-Chloro-<i>N</i>-[4-(8-chloro-5<i>H</i>-dibenzo[<i>b</i>,<i>e</i>][1,4]diazepin-11-yl)-1-methylpiperazinio]benzamidate dichloromethane solvate","Acta Crystallographica Section E","2005","61","1","o20","o22","10.1107/S1600536804031095","","","0.71073","MoKα","","","0.0533","","","","0.1111","","","","","","1.022","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204899","10.0407","0.0016","17.007","0.003","30.197","0.005","90","","90","","90","","5156.5","1.5","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4,4,6-Trimethyl-1-phenyl-3,4-dihydropyrimidine-2(1H)-thione","","- C13 H16 N2 S -","- C13 H16 N2 S -","- C208 H256 N32 S16 -","16","2","IS6010","Yamin, Bohari M.; Kasim, Noor Azilah M.; Hamzah, Noraini","4,4,6-Trimethyl-1-phenyl-3,4-dihydropyrimidine-2(1<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","1","o55","o57","10.1107/S1600536804031320","","","0.71073","MoKα","","0.0641","0.0581","","","0.1598","0.1638","","","","","","1.131","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204900","6.8297","0.0001","12.097","0.0002","27.8762","0.0004","90","","90","","90","","2303.1","0.06","83","2","83","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1S,2S)-1-{2-[(4-methoxybenzyl)oxy]ethyl}-2-methyl-3-butenyl (1S,4R)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate","","- C25 H34 O6 -","- C25 H34 O6 -","- C100 H136 O24 -","4","1","IS6013","Kai T. Meilert; George R. Clark; Tania Groutso; Margaret A. Brimble","(1<i>S</i>,2<i>S</i>)-1-{2-[(4-Methoxybenzyl)oxy]ethyl}-2-methyl-3-butenyl (1<i>S</i>,4<i>R</i>)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate","Acta Crystallographica Section E","2005","61","1","o6","o7","10.1107/S1600536804030946","","","0.71073","MoKα","","0.0535","0.0412","","","0.0862","0.0918","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204901","22.565","0.007","9.393","0.003","21.052","0.007","90","","115.682","0.008","90","","4021","2","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","16β-Bromo-17α-hydroxypregn-4-ene-3,20-dione","","- C21 H29 Br O3 -","- C21 H29 Br O3 -","- C168 H232 Br8 O24 -","8","2","IS6018","Shi Wang; Yongli Wang; Qiang Nie; Aishuang Xiang; Lina Zhou","16β-Bromo-17α-hydroxypregn-4-ene-3,20-dione","Acta Crystallographica Section E","2005","61","1","o1","o2","10.1107/S1600536804031083","","","0.71073","MoKα","","0.0954","0.0426","","","0.0778","0.0933","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204902","10.4974","0.0008","20.3856","0.0013","13.2263","0.001","90","","95.332","0.002","90","","2818.1","0.4","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[4-trimethylammonio)phenyl] disulfide tetraiodomercurate(II)","","- C18 H26 Hg I4 N2 S2 -","- C18 H26 Hg I4 N2 S2 -","- C72 H104 Hg4 I16 N8 S8 -","4","1","IS6020","Chen, Jin-Xiang; Zhang, Wen-Hua; Ren, Zhi-Gang; Zhang, Yong; Lang, Jian-Ping","Bis[4-(trimethylammonio)phenyl] disulfide tetraiodomercurate(II)","Acta Crystallographica Section E","2005","61","1","m60","m62","10.1107/S1600536804031630","","","0.7107","MoKα","","0.0481","0.0405","","","0.0963","0.1008","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204903","18.4522","0.0009","11.5264","0.0006","11.4079","0.0006","90","","90","","90","","2426.3","0.2","295","2","295","2","","","","","","","","5","P n n a","-P 2a 2bc","52","Tetra-n-butylammonium tetrachloro-iron","Tetrabutylammonium tetrachloroferrate(III)","","- C16 H36 Cl4 Fe N -","- C16 H36 Cl4 Fe N -","- C64 H144 Cl16 Fe4 N4 -","4","0.5","IS6021","Hay, Michael T.; Geib, Steven J.","Tetrabutylammonium tetrachloroferrate(III)","Acta Crystallographica Section E","2005","61","1","m190","m191","10.1107/S1600536804031824","","","0.71073","MoKα","","0.0804","0.0526","","","0.1623","0.1731","","","","","","1.331","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204904","10.281","0.003","10.672","0.004","12.945","0.005","79.209","0.015","67.071","0.012","63.502","0.013","1170.5","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","catena-Poly[[bis(O,O'-dimethyl dithiophosphato-κ^2^S,S')cadmium(II)]-μ-4,4'-bipyridine-N:N']","","- C14 H20 Cd N2 O4 P2 S4 -","- C14 H20 Cd N2 O4 P2 S4 -","- C28 H40 Cd2 N4 O8 P4 S8 -","2","1","IS6023","Tao Li; Zhi-Hua LI; Shao-Wu Du","<i>catena</i>-Poly[[bis(<i>O</i>,<i>O</i>'-dimethyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')cadmium(II)]-μ-4,4'-bipyridine-<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2005","61","1","m95","m97","10.1107/S1600536804031885","","","0.71073","MoKα","","0.0487","0.0418","","","0.1024","0.1086","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204905","13.345","0.0004","8.016","0.0004","12.378","0.0007","90","","104.391","0.003","90","","1282.57","0.11","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","p-nitrophenyl p-toluenesulfonate","4-Nitrophenyl 4-toluenesulfonate","","- C13 H11 N O5 S -","- C13 H11 N O5 S -","- C52 H44 N4 O20 S4 -","4","1","IS6024","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Fronczek Frank R","4-Nitrophenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O, C—H···π and van der Waals interactions","Acta Crystallographica Section E","2005","61","1","o75","o78","10.1107/S1600536804032015","","","0.71073","MoKα","","0.084","0.0372","","","0.0865","0.0915","","","","","","0.876","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204906","7.953","0.001","20.468","0.003","7.945","0.0009","90","","99.516","0.008","90","","1275.5","0.3","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","o-nitrophenyl o-toluenesulfonate","2-Nitrophenyl 4-toluenesulfonate","","- C13 H11 N O5 S -","- C13 H11 N O5 S -","- C52 H44 N4 O20 S4 -","4","1","IS6025","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Fronczek R. Frank","2-Nitrophenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O, C—H···π and π‒π interactions","Acta Crystallographica Section E","2005","61","1","o118","o120","10.1107/S1600536804032477","","","0.71073","MoKα","","0.1071","0.0612","","","0.1791","0.1867","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204907","7.535","0.001","7.935","0.001","19.368","0.003","90","","95.03","0.04","90","","1153.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[2-mercaptopyridine N-oxide(1-)-κ^2^N,O]platinum(II)","","- C10 H8 N2 O2 Pt S2 -","- C10 H8 N2 O2 Pt S2 -","- C40 H32 N8 O8 Pt4 S8 -","4","1","IS6026","Zhou, Jian-Hao; Li, Yi-Zhi; Liu, Zheng; Chen, Xue-Tai","Bis[2-mercaptopyridine <i>N</i>-oxide(1‒)-κ^2^<i>N,O</i>]platinum(II)","Acta Crystallographica Section E","2005","61","1","m195","m197","10.1107/S1600536804033264","","","0.71073","MoKα","","0.0663","0.0481","","","0.1061","0.1115","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204908","15.465","0.004","9.988","0.002","11.227","0.003","90","","93.554","0.003","90","","1730.8","0.7","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4-dimethyl-3-oxo-N-phenyl-2-(1H-1,2,4-triazol-1-yl)pentanethioamide monohydrate","","- C15 H20 N4 O2 S -","- C15 H20 N4 O2 S -","- C60 H80 N16 O8 S4 -","4","1","IS6027","Xu, Liang-Zhong; Xu, Hai-Zhen; Yu, Guan-Ping; Yang, Shuang-Hua; Li, Chun-Li","4,4-Dimethyl-3-oxo-<i>N</i>-phenyl-2-(1<i>H</i>-1,2,4-triazol-1-yl)pentanethioamide monohydrate","Acta Crystallographica Section E","2005","61","1","o163","o165","10.1107/S1600536804033276","","","0.71073","MoKα","","0.0876","0.0455","","","0.114","0.132","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204909","12.642","0.002","8.5036","0.0014","16.934","0.003","90","","98.488","0.003","90","","1800.5","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl 5-amino-3-methylisoxazole-4-carboxylate","","- C7 H10 N2 O3 -","- C7 H10 N2 O3 -","- C56 H80 N16 O24 -","8","1","IS6029","Sony, S. M. Malathy; Charles, P.; Ponnuswamy, M. N.; Yathirajan, H. S.; Nethaji, M.","Ethyl 5-amino-3-methylisoxazole-4-carboxylate","Acta Crystallographica Section E","2005","61","1","o198","o200","10.1107/S1600536804033720","","","0.71073","MoKα","","0.0935","0.0629","","","0.1379","0.1512","","","","","","1.137","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204910","16.6409","0.0011","8.7622","0.0006","13.9279","0.0009","90","","120.288","0.002","90","","1753.6","0.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Poly[[aquaneodymiun(III)]-μ~5~-citrato]","","- C6 H7 Nd O8 -","- C6 H7 Nd O8 -","- C48 H56 Nd8 O64 -","8","1","KP6015","Yuan, Da-Qiang; Xu, Yan-Qing; Wu, Ming-Yan; Hong, Mao-Chun","Poly[[aquaneodymium(III)]-μ~5~-citrato]","Acta Crystallographica Section E","2005","61","1","m108","m109","10.1107/S1600536804032210","","","0.71073","MoKα","","","0.0459","","","0.0976","0.1089","","","","","","1.156","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204911","11.853","0.002","5.052","0.0009","17.641","0.003","90","","102.72","0.009","90","","1030.4","0.3","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-Poly[-diaquazinc(II)]-μ-4-carboxylatophenoxyacetato]","","- C9 H10 O7 Zn -","- C9 H10 O7 Zn -","- C36 H40 O28 Zn4 -","4","0.5","KP6023","Zhao, Jing Gui; Gao, Shan; Huo, Li Hua; Ng, Seik Weng","<i>catena</i>-Poly[[diaquazinc(II)]-μ-4-carboxylatophenoxyacetato]","Acta Crystallographica Section E","2005","61","1","m115","m116","10.1107/S1600536804032222","","","0.71073","MoKα","","0.055","0.045","","","0.11","0.114","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204912","8.42","0.002","13.087","0.003","8.938","0.002","90","","116.45","0.03","90","","881.8","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,6-Diaminotoluene-4-sulfonic acid","2-amino-6-ammoniotoluene-4-sulfonate","","- C7 H10 N2 O3 S -","- C7 H10 N2 O3 S -","- C28 H40 N8 O12 S4 -","4","1","KP6024","Huo, Li Hua; Xu, Shi Xiao; Gao, Shan; Zain, Sharifuddin M.; Ng, Seik Weng","6-Amino-2-ammoniotoluene-4-sulfonate","Acta Crystallographica Section E","2005","61","1","o100","o101","10.1107/S1600536804032234","","","0.71073","MoKα","","0.072","0.045","","","0.103","0.115","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204913","5.9958","0.0013","15.891","0.003","13.085","0.003","90","","97.49","0.02","90","","1236.1","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2-hexyl-2H-tetrazole-κN^4^)copper(II)]-di-μ-chloro]","","- C7 H14 Cl2 Cu N4 -","- C7 H14 Cl2 Cu N4 -","- C28 H56 Cl8 Cu4 N16 -","4","1","KP6026","Lyakhov, Alexander S.; Gaponik, Pavel N.; Degtyarik, Michail M.; Ivashkevich, Ludmila S.","<i>catena</i>-Poly[[(2-hexyl-2<i>H</i>-tetrazole-κ<i>N</i>^4^)copper(II)]-di-μ-chloro]","Acta Crystallographica Section E","2005","61","1","m183","m186","10.1107/S1600536804033446","","","0.71073","MoKα","","0.0415","0.0327","","","0.0879","0.0948","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204914","8.5896","0.0014","9.3966","0.0015","10.9312","0.0018","96.489","0.002","99.109","0.002","103.805","0.002","835.5","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Methyl 5-hydroxy-2-(2-hydroxy-6-methoxy-4-methylbenzoyl)-3-methoxybenzoate","","- C18 H18 O7 -","- C18 H18 O7 -","- C36 H36 O14 -","2","1","KP6028","Shu, Ren-Geng; Zhu, Hai-Liang; Tan, Ren-Xiang","Methyl 5-hydroxy-2-(2-hydroxy-6-methoxy-4-methylbenzoyl)-3-methoxybenzoate","Acta Crystallographica Section E","2005","61","1","o189","o191","10.1107/S160053680403346X","","","0.71073","MoKα","","0.0768","0.0633","","","0.1439","0.1505","","","","","","1.156","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204915","8.1027","0.0016","12.668","0.003","13.436","0.003","110.74","0.03","92.41","0.03","103.37","0.03","1243.1","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(Acetato-κO)[diacetyl monooxime (4-methoxybenzoyl)hydrazonato- κ^3^O,N,N']bis(pyridine-κN)nickel(II)","","- C24 H27 N5 Ni O5 -","- C24 H27 N5 Ni O5 -","- C48 H54 N10 Ni2 O10 -","2","1","KP6029","Shan Gao; Li-Hua Huo; Zhao-Peng Deng; Hui Zhao","(Acetato-κ<i>O</i>)[diacetyl monooxime (4-methoxybenzoyl)hydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>']bis(pyridine-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2005","61","1","m152","m154","10.1107/S1600536804033495","","","0.71073","MoKα","","0.0641","0.0407","","","0.0906","0.1043","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204916","15.0216","0.0013","9.6464","0.0008","12.6545","0.001","90","","100.708","0.006","90","","1801.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-methyl-1-(1,2,3,9-tetrahydro-9-methyl-4-oxo-4H-carbazol-3-ylmethyl)-1H- imidazol-3-ium chloride dihydrate","","- C18 H24 Cl N3 O3 -","- C18 H24 Cl N3 O3 -","- C72 H96 Cl4 N12 O12 -","4","1","LH6309","Bolte, Michael; Yathirajan, Hemmige S.; Nagaraj, B.; Nagaraja, P.","Disorder in ondansetron hydrochloride dihydrate","Acta Crystallographica Section E","2005","61","1","o47","o48","10.1107/S1600536804028971","","","0.71073","MoKα","","0.0455","0.0328","","","0.0842","0.0872","","","","","","0.956","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204917","7.2051","0.0019","12.139","0.003","12.732","0.003","84.319","0.005","82.17","0.005","80.583","0.005","1085","0.5","100","2","273","2","","","","","","","","6","P -1","-P 1","2","","3-Methoxycarbonyl-1-methylpyridinium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(II)","","- C14 H10 N Ni O2 S10 -","- C14 H10 N Ni O2 S10 -","- C28 H20 N2 Ni2 O4 S20 -","2","1","LH6312","Tomono, Kazuaki; Sasaki, Yuka; Miyamura, Kazuo","3-Methoxycarbonyl-1-methylpyridinium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(II)","Acta Crystallographica Section E","2005","61","1","m18","m20","10.1107/S1600536804031034","","","0.71073","MoKα","","0.0861","0.0639","","","0.1776","0.1847","","","","","","1.067","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204918","7.518","0.003","14.801","0.01","7.678","0.006","90","","91.91","0.05","90","","853.9","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4-hydroxy-2,6-dimethoxybenzaldehyde","4-hydroxy-2,6-dimethoxybenzaldehyde","","- C9 H10 O4 -","- C9 H10 O4 -","- C36 H40 O16 -","4","1","LH6314","Wuyts, Cindy; Vande Velde, Christophe M. L.; Geise, Herman J.; Blockhuys, Frank","4-Hydroxy-2,6-dimethoxybenzaldehyde","Acta Crystallographica Section E","2005","61","1","o79","o80","10.1107/S1600536804030053","","","0.71073","MoKα","","0.1294","0.0537","","","0.0964","0.1199","","","","","","0.968","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204919","15.563","0.004","7.2595","0.0017","15.425","0.004","90","","113.412","0.003","90","","1599.2","0.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,3,5,6-tetramethylpyrazine 1,4-dioxide‒diaquadithiocyanatezinc(II) (1/1)","","- C10 H16 N4 O4 S2 Zn -","- C10 H16 N4 O4 S2 Zn -","- C40 H64 N16 O16 S8 Zn4 -","4","1","LH6323","Shi, Jing-Min; Zhang, Xia; Lu, Jian-Jun; Liu, Lian-Dong; Ma, Jian-Ping","The 1:1 adduct of 2,3,5,6-tetramethylpyrazine 1,4-dioxide and diaquabis(thiocyanato-κ<i>N</i>)zinc(II) (ATD)","Acta Crystallographica Section E","2005","61","1","m47","m49","10.1107/S1600536804031599","","","0.71073","MoKα","","0.0435","0.0354","","","0.0921","0.0963","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204920","9.521","0.001","9.41","0.001","17.426","0.002","90","","103.44","0.01","90","","1518.5","0.3","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","perfluoro 6-isopropyl-2,4,5-trimethyl-benzenecarbonitrile","3-fluoro-6-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-2,4,5- tris(trifluoromethyl)benzonitrile","","- C13 F17 N -","- C13 F17 N -","- C52 F68 N4 -","4","1","LH6327","Batsanov, Andrei S.; Richmond, Paul; Sandford, Graham; Chambers, Richard D.","Perfluorinated 6-isopropyl-2,4,5-trimethylbenzonitrile","Acta Crystallographica Section E","2005","61","1","o45","o46","10.1107/S1600536804031745","","","0.71073","MoKα","","0.1277","0.0574","","","0.1078","0.134","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204921","8.523","0.001","22.678","0.005","7.769","0.002","90","","93.388","0.015","90","","1499","0.5","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(Anthracen-9-ylmethyl)diethylamine at 100K","","- C19 H21 N -","- C19 H21 N -","- C76 H84 N4 -","4","1","LH6328","Howie, R. Alan; Kindness, Andrew; McKay, Michael G.; Maguire, Glenn E. M.","(Anthracen-9-ylmethyl)diethylamine at 100K","Acta Crystallographica Section E","2005","61","1","o52","o54","10.1107/S1600536804031265","","","0.71073","MoKα","","0.0681","0.0476","","","0.1264","0.1367","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204922","12.8111","0.0003","14.8721","0.0004","12.8378","0.0003","90","","91.3964","0.0014","90","","2445.23","0.1","160","1","160","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-Bis(8-hydroxyquinolinato-κ^2^N,O)diphenyltin(IV)","","- C30 H22 N2 O2 Sn -","- C30 H22 N2 O2 Sn -","- C120 H88 N8 O8 Sn4 -","4","1","LH6330","Linden, Anthony; Basu Baul, Tushar S.; Mizar, Archana","<i>cis</i>-Bis(8-hydroxyquinolinato-κ^2^<i>N</i>,<i>O</i>)diphenyltin(IV)","Acta Crystallographica Section E","2005","61","1","m27","m29","10.1107/S1600536804031277","","","0.71073","MoKα","","0.0632","0.0374","","","0.0799","0.0909","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204923","15.815","0.006","15.815","0.006","16.773","0.009","90","","90","","90","","4195","3","110","2","110","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","Dichlorotetrapyridinenickel(II) 0.76-hydrate","","- C20 H21.52 Cl2 N4 Ni O0.76 -","- C20 H21.52 Cl2 N4 Ni O0.76 -","- C160 H172.16 Cl16 N32 Ni8 O6.08 -","8","0.25","LH6331","Zhang, Hui; Fang, Liang","Dichlorotetrapyridinenickel(II) 0.76-hydrate","Acta Crystallographica Section E","2005","61","1","m180","m182","10.1107/S1600536804033586","","","0.71073","MoKα","","0.0383","0.022","","","0.047","0.0485","","","","","","0.831","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204924","8.6851","0.0011","10.6167","0.0009","12.433","0.0012","106.724","0.008","101.049","0.01","107.406","0.008","998.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-tert-Butyl-1-(4-chlorophenyl)-7,7-dimethyl-5,6,7,8- tetrahydroimidazo[3,4-b]quinolin-5-one","","- C22 H24 Cl N3 O -","- C22 H24 Cl N3 O -","- C44 H48 Cl2 N6 O2 -","2","1","LH6332","Low, John N.; Cobo, Justo; Mera, Jaime; Quiroga, Jairo; Glidewell, Christopher","3-<i>tert</i>-Butyl-1-(4-chlorophenyl)-7,7-dimethyl-5,6,7,8-tetrahydropyrazolo[3,4-<i>b</i>]quinolin-5-one: centrosymmetric dimers generated by C—H···π(arene) hydrogen bonds","Acta Crystallographica Section E","2005","61","1","o49","o51","10.1107/S1600536804031927","","","0.71073","MoKα","","0.2329","0.0528","","","0.0979","0.1218","","","","","","0.93","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204925","20.829","0.002","8.428","0.001","6.8415","0.0008","90","","108.402","0.002","90","","1139.6","0.2","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Melaminium(2+) di(hydrogen oxalate)","","- C7 H10 N6 O8 -","- C7 H10 N6 O8 -","- C28 H40 N24 O32 -","4","0.5","LH6334","Zhang, Xiu-Lian; Chen, Xiao-Ming; Ng, Seik Weng","Melaminium bis(hydrogen oxalate)","Acta Crystallographica Section E","2005","61","1","o156","o157","10.1107/S1600536804033239","","","0.71073","MoKα","","0.049","0.041","","","0.11","0.116","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204926","7.0522","0.0005","9.9537","0.0008","9.9895","0.0007","83.607","0.006","80.386","0.006","89.477","0.006","687.04","0.09","100","","100","","","","","","","","","5","P -1","-P 1","2","","1-[2-(5-Nitrobenzimidazol-1-yl)ethyl]morpholinium chloride","","- C13 H17 Cl N4 O3 -","- C13 H17 Cl N4 O3 -","- C26 H34 Cl2 N8 O6 -","2","1","LH6336","Mehmet Akkurt; Sevim Türktekin; Hasan Küçükbay; Ülkü Yılmaz; Orhan Büyükgüngör","1-[2-(5-Nitro-1<i>H</i>-benzimidazol-1-yl)ethyl]morpholinium chloride","Acta Crystallographica Section E","2005","61","1","o166","o168","10.1107/S1600536804033240","","","0.71073","MoKα","","0.0304","0.0269","","","0.0678","0.0693","","","","","","1.056","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204927","15.405","0.003","8.886","0.0018","11.105","0.002","90","","100.75","0.03","90","","1493.5","0.5","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Bis(methylenedithio)tetrathiafulvalene dichloride","4,5:4',5'-Bis(methylenedithio)tetrathiafulvalenium dichloride","","- C8 H4 Cl2 S8 -","- C8 H4 Cl2 S8 -","- C32 H16 Cl8 S32 -","4","0.5","NC6006","Xun-Wen Xiao; Wei Xu; Hai Xu; De-Qing Zhang; Dao-Ben Zhu","4,5:4',5'-Bis(methylenedithio)tetrathiafulvalenium dichloride","Acta Crystallographica Section E","2005","61","1","o111","o113","10.1107/S1600536804032350","","","0.71073","MoKα","","0.0978","0.0603","","","0.164","0.1766","","","","","","0.934","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204928","7.0561","0.0014","7.5531","0.0015","7.6261","0.0015","90","","117.36","0.03","90","","360.97","0.16","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Poly[aquamanganese(II)-μ~3~-1H-imidazole-4,5-dicarboxylato]","","- C5 H4 Mn N2 O5 -","- C5 H4 Mn N2 O5 -","- C10 H8 Mn2 N4 O10 -","2","1","NC6009","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","Poly[aquamanganese(II)-μ~3~-1<i>H</i>-imidazole-4,5-dicarboxylato]","Acta Crystallographica Section E","2005","61","1","m155","m157","10.1107/S1600536804033306","","","0.71073","MoKα","","0.0241","0.0219","","","0.0479","0.0487","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204929","11.3447","0.001","13.4618","0.0011","29.91","0.003","90","","98.65","0.002","90","","4515.9","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[[tris(di-2-pyridylamine)bis(μ-5-sulfonatosalicylato)tricopper(II)] trihydrate]","","- C44 H39 Cu3 N9 O15 S2 -","- C44 H35 Cu3 N9 O15 S2 -","- C176 H140 Cu12 N36 O60 S8 -","4","0.5","NC6010","Fan, Sai-Rong; Zhu, Long-Guan","Poly[[tris(di-2-pyridylamine)tris(μ-5-sulfonatosalicylato)tricopper(II)] trihydrate]","Acta Crystallographica Section E","2005","61","1","m174","m176","10.1107/S1600536804032908","","","0.71073","MoKα","","0.0563","0.0422","","","0.0975","0.1018","","","","","","0.956","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204930","7.0624","0.0011","10.3895","0.0016","12.7945","0.0019","91.557","0.012","91.519","0.012","104.011","0.012","910","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","diaquatetrakis(μ-1,2-benzenedicarboxylato)di-μ-nitrato-pentastrontium(II)","","- C32 H20 N2 O24 Sr5 -","- C32 H20 N2 O24 Sr5 -","- C32 H20 N2 O24 Sr5 -","1","0.5","NC6011","Stein, Irena; Ruschewitz, Uwe","Polymeric diaquatetrakis(μ-1,2-benzenedicarboxylato)di-μ-nitrato-pentastrontium(II)","Acta Crystallographica Section E","2005","61","1","m141","m143","10.1107/S1600536804032805","","","0.71073","MoKα","","0.0568","0.0338","","","0.0775","0.0912","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204931","4.0159","0.0003","23.6948","0.0014","12.7652","0.0011","90","","91.642","0.007","90","","1214.19","0.16","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(3,4-Methylenedioxyphenoxy)phthalonitrile","","- C15 H8 N2 O3 -","- C15 H8 N2 O3 -","- C60 H32 N8 O12 -","4","1","NC6012","Ocak Iskeleli, Nazan; Ag̃ar, Ayşen","4-(3,4-Methylenedioxyphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","1","o158","o159","10.1107/S1600536804033094","","","0.71073","MoKα","","0.0549","0.0445","","","0.119","0.1272","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204932","10.0696","0.0017","9.4318","0.0016","10.1752","0.0019","90","","95.178","0.014","90","","962.4","0.3","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","Pioglitazone hydrochloride","(±)-5-({4-[2-(5-ethyl-2-pyridinio)ethoxy]phenyl}methyl)thiazolidine-2,4-dione chloride","","- C19 H21 Cl N2 O3 S -","- C19 H21 Cl N2 O3 S -","- C38 H42 Cl2 N4 O6 S2 -","2","1","NC6013","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Nagaraja, Padmarajaiah; Bolte, Michael","Pioglitazone hydrochloride","Acta Crystallographica Section E","2005","61","1","o154","o155","10.1107/S1600536804033100","","","0.71073","MoKα","","0.0459","0.0348","","","0.0718","0.074","","","","","","0.828","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204933","8.0458","0.0009","10.5193","0.0011","15.7386","0.0017","98.073","0.009","90.542","0.009","103.744","0.008","1279.8","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Phthaloyl amlodipine","3-ethyl 5-methyl 4-(2-chlorophenyl)-2-(2-phthalmidoethoxymethyl)-6-methyl-1,4- dihydropyridine-3,5-dicarboxylate","","- C28 H27 Cl N2 O7 -","- C28 H27 Cl N2 O7 -","- C56 H54 Cl2 N4 O14 -","2","1","NC6014","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Bolte, Michael","Phthaloyl amlodipine","Acta Crystallographica Section E","2005","61","1","o174","o175","10.1107/S1600536804033471","","","0.71073","MoKα","","0.0485","0.0337","","","0.0831","0.0875","","","","","","0.952","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204934","21.0397","0.0019","11.6598","0.0012","8.6694","0.0008","90","","92.935","0.007","90","","2124","0.4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","N-Amino-3-methyl-2,3-dihydro-1,3-benzothiazoliminium chloride monohydrate","","- C8 H12 Cl N3 O S -","- C8 H12 Cl N3 O S -","- C64 H96 Cl8 N24 O8 S8 -","8","1","NC6015","Yathirajan, Hemmige S.; Narasegowda, Rajenahally S.; Bolte, Michael","<i>N</i>-Amino-3-methyl-2,3-dihydro-1,3-benzothiazoliminium chloride monohydrate","Acta Crystallographica Section E","2005","61","1","o176","o178","10.1107/S1600536804033483","","","0.71073","MoKα","","0.0272","0.0232","","","0.0631","0.064","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204935","12.7882","0.001","6.9977","0.0005","21.3137","0.0017","90","","105.994","0.001","90","","1833.5","0.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua{2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]diphenolato}(thiocyanato)cobalt(III)","","- C18 H18 Co N3 O3 S -","- C18 H18 Co N3 O3 S -","- C72 H72 Co4 N12 O12 S4 -","4","1","NG6068","Sun, Yu-Xi","Aqua(isothiocyanato){2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato}cobalt(III)","Acta Crystallographica Section E","2005","61","1","m39","m40","10.1107/S1600536804031307","","","0.71073","MoKα","","0.0757","0.0581","","","0.1493","0.1606","","","","","","1.066","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204936","9.5529","0.0011","12.6089","0.0014","13.7463","0.0016","90","","95.238","0.002","90","","1648.8","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2,2'-bipyridine)copper(II)]-μ-5-nitroisophthalato]","","- C18 H11 Cu N3 O6 -","- C18 H11 Cu N3 O6 -","- C72 H44 Cu4 N12 O24 -","4","1","NG6073","Hong-Ping Xiao; Xin-Hua Li; Ya-Qian Cheng","<i>catena</i>-Poly[[(2,2'-bipyridine)copper(II)]-μ-5-nitroisophthalato]","Acta Crystallographica Section E","2005","61","1","m158","m159","10.1107/S1600536804032970","","","0.71073","MoKα","","0.0465","0.0397","","","0.0931","0.0966","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204937","6.9025","0.0014","16.504","0.003","16.77","0.003","90","","90","","90","","1910.4","0.6","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(Benzotriazol-1-yl)-2-(α-hydroxybenzyl)-N-phenylthioacrylamide","","- C21 H16 Cd N2 O6 -","- C21 H16 Cd N2 O6 -","- C84 H64 Cd4 N8 O24 -","4","1","NG6078","Gao, Shan; Huo, Li-Hua; Gu, Chang-Sheng; Zhao, Jing-Gui","<i>catena</i>-Poly[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-4-carboxylatophenoxyacetato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>'']","Acta Crystallographica Section E","2005","61","1","m198","m200","10.1107/S160053680403377X","","","0.71073","MoKα","","0.0577","0.0395","","","0.0586","0.0619","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204938","21.399","0.008","7.504","0.005","24.891","0.016","90","","120.15","0.04","90","","3456","4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2,2'-Bipyridine-κ^2^N,N')(3-oxidonaphthalene-2-carboxylato- κ^2^O:O')palladium(II) hemihydrate","","- C21 H15 N2 O3.5 Pd -","- C21 H15 N2 O3.5 Pd -","- C168 H120 N16 O28 Pd8 -","8","2","OB6443","Yue Wang; Nobuo Okabe","(2,2'-Bipyridine-κ^2^<i>N,N</i>')(3-oxidonaphthalene-2-carboxylato-κ^2^<i>O</i>:<i>O</i>')palladium(II) hemihydrate","Acta Crystallographica Section E","2005","61","1","m3","m5","10.1107/S1600536804030983","","","0.71073","MoKα","","0.0997","0.0312","","","0.0402","0.0442","","","","","","0.658","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204939","9.53","0.005","9.561","0.006","11.609","0.005","108.472","0.005","93.918","0.006","92.673","0.005","998.3","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[silver(I)-μ-propane-1,3-diamine-κ^2^N:N'] bis(4-nitrobenzoato-κO)silver(I)]","","- C17 H18 Ag2 N4 O8 -","- C17 H18 Ag2 N4 O8 -","- C34 H36 Ag4 N8 O16 -","2","1","OB6444","You, Zhong-Lu; Wang, Zuo-Mao; Zou, Ying; Zhu, Hai-Liang","<i>catena</i>-Poly[[silver(I)-μ-propane-1,3-diamine-κ^2^<i>N</i>:<i>N</i>'] bis(4-nitrobenzoato-κ<i>O</i>)argentate(I)]","Acta Crystallographica Section E","2005","61","1","m6","m8","10.1107/S1600536804031071","","","0.71073","MoKα","","0.0502","0.0436","","","0.1078","0.1182","","","","","","1.067","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204940","9.7879","0.0008","7.9071","0.0005","13.8045","0.001","90","","102.266","0.006","90","","1043.99","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Ethyl-5-(2-hydroxyphenyl)-2H-1,2,4-triazole-3(4H)-thione","","- C10 H11 N3 O S -","- C10 H11 N3 O S -","- C40 H44 N12 O4 S4 -","4","1","OB6445","Dege, Necmi; Özdemir, Namık; Çetin, Ahmet; Cansız, Ahmet; Şekerci, Memet; Dinçer, Muharrem","4-Ethyl-5-(2-hydroxyphenyl)-2<i>H</i>-1,2,4-triazole-3(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","1","o17","o19","10.1107/S1600536804031137","","","0.71073","MoKα","","0.0361","0.0305","","","0.0836","0.0863","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204941","11.229","0.001","9.207","0.001","19.086","0.001","90","","125.4","0.01","90","","1608.4","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-(3-Methylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole","","- C19 H15 N5 -","- C19 H15 N5 -","- C76 H60 N20 -","4","1","OB6446","Zhang, Shu-Ping; You, Zhong-Lu; Shao, Si-Chang; Zhu, Hai-Liang","4-(3-Methylphenyl)-3,5-di-2-pyridyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","1","o27","o28","10.1107/S1600536804031319","","","0.71073","MoKα","","0.1261","0.0644","","","0.1128","0.1357","","","","","","1.01","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204942","11.704","0.001","19.935","0.002","8.181","0.001","90","","107.58","0.002","90","","1819.6","0.3","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-(4-Isopropylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole","","- C21 H19 N5 -","- C21 H19 N5 -","- C84 H76 N20 -","4","1","OB6447","Zhang, Shu-Ping; You, Zhong-Lu; Shao, Si-Chang; Zhu, Hai-Liang","4-(4-Isopropylphenyl)-3,5-di-2-pyridyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","1","o8","o9","10.1107/S1600536804031101","","","0.71073","MoKα","","0.0803","0.05","","","0.1114","0.1263","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204943","8.294","0.0017","12.654","0.003","23.601","0.005","90","","97.02","0.03","90","","2458.4","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 3-(dimethylamino)-2-[2-(1-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}- 2-(dimethylamino)vinyloxy)phenyl]acrylate","","- C25 H28 N4 O4 S -","- C25 H28 N4 O4 S -","- C100 H112 N16 O16 S4 -","4","1","OB6448","Wang, Hai-Bo; Chen, Jia-Hui; Pu, Yue-Qing; Wang, Jin-Tang","Methyl 3-(dimethylamino)-2-[2-(1-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-2-(dimethylamino)vinyloxy)phenyl]acrylate","Acta Crystallographica Section E","2005","61","1","o58","o59","10.1107/S1600536804031897","","","0.71073","MoKα","","0.1474","0.0582","","","0.1653","0.2111","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204944","12.355","0.001","21.912","0.002","8.972","0.001","90","","95.58","0.01","90","","2417.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(6,6'-dimethyl-2,2'-bipyridine)copper(I) perchlorate","","- C24 H24 Cl Cu N4 O4 -","- C24 H24 Cl Cu N4 O4 -","- C96 H96 Cl4 Cu4 N16 O16 -","4","1","OB6449","Cui, Guang-Hua; Li, Jian-Rong; Gao, Di; Ng, Seik Weng","Bis(6,6'-dimethyl-2,2'-bipyridine)copper(I) perchlorate","Acta Crystallographica Section E","2005","61","1","m72","m73","10.1107/S1600536804031939","","","0.71073","MoKα","","0.088","0.049","","","0.126","0.151","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204945","9.058","0.001","12.931","0.001","17.879","0.001","85.011","0.001","80.643","0.001","84.314","0.001","2050.8","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Diaquatris(nicotinato-κO)bis(1,10-phenanthroline-κ^2^N,N')cerium(III) trihydrate","","- C42 H38 Ce N7 O11 -","- C42 H38 Ce N7 O11 -","- C84 H76 Ce2 N14 O22 -","2","1","OB6450","Liu, Fu-Chen; Li, Jian-Rong; Ng, Seik Weng","Diaquatris(nicotinato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N,N</i>')cerium(III) trihydrate","Acta Crystallographica Section E","2005","61","1","m9","m10","10.1107/S1600536804031125","","","0.71073","MoKα","","0.05","0.034","","","0.066","0.077","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204946","11.304","0.003","9.485","0.003","17.835","0.005","90","","97.434","0.002","90","","1896.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis[2-(4-pyridinio)-1H-benzimidazolium] hexacosaoxooctamolybdenum(VI)","","- C24 H22 Mo8 N6 O26 -","- C24 H22 Mo8 N6 O26 -","- C48 H44 Mo16 N12 O52 -","2","0.5","OB6451","Li-Juan Chen; Chang-Kun Xia; Quan-Zheng Zhang; Can-Zhong Lu","Bis[2-(4-pyridinio)-1<i>H</i>-benzimidazolium] hexacosaoxooctamolybdate(VI)","Acta Crystallographica Section E","2005","61","1","m92","m94","10.1107/S1600536804032027","","","0.71073","MoKα","","0.0502","0.0427","","","0.1073","0.1136","","","","","","1.085","","","","has coordinates,has Fobs","201211","2020-10-21","18:00:00",""
"2204947","10.277","0.001","6.9852","0.0005","25.695","0.003","90","","92.512","0.009","90","","1842.8","0.3","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Amino-1-(3,4-methylenedioxyphenyl)-9-methoxy-5,6-dihydro-1H- benzo[f]chromene-2-carbonitrile","","- C22 H18 N2 O4 -","- C22 H18 N2 O4 -","- C88 H72 N8 O16 -","4","1","OB6452","Chen-Xia Yu; Da-Qing Shi; Xiang-Shan Wang; Qi-Ya Zhuang","3-Amino-1-(3,4-methylenedioxyphenyl)-9-methoxy-5,6-dihydro-1<i>H</i>-benzo[<i>f</i>]chromene-2-carbonitrile","Acta Crystallographica Section E","2005","61","1","o84","o86","10.1107/S1600536804032039","","","0.71073","MoKα","","0.0637","0.0354","","","0.0759","0.0824","","","","","","0.861","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204948","7.5757","0.0005","12.7812","0.0004","12.9142","0.0008","62.186","0.005","89.802","0.008","74.08","0.006","1052.09","0.12","193","2","193","2","","","","","","","","5","P -1","-P 1","2","Methyl 2-amino-4-(4-chlorophenyl)-4H-pyrano[3,2-c]coumarin-3-carboxylate N,N-dimethylformamide solvate","methyl 2-amino-4-(4-chlorophenyl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carboxylate N,N-dimethylformamide solvate","","- C23 H21 Cl N2 O6 -","- C23 H21 Cl N2 O6 -","- C46 H42 Cl2 N4 O12 -","2","1","OB6453","Daqing Shi; Nan Wu; Qiya Zhuang; Yong Zhang","Methyl 2-amino-4-(4-chlorophenyl)-4<i>H</i>-pyrano[3,2-<i>c</i>]coumarin-3-carboxylate <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2005","61","1","o87","o89","10.1107/S1600536804032040","","","0.7107","MoKα","","0.0419","0.0381","","","0.0987","0.102","","","","","","1.055","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204949","9.525","0.003","5.992","0.003","14.817","0.002","90","","94.77","0.02","90","","842.7","0.5","290","","290","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[1-(hydroxyethylamino)propyl]phosphonic acid","[1-(hydroxyethylammonio)propyl]phosphonate","","- C5 H14 N O4 P -","- C5 H14 N O4 P -","- C20 H56 N4 O16 P4 -","4","1","OB6454","Shivachev, Boris; Petrova, Rosica; Kossev, Krassimir; Troev, Kolio","[1-(Hydroxyethylammonio)propyl]phosphonate","Acta Crystallographica Section E","2005","61","1","o134","o136","10.1107/S1600536804032623","","","0.71073","MoKα","","0.0622","0.0421","","","0.108","0.1232","","","","","","0.877","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204950","10.9","0.002","12.197","0.002","14.772","0.003","91.86","0.01","91.53","0.02","92.28","0.01","1960.5","0.6","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,2'-bipyridine-κN,N'){[5-(carboxymethylsulfanyl)-1,3,4-thiadiazol-2- ylsulfanyl]acetato-κO}copper(II) 5-(carboxymethylsulfanyl)-1,3,4-thiadiazol-2-ylsulfanylacetate dihydrate","","- C32 H30 Cu N8 O10 S6 -","- C32 H30 Cu N8 O10 S6 -","- C64 H60 Cu2 N16 O20 S12 -","2","1","OB6456","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","Bis(2,2'-bipyridine-κ<i>N</i>,<i>N</i>'){[5-(carboxymethylsulfanyl)-1,3,4-thiadiazol-2-ylsulfanyl]acetato-κ<i>O</i>}copper(II) [5-(carboxymethylsulfanyl)-1,3,4-thiadiazol-2-ylsulfanyl]acetate dihydrate","Acta Crystallographica Section E","2005","61","1","m126","m128","10.1107/S1600536804032647","","","0.71073","MoKα","","0.077","0.052","","","0.141","0.156","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204951","11.2374","0.0008","11.2374","0.0008","24.648","0.003","90","","90","","120","","2695.5","0.4","293","2","123","2","","","","","","","","7","P 63 2 2","P 6c 2c","182","","tris(ethylenediamine-κ^2^N,N')cobalt(III) chloride diiodide monohydrate","","- C6 H26 Cl Co I2 N6 O -","- C6 H26 Cl Co I2 N6 O -","- C36 H156 Cl6 Co6 I12 N36 O6 -","6","0.5","RZ6010","Zhang, Zhang-Jing; Zheng, Fa-Kun; Fu, Ming-Lai; Guo, Guo-Cong; Huang, Jin-Shun","A new cobalt(III) ethylenediamine complex with mixed halide counter-anions, [Co(en)~3~](Cl)(I)~2~·H~2~O","Acta Crystallographica Section E","2005","61","1","m89","m91","10.1107/S1600536804030272","","","0.71073","MoKα","","0.0906","0.0529","","","0.0826","0.0968","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204952","14.951","0.002","9.1564","0.0015","12.815","0.002","90","","90","","90","","1754.3","0.5","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Bis(pyridinium) tetrabromocadmate(II) monohydrate","","- C10 H14 Br4 Cd N2 O -","- C10 H14 Br4 Cd N2 O -","- C40 H56 Br16 Cd4 N8 O4 -","4","0.5","RZ6012","Zhang, Hui; Fang, Liang","Bis(pyridinium) tetrabromocadmate(II) monohydrate","Acta Crystallographica Section E","2005","61","1","m101","m102","10.1107/S1600536804029897","","","0.71073","MoKα","","0.0461","0.0296","","","0.0698","0.0767","","","","","","1.102","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204953","6.1539","0.001","10.7908","0.0017","34.057","0.006","90","","94.504","0.014","90","","2254.6","0.6","298","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Methoxyphenyl)-3-phenyl-2,4,8,10-tetraazaspiro[5.4]dec-1-ene-6,8,10-trione acetone solvate monohydrate","","- C22 H24 N4 O6 -","- C22 H24 N4 O6 -","- C88 H96 N16 O24 -","4","1","RZ6024","Bruno, Giuseppe; Rotondo, Archimede; Nicoló, Francesco; Foti, Francesco; Grassi, Giovanni; Risitano, Francesco","4-(4-Methoxyphenyl)-3-phenyl-2,4,8,10-tetraazaspiro[5.4]dec-1-ene-6,8,10-trione acetone solvate monohydrate","Acta Crystallographica Section E","2005","61","1","o139","o141","10.1107/S1600536804032817","","","0.71073","MoKα","","","0.0553","","","","0.17","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204954","12.027","0.004","13.38","0.005","13.416","0.003","71.32","0.03","86.159","0.013","87.84","0.03","2040.3","1.2","571","2","","","","","","","","","","5","P -1","-P 1","2","","3-Bromo-1,4-diphenyl-1,2,7,9-tetraazaspiro[5.4]dec-2-ene-6,8,10-trione acetone solvate","","- C20 H19 Br N4 O4 -","- C20 H19 Br N4 O4 -","- C80 H76 Br4 N16 O16 -","4","2","RZ6025","Bruno, Giuseppe; Rotondo, Archimede; Nicoló, Francesco; Foti, Francesco; Grassi, Giovanni; Risitano, Francesco","3-Bromo-1,4-diphenyl-1,2,7,9-tetraazaspiro[5.4]dec-2-ene-6,8,10-trione acetone solvate","Acta Crystallographica Section E","2005","61","1","o142","o144","10.1107/S1600536804032829","","","0.71073","MoKα","","","0.056","","","","0.1413","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204955","18.092","0.005","9.471","0.002","8.464","0.002","90","","100.127","0.008","90","","1427.7","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(4-Chlorobenzoyl)methyl morpholine-4-carbodithionate","","- C13 H14 Cl N O2 S2 -","- C13 H14 Cl N O2 S2 -","- C52 H56 Cl4 N4 O8 S8 -","4","1","RZ6026","Liang-Zhong Xu; Wei-Hua Li; Hai-Bin Song; Kai Li; Guan-ping Yu","(4-Chlorobenzoyl)methyl morpholine-4-carbodithionate","Acta Crystallographica Section E","2005","61","1","o130","o131","10.1107/S1600536804032593","","","0.71073","MoKα","","0.0566","0.0348","","","0.0783","0.0882","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204956","33.745","0.005","6.3132","0.0011","18.793","0.004","90","","119.572","0.01","90","","3482.1","1.1","293","2","130.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Re C15 H11 N3 Cl O7","(Acetonitrile)(2,2'-bipyridine)tricarbonylrhenium(I) perchlorate","","- C15 H11 Cl N3 O7 Re -","- C15 H11 Cl N3 O7 Re -","- C120 H88 Cl8 N24 O56 Re8 -","8","1","RZ6027","Chen, Yan-Dan; Zhang, Li-Yi; Chen, Zhong-Ning","(Acetonitrile)(2,2'-bipyridine)tricarbonylrhenium(I) perchlorate","Acta Crystallographica Section E","2005","61","1","m121","m122","10.1107/S1600536804032246","","","0.71073","MoKα","","0.0253","0.0238","","","0.0606","0.0614","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204957","25.826","0.002","6.8065","0.0006","17.2924","0.0016","90","","102.49","0.002","90","","2967.8","0.4","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","7-chloro-8-fluoro-4-phenyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline","","- C17 H15 Cl F N O -","- C17 H15 Cl F N O -","- C136 H120 Cl8 F8 N8 O8 -","8","1","RZ6028","K. Ravikumar; B. Sridhar; M. Mahesh; V. V. Narayana Reddy","A diastereoisomer of furo[3,2-<i>c</i>]quinoline","Acta Crystallographica Section E","2005","61","1","o102","o104","10.1107/S1600536804032283","","","0.71073","MoKα","","0.0836","0.0658","","","0.1458","0.1545","","","","","","1.156","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204958","6.5573","0.001","9.5294","0.0014","9.8799","0.0015","62.979","0.002","79.162","0.002","78.385","0.001","535.4","0.14","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","Poly[[diaqua(μ~6~-1,3,5-benzenetricarboxylato)tricadmium(II)] dihydrate]","","- C18 H14 Cd3 O16 -","- C18 H14 Cd3 O16 -","- C18 H14 Cd3 O16 -","1","0.5","RZ6029","You-Fu Zhou; Ben-Lai Wu; Lei Han; Mao-Chun Hong","Poly[[diaqua(μ~6~-1,3,5-benzenetricarboxylato)tricadmium(II)] dihydrate]","Acta Crystallographica Section E","2005","61","1","m160","m163","10.1107/S1600536804033136","","","0.71073","MoKα","","","0.0482","","","0.1026","0.1164","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204959","7.5168","0.0006","15.124","0.001","13.1804","0.001","90","","94.61","0.004","90","","1493.55","0.19","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bromobis(2,3-lutidine)copper(I)","","- C14 H18 Br Cu N2 -","- C14 H18 Br Cu N2 -","- C56 H72 Br4 Cu4 N8 -","4","1","RZ6030","Jones, Peter G.; Zerbe, Eva-Maria","Bromobis(2,3-lutidine)copper(I)","Acta Crystallographica Section E","2005","61","1","m106","m107","10.1107/S1600536804032416","","","0.71073","MoKα","","0.0372","0.0249","","","0.0564","0.0617","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204960","14.1068","0.0009","9.5526","0.0006","21.1298","0.0013","90","","90","","90","","2847.4","0.3","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-(4-chlorophenyl)-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline","","- C17 H16 Cl N O -","- C17 H16 Cl N O -","- C136 H128 Cl8 N8 O8 -","8","1","RZ6035","Ravikumar, K.; Sridhar, B.; Mahesh, M.; Narayana Reddy, V. V.","A diastereoisomer of furo[3,2-<i>c</i>]quinoline","Acta Crystallographica Section E","2005","61","1","o195","o197","10.1107/S1600536804033550","","","0.71073","MoKα","","0.0629","0.0564","","","0.1456","0.1503","","","","","","1.136","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204961","11.3309","0.0013","12.2714","0.0014","15.0877","0.0015","90","","98.281","0.008","90","","2076","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(2,2'-bipyridine)nitratocopper(II) nitrate","","- C20 H16 Cu N6 O6 -","- C20 H16 Cu N6 O6 -","- C80 H64 Cu4 N24 O24 -","4","1","SJ6001","Marjani, Katayoun; Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Khodamorad, Nejat; Samodi, Assadolah","Bis(2,2'-bipyridine)nitratocopper(II) nitrate","Acta Crystallographica Section E","2005","61","1","m11","m14","10.1107/S1600536804030788","","","0.71069","Mo-Kα","","0.1264","0.0486","","","0.0667","0.0924","","","","","","0.969","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204962","11.6288","0.0009","14.0386","0.0011","13.7457","0.001","90","","98.349","0.001","90","","2220.2","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(3aS,10R,10aS,10bS,13R,13aR)-8-formyl-6-hydroxy-13-methoxy-1,1,7-trimethyl- 5-oxo-1,2,3,3a,5,9,10,10a,13,13a-decahydrocyclohepta[c]furo[3,4-e]chromen-10-yl acetate","","- C23 H30 O8 -","- C23 H30 O8 -","- C92 H120 O32 -","4","2","SJ6021","Shi, Hao","(3a<i>S</i>*,10<i>R</i>*,10a<i>S</i>*,10b<i>S</i>*,13<i>R</i>*,13a<i>R</i>*)-8-Formyl-6-hydroxy-13-methoxy-1,1,7-trimethyl-5-oxo-1,2,3,3a,5,9,10,10a,13,13a-decahydrocyclohepta[<i>c</i>]furo[3,4-<i>e</i>]chromen-10-yl acetate","Acta Crystallographica Section E","2005","61","1","o12","o14","10.1107/S1600536804031046","","","0.71073","MoKα","","0.0573","0.0477","","","0.1128","0.1188","","","","","","0.836","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204963","15.5339","0.0013","11.1141","0.0007","15.7665","0.0015","90","","114.061","0.007","90","","2485.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-Bis(5-isopropyl-2-methylphenoxy)phthalonitrile","","- C28 H26 N2 O2 -","- C28 H26 N2 O2 -","- C112 H104 N8 O8 -","4","1","SJ6023","Ocak, Nazan; Yavuz, Metin; Işık, Şamil; Akdemir, Nesuhi; Aǧar, Erbil; Özil, Musa","4,5-Bis(5-isopropyl-2-methylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","1","o37","o39","10.1107/S1600536804031289","","","0.71073","MoKα","","0.0916","0.0525","","","0.1458","0.167","","","","","","0.942","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204964","10.4","0.007","9.117","0.006","32.09","0.02","90","","90","","90","","3043","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","isoprothiolane","diisopropyl (1,3-dithiolan-2-ylidene)malonate","","- C12 H18 O4 S2 -","- C12 H18 O4 S2 -","- C96 H144 O32 S16 -","8","1","SJ6026","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","Diisopropyl (1,3-dithiolan-2-ylidene)malonate","Acta Crystallographica Section E","2005","61","1","o3","o5","10.1107/S1600536804030934","","","0.71073","MoKα","","0.1248","0.09","","","0.1882","0.2052","","","","","","1.224","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204965","6.993","0.004","7.543","0.004","11.058","0.006","83.53","0.009","85.171","0.009","79.017","0.009","567.8","0.5","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","1-(1,8-Dihydroxy-6-methoxy-3-methylnaphthalen-2-yl)ethanone","","- C14 H14 O4 -","- C14 H14 O4 -","- C28 H28 O8 -","2","1","SJ6028","Ismail, Nor Hadiani; Alyahya, S. A. Illah.; Shaari, Khozirah; Yamin, Bohari M.","1-(1,8-Dihydroxy-6-methoxy-3-methylnaphthalen-2-yl)ethanone","Acta Crystallographica Section E","2005","61","1","o67","o68","10.1107/S1600536804030181","","","0.71073","MoKα","","0.101","0.066","","","0.135","0.148","","","","","","1.14","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204966","6.9541","0.0012","11.465","0.002","12.059","0.002","90","","113.547","0.003","90","","881.4","0.3","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[Fe(bpy)(H~2~O)~4~](bdc)","catena-poly[[[tetraaquairon(II)]-μ-4,4'-bipyridine] benzene-1,4-dicarboxylate]","","- C18 H20 Fe N2 O8 -","- C18 H20 Fe N2 O8 -","- C36 H40 Fe2 N4 O16 -","2","0.5","SJ6033","Halder, Gregory J.; Kepert, Cameron J.","A three-dimensional hydrogen-bonded coordination framework: <i>catena</i>-poly[[[tetraaquairon(II)]-μ-4,4'-bipyridine] benzene-1,4-dicarboxylate]","Acta Crystallographica Section E","2005","61","1","m113","m114","10.1107/S1600536804032192","","","0.71073","MoKα","","0.024","0.0231","","","0.0638","0.0645","","","","","","1.134","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204967","12.998","0.006","15.198","0.006","8.543","0.004","90","","102.85","0.008","90","","1645.3","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","tert-Butyl 3-oxospiro[indan-1,4'-piperidine]-1'-carboxylate","","- C18 H23 N O3 -","- C18 H23 N O3 -","- C72 H92 N4 O12 -","4","1","SJ6034","Zheng, Pengwu; Li, Chunbao; Wang, Wei; Zhao, Bing","<i>tert</i>-Butyl 3-oxospiro[indan-1,4'-piperidine]-1'-carboxylate","Acta Crystallographica Section E","2005","61","1","o10","o11","10.1107/S1600536804031058","","","0.71073","MoKα","","0.1148","0.0495","","","0.1108","0.1497","","","","","","0.996","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204968","6.048","0.0001","10.1735","0.0003","15.5791","0.0004","90","","90","","90","","958.57","0.04","190","","190","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2R,5S)-2-Trichloromethyl-3-oxa-1-azabicyclo[3,3,0]octane-4,8-dione","","- C7 H6 Cl3 N O3 -","- C7 H6 Cl3 N O3 -","- C28 H24 Cl12 N4 O12 -","4","1","SJ6035","Punzo, Francesco; Watkin, David J.; Pike, Richard; Moloney, Mark; Panchal, Terry","(2<i>R</i>,5<i>S</i>)-2-Trichloromethyl-3-oxa-1-azabicyclo[3.3.0]octane-4,8-dione","Acta Crystallographica Section E","2005","61","1","o42","o44","10.1107/S1600536804031605","","","0.71073","MoKα","","0.0297","0.0269","","0.0637","0.0618","0.0637","","","","","","0.9547","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204969","11.035","0.004","14.368","0.006","14.637","0.006","114.257","0.002","101.688","0.002","103.272","0.003","1940.6","1.3","130.15","","130.15","","","","","","","","","6","P -1","-P 1","2","","Bis[2-(4,6-diphenyl-2-pyridyl)pyridine-κ^2^N,N]copper(I) perchlorate dichloromethane solvate","","- C45 H34 Cl3 Cu N4 O4 -","- C45 H34 Cl3 Cu N4 O4 -","- C90 H68 Cl6 Cu2 N8 O8 -","2","1","SJ6036","Wei, Qiao-Hua; Yin, Gang-Qiang; Chen, Zhong-Ning","Bis[2-(4,6-diphenyl-2-pyridyl)pyridine-κ^2^<i>N</i>,<i>N</i>]copper(I) perchlorate dichloromethane solvate","Acta Crystallographica Section E","2005","61","1","m117","m118","10.1107/S1600536804032064","","","0.7107","MoKα","","0.0821","0.0554","","","0.1022","0.1156","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2204970","3.8144","0.0005","12.175","0.002","18.806","0.003","90","","90","","90","","873.4","0.2","153","2","153","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","naphthalene-2,3-dicarbonitrile","","- C12 H6 N2 -","- C12 H6 N2 -","- C48 H24 N8 -","4","1","SJ6037","Tamil Selvi Pitchumony; Helen Stoeckli-Evans","An orthorhombic polymorph of naphthalene-2,3-dicarbonitrile","Acta Crystallographica Section E","2005","61","1","o40","o41","10.1107/S1600536804031757","","","0.71073","MoKα","","0.0435","0.0373","","","0.0991","0.1048","","","","","","0.869","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204971","12.561","0.003","12.949","0.003","6.855","0.001","90","","98.68","0.03","90","","1102.2","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquamanganese(II) bis[(4-oxo-4H-pyridin-1-yl)acetate] dihydrate","","- C14 H28 Mn N2 O14 -","- C14 H28 Mn N2 O14 -","- C28 H56 Mn2 N4 O28 -","2","0.5","SJ6038","Zhu-Yan Zhang; Shan Gao; Li-Hua Huo; Hui Zhao; Jing-Gui Zhao","Hexaaquamanganese(II) bis[(4-oxo-4<i>H</i>-pyridin-1-yl)acetate] dihydrate","Acta Crystallographica Section E","2005","61","1","m85","m86","10.1107/S1600536804032076","","","0.71073","MoKα","","0.036","0.032","","","0.083","0.085","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204972","12.727","0.003","7.231","0.001","14.947","0.003","90","","108.79","0.03","90","","1302.2","0.5","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","catena-Poly[[strontium(II)-di-μ-aqua-di-μ-9-hydroxy-fluorene-9-carboxylato] monohydrate]","","- C28 H24 O9 Sr -","- C28 H24 O9 Sr -","- C56 H48 O18 Sr2 -","2","1","SJ6041","Gao, Shan; Huo, Li Hua; Zhao, Hui; Ng, Seik Weng","<i>catena</i>-Poly[[strontium(II)-di-μ-aqua-di-μ-9-hydroxyfluorene-9-carboxylato] monohydrate]","Acta Crystallographica Section E","2005","61","1","m129","m131","10.1107/S1600536804032799","","","0.71073","MoKα","","0.061","0.047","","","0.109","0.115","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204973","8.4681","0.0007","8.9652","0.0008","14.3497","0.0012","75.198","0.002","87.918","0.001","65.395","0.001","954.57","0.14","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(dimethylsulfonyl)amino]- 1H-pyrazole-3-carbonitrile","","- C13 H9 Cl2 F3 N4 O4 S2 -","- C13 H9 Cl2 F3 N4 O4 S2 -","- C26 H18 Cl4 F6 N8 O8 S4 -","2","1","SU6147","Yang, Zhi-Ping; Zhong, Ping; Hu, Mao-Lin; Li, Shu-Yan; Tang, Ri-Yuan","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(dimethylsulfonyl)amino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","1","o116","o117","10.1107/S1600536804032428","","","0.71073","MoKα","","0.0538","0.049","","","0.1314","0.1355","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204974","34.57","0.02","14.686","0.007","11.74","0.004","90","","108.67","0.04","90","","5647","5","295","","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[1-(diphenylphosphino)-4-(diphenylphosphinoyl)butane-κP^1^]idodgold(I) monohydrate","","- C28 H30 Au I O2 P2 -","- C28 H30 Au I O2 P2 -","- C224 H240 Au8 I8 O16 P16 -","8","1","TK6200","Michael L. Williams; Deborah L. Slade; Sue E. Boyd; Peter C. Healy","Aurophilic and hydrogen-bonding interactions in [1-(diphenylphosphino)-4-(diphenylphosphinoyl)butane-κ<i>P</i>^1^]iodogold(I) monohydrate","Acta Crystallographica Section E","2005","61","1","m30","m32","10.1107/S160053680403137X","","","0.7107","MoKα","","0.0596","0.0329","","","0.0803","0.0899","","","","","","1.028","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204975","16.597","0.003","22.522","0.003","9.871","0.002","90","","90","","90","","3689.8","1.1","295","","295","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C32 H44 N6 O8 S2 -","- C32 H44 N6 O8 S2 -","- C128 H176 N24 O32 S8 -","4","1","TK6202","Ohba, Shigeru; Miyamoto, Hisakazu; Fujioka, Atsushi; Ikeuchi, Takahiro; Jean-Marie Lehn","<i>N,N</i>'-Bis(6-<i>tert</i>-butoxycarbonylamino-2-pyridyl)terephthalamide dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2005","61","1","o182","o184","10.1107/S1600536804033367","","","0.7107","MoKα","","","0.061","","","","0.207","","","","","","0.95","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204976","13.0201","0.0014","7.793","0.0005","17.3305","0.0019","90","","94.373","0.009","90","","1753.3","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(5-methyl-3-phenylisoxazol-4-yl)benzenesulfonamide ethyl methyl ketone hemisolvate","","- C18 H18 N2 O3.5 S -","- C18 H18 N2 O3.5 S -","- C72 H72 N8 O14 S4 -","4","1","TK6204","Yathirajan, Hemmige S.; Narasegowda, Rajenahally S.; Nagarajab, Padmarajaiah; Bolte, Michael","A pseudopolymorph of valdecoxib","Acta Crystallographica Section E","2005","61","1","o179","o181","10.1107/S1600536804033598","","","0.71073","MoKα","","0.053","0.044","","","0.126","0.131","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204977","5.4656","0.0002","5.888","0.0002","7.8714","0.0003","90","","91.097","0.001","90","","253.267","0.016","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","disamarium sodium iridium hexaoxide","","- Ir Na O6 Sm2 -","- Ir Na O6 Sm2 -","- Ir2 Na2 O12 Sm4 -","2","0.5","WM6042","Mugavero III, Samuel J.; Puzdrjakova, Irina V.; Smith, Mark D.; zur Loye, Hans-Conrad","Sm~2~NaIrO~6~, a monoclinically distorted double perovskite","Acta Crystallographica Section E","2005","61","1","i3","i5","10.1107/S1600536804031836","","","0.71073","MoKα","","0.029","0.0262","","","0.0509","0.0519","","","","","","1.129","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204978","8.601","0.0017","9.5176","0.0019","6.7287","0.0013","90","","98.17","0.03","90","","545.23","0.19","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","Caesium vanadium diphosphorus heptasulfide","","- Cs P2 S7 V -","- Cs P2 S7 V -","- Cs2 P4 S14 V2 -","2","0.5","WM6043","Gutzmann, Andreas; Näther, Christian; Bensch, Wolfgang","CsVP~2~S~7~","Acta Crystallographica Section E","2005","61","1","i6","i8","10.1107/S1600536804031150","","","0.71073","MoKα","","0.0753","0.0456","","","0.0946","0.1001","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204979","4.366","0.0005","4.366","0.0005","9.9726","0.001","90","","90","","90","","190.1","0.04","295","2","295","2","","","","","","","","3","I 4 m m","I 4 -2","107","lanthanum iron trigermanide","lanthanum iron trigermanide","","- Fe Ge3 La -","- Fe Ge3 La -","- Fe2 Ge6 La2 -","2","0.125","WM6044","Tkachuk, Andriy V.; Mar, Arthur","Lanthanum iron trigermanide, LaFeGe~3~","Acta Crystallographica Section E","2005","61","1","i1","i2","10.1107/S1600536804031253","","","0.71073","MoKα","","0.0313","0.0307","","","0.0749","0.0752","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204980","9.08","0.006","22.782","0.015","10.055","0.007","90","","109.476","0.01","90","","1961","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4'-{[2-(But-2-enyl)-4-chloro-5-formyl-1H-imidazol-1-yl]methyl}biphenyl- 2-carbonitrile","","- C22 H18 Cl N3 O -","- C22 H18 Cl N3 O -","- C88 H72 Cl4 N12 O4 -","4","1","WN6311","Malathy Sony, S. M.; Charles, P.; Ponnuswamy, M. N.; Yathirajan, H. S.; Nethaji, M.","4'-{[2-(But-2-enyl)-4-chloro-5-formyl-1<i>H</i>-imidazol-1-yl]methyl}biphenyl-2-carbonitrile","Acta Crystallographica Section E","2005","61","1","o25","o26","10.1107/S1600536804031186","","","0.71073","MoKα","","0.0817","0.0636","","","0.1695","0.1836","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204981","10.5872","0.0011","10.5872","0.0011","11.9509","0.0012","90","","90","","90","","1339.6","0.2","110","2","110","2","","","","","","","","5","P 43","P 4cw","78","","(S)-(Acetylacetonato-κ^2^O,O')[2-(1-aminoethyl)phenyl- κ^2^C^1^,N]palladium(II)","","- C13 H17 N O2 Pd -","- C13 H17 N O2 Pd -","- C52 H68 N4 O8 Pd4 -","4","1","WW6314","Calmuschi, Beatrice; Englert, Ulli","(<i>S</i>)-(Acetylacetonato-κ^2^<i>O</i>,<i>O</i>')[2-(1-aminoethyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]palladium(II)","Acta Crystallographica Section E","2005","61","1","m164","m165","10.1107/S1600536804032842","","","0.71073","MoKα","","0.0207","0.0196","","","0.0471","0.0476","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204982","10.951","0.005","10.951","0.005","12.442","0.007","90","","90","","90","","1492.1","1.3","110","2","110","2","","","","","","","","6","P 43","P 4cw","78","","(S)-2-(1-Aminoethyl)phenyl-κ^2^C^1^,N](hexafluoroacetylacetonato- κ^2^O,O')palladium(II)","","- C13 H9 F6 N O2 Pd -","- C13 H9 F6 N O2 Pd -","- C52 H36 F24 N4 O8 Pd4 -","4","1","WW6315","Calmuschi, Beatrice; Englert, Ulli","(<i>S</i>)-[2-(1-Aminoethyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>](hexafluoroacetylacetonato-κ^2^<i>O</i>,<i>O</i>')palladium(II)","Acta Crystallographica Section E","2005","61","1","m166","m167","10.1107/S1600536804032854","","","0.71073","MoKα","","0.0384","0.0367","","","0.0936","0.0946","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204983","23.283","0.012","8.824","0.006","15.562","0.01","90","","112.574","0.0013","90","","2952","3","293","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","rac-[2-(1-Aminoethyl)phenyl-κ^2^C^1^,N](hexafluoroacetylacetonato- κ^2^O,O')palladium(II)","","- C13 H11 F6 N O2 Pd -","- C13 H11 F6 N O2 Pd -","- C104 H88 F48 N8 O16 Pd8 -","8","1","WW6316","Calmuschi, Beatrice; Englert, Ulli","<i>rac</i>-[2-(1-Aminoethyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>](hexafluoroacetylacetonato-κ^2^<i>O</i>,<i>O</i>')palladium(II)","Acta Crystallographica Section E","2005","61","1","m168","m170","10.1107/S1600536804032866","","","0.71073","MoKα","","0.1029","0.0566","","","0.1224","0.1375","","","","","","0.991","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204984","7.373","0.0002","13.529","0.0003","17.268","0.0003","90","","90","","90","","1722.47","0.07","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Acetonitrilechlorobis(η^5^-cyclopentadienyl)vanadium(IV) tetrachloroiron(III)","","- C12 H13 Cl5 Fe N V -","- C12 H13 Cl5 Fe N V -","- C48 H52 Cl20 Fe4 N4 V4 -","4","1","WW6317","Honzíček, Jan; Císařová, Ivana; Vinklárek, Jaromír","Acetonitrilechlorotris(η^5^-cyclopentadienyl)vanadium(IV) tetrachloroferrate(III)","Acta Crystallographica Section E","2005","61","1","m149","m151","10.1107/S1600536804032830","","","0.71073","MoKα","","0.024","0.0221","","","0.0524","0.0535","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204985","8.7861","0.0003","10.359","0.0009","17.9636","0.0007","99.192","0.007","90.389","0.002","105.774","0.003","1551.01","0.16","296.2","","","","","","","","","","","6","P -1","-P 1","2","","Acetonitrile(1,10-phenanthroline )(2,2':6',2''-terpyridine)ruthenium(II) hexafluorophosphate","","- C29 H22 F12 N6 P2 Ru -","- C29 H22 F12 N6 P2 Ru -","- C58 H44 F24 N12 P4 Ru2 -","2","1","WW6333","Naokazu Yoshikawa; Akio Ichimura; Nobuko Kanehisa; Yasushi Kai; Hiroshi Takashima; Keiichi Tsukahara","Acetonitrile(1,10-phenanthroline)(2,2':6',2''-terpyridine)ruthenium(II) bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","1","m55","m56","10.1107/S1600536804031629","","","0.7107","MoKα","","","0.0888","","","","0.1719","","","","","","1.29","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204986","8.29","0.0002","8.381","0.0002","12.795","0.0003","73.882","0.0015","89.372","0.0014","62.465","0.0013","750.07","0.03","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","Dichloro{(η^5^,κN)- [(tert-butylamido)dimethylsilyl]cyclopentadienyl}titanium(IV)","","- C11 H19 Cl2 N Si Ti -","- C11 H19 Cl2 N Si Ti -","- C22 H38 Cl4 N2 Si2 Ti2 -","2","1","YA6226","Erben, Milan; Císařová, Ivana; Vinklárek, Jaromír; Dušek, Michal","{(η^5^,κ<i>N</i>)-[(<i>tert</i>-Butylamido)dimethylsilyl]cyclopentadienyl}dichlorotitanium(IV)","Acta Crystallographica Section E","2005","61","1","m50","m51","10.1107/S1600536804031332","","","0.71073","MoKα","","0.03","0.027","","","0.069","0.072","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204987","9.3049","0.0008","11.1595","0.0015","11.4248","0.0018","108.526","0.005","106.493","0.008","90.737","0.006","1071.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[tetraaquazinc(II)]-μ-4,4'-bipyridine-κ^2^N:N'] 3-carboxylatophenoxyacetate monohydrate]","","- C19 H24 N2 O10 Zn -","- C19 H24 N2 O10 Zn -","- C38 H48 N4 O20 Zn2 -","2","1","YA6230","Zhao, Jing-Gui; Gu, Chang-Sheng; Huo, Li-Hua; Liu, Ji-Wei; Gao, Shan","<i>catena</i>-Poly[[[tetraaquazinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 3-carboxylatophenoxyacetate monohydrate]","Acta Crystallographica Section E","2005","61","1","m76","m78","10.1107/S1600536804031344","","","0.71073","MoKα","","0.068","0.04","","","0.079","0.089","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204988","5.839","0.002","9.498","0.003","15.663","0.005","90","","92.76","0.02","90","","867.6","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","α-Cyano-4-hydroxy-cinnamic acid","2-Cyano-3-(4-hydroxyphenyl)propenoic acid","","- C10 H7 N O3 -","- C10 H7 N O3 -","- C40 H28 N4 O12 -","4","1","AC6150","Qian, Hui-Fen; Huang, Wei; Yao, Cheng","2-Cyano-3-(4-hydroxyphenyl)propenoic acid","Acta Crystallographica Section E","2005","61","2","o370","o372","10.1107/S1600536805001224","","","0.71073","MoKα","","0.0646","0.0579","","","0.1109","0.1145","","","","","","0.987","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204989","12.0293","0.0015","13.1788","0.0017","13.8881","0.0018","68.211","0.002","72.262","0.002","67.135","0.002","1850.4","0.4","90","2","90","2","","","","","","","","7","P -1","-P 1","2","[(CH~2~trpy)(bipy)CORu] 2PF~6~ acetone","cis-(2,2'-Bipyridyl-κ^2^N,N')carbonyl(η^3^-1-methylene-2,2':6',2''- terpyridyl-κ^3^C^1^,N,N')-ruthenium(II) bis(hexafluorophosphate) acetone disolvate","","- C33 H33 F12 N5 O3 P2 Ru -","- C33 H33 F12 N5 O3 P2 Ru -","- C66 H66 F24 N10 O6 P4 Ru2 -","2","1","AC6152","Gibson, Dorothy H.; Mashuta, Mark S.; Andino, Jose G.","<i>cis</i>-(2,2'-Bipyridyl-κ^2^<i>N</i>,<i>N</i>')carbonyl(η^3^-1-methylene-2,2':6',2''-terpyridyl-κ^3^<i>C</i>^1^,<i>N</i>,<i>N</i>')ruthenium(II) bis(hexafluorophosphate) acetone disolvate","Acta Crystallographica Section E","2005","61","2","m341","m343","10.1107/S160053680500142X","","","0.71073","MoKα","","0.035","0.034","","","0.088","0.089","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204990","7.1233","0.0003","17.3399","0.0007","9.5533","0.0004","90","","90","","90","","1180","0.08","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","1-(6-Bromopyridin-2-yl)-3-methyl-3H-imidzol-1-ium bromide monoydrate","","- C9 H11 Br2 N3 O -","- C9 H11 Br2 N3 O -","- C36 H44 Br8 N12 O4 -","4","1","AC6155","Cheng, Bi Yun; Zeng, Jing Yao; Chiu, Pei Ling; Lee, Hon Man","1-(6-Bromopyridin-2-yl)-3-methyl-3<i>H</i>-imidazol-1-ium bromide monohydrate","Acta Crystallographica Section E","2005","61","2","o509","o510","10.1107/S1600536805002783","","","0.71073","MoKα","","0.0435","0.0346","","","0.0914","0.0971","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204991","12.2994","0.0018","11.6445","0.0017","13.66","0.002","90","","113.909","0.002","90","","1788.5","0.5","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","Aqua[bis(5-bromosalicylidene)ethylenediaminato]chloromanganese(III)","aqua{4,4'-dibromo-2,2'-[1,2- ethanediylbis(nitrilomethylidyne)]diphenolato]chloromanganese(III)), [Mn(C~16~H~12~Br~2~N~2~O~2~)Cl(H~2~O)]","","- C16 H14 Br2 Cl Mn N2 O3 -","- C16 H14 Br2 Cl Mn N2 O3 -","- C64 H56 Br8 Cl4 Mn4 N8 O12 -","4","1","BR6176","Dang, Li-Long; Huo, Yong-Qian; Wang, Wei; Li, Jun","Aqua[bis(5-bromosalicylidene)ethylenediaminato]chloromanganese(III)","Acta Crystallographica Section E","2005","61","2","m332","m334","10.1107/S1600536805000942","","","0.71073","MoKα","","0.082","0.0726","","","0.1586","0.1641","","","","","","1.191","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204992","11.2152","0.0014","8.7122","0.001","29.091","0.003","90","","95.719","0.009","90","","2828.3","0.6","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(3-Methoxysalicylideneamino)-1H-benzimidazole monohydrate","","- C15 H15 N3 O3 -","- C15 H15 N3 O3 -","- C120 H120 N24 O24 -","8","1","BT6567","Albayrak, Çiǧdem; Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan","2-(3-Methoxysalicylideneamino)-1<i>H</i>-benzimidazole monohydrate","Acta Crystallographica Section E","2005","61","2","o423","o424","10.1107/S1600536804033057","","","0.71073","MoKα","","0.073","0.032","","","0.058","0.062","","","","","","0.83","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204993","12.545","0.0009","8.4858","0.0008","13.2955","0.001","90","","111.755","0.006","90","","1314.56","0.19","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(3-Methoxysalicylideneamino)-1H-benzimidazole","","- C15 H13 N3 O2 -","- C15 H13 N3 O2 -","- C60 H52 N12 O8 -","4","1","BT6568","Odabas̨oǧlu, Mustafa; Albayrak, Çiǧdem; Büyükgüngör, Orhan","2-(3-Methoxysalicylideneamino)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","2","o425","o426","10.1107/S1600536804033069","","","0.71073","MoKα","","0.083","0.039","","","0.076","0.087","","","","","","0.88","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204994","15.121","0.003","7.234","0.001","12.773","0.002","90","","114.95","0.01","90","","1266.8","0.4","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-Chloromethyl-4-(dimethylamino)-N,N-dimethylanilinium chloride","","- C11 H18 Cl2 N2 -","- C11 H18 Cl2 N2 -","- C44 H72 Cl8 N8 -","4","1","BT6570","Batsanov, Andrei S.; Collings, Jonathan C.; Marder, Todd B.","<i>N</i>-Chloromethyl-4-(dimethylamino)-<i>N,N</i>-dimethylanilinium chloride","Acta Crystallographica Section E","2005","61","2","o201","o202","10.1107/S1600536804033860","","","0.71073","MoKα","","0.0497","0.0372","","","0.1079","0.1146","","","","","","1.051","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204995","10.518","0.001","20.61","0.002","7.4612","0.0008","90","","90","","90","","1617.4","0.3","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3<i>R</i>,8<i>S</i>,9<i>R</i>)-10,11-Dihydrocinchonidine","","- C19 H24 N2 O -","- C19 H24 N2 O -","- C76 H96 N8 O4 -","4","1","BT6573","Lei, Xin-Xiang; Jing, Xiong; Zhang, An-Jiang; Ng, Seik Weng","10,11-Dihydrocinchonan-9-ol","Acta Crystallographica Section E","2005","61","2","o230","o232","10.1107/S1600536804034117","","","0.71073","MoKα","","0.079","0.072","","","0.156","0.16","","","","","","1.29","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204996","14.31","0.001","13.1112","0.0005","26.642","0.002","90","","90.007","0.005","90","","4998.6","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(-)-(3a'S,4'S,9b'S,1R,2S,5R)-4'-Ethyl-3a',4',5',7',8',9b'-hexahydro-2- isopropyl-5-methyl-2'-phenylspiro[cyclohexane-1,7'-dioxino[3,2-e]isoindole]- 1',3',9'-trione","","- C27 H33 N O5 -","- C27 H33 N O5 -","- C216 H264 N8 O40 -","8","4","BT6574","Schollmeyer, Dieter; Hoffmann, Ralf; Mattay, Jochen","(‒)-(3a'<i>S</i>,4'<i>S</i>,9b'<i>S</i>,1<i>R</i>,2<i>S</i>,5<i>R</i>)-4'-Ethyl-3a',4',5',7',8',9b'-hexahydro-2-isopropyl-5-methyl-2'-phenylspiro[cyclohexane-1,7'-dioxino[3,2-<i>e</i>]isoindole]-1',3',9'-trione","Acta Crystallographica Section E","2005","61","2","o290","o291","10.1107/S1600536805000140","","","1.54178","CuKα","","0.0712","0.0506","","","0.137","0.1541","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204997","32.264","0.003","7.6517","0.0007","12.0672","0.0011","90","","95.242","0.002","90","","2966.6","0.5","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","4-aminiumbenzoic acid 5-sulfosalicylate","4-carboxyanilinium 3-carboxy-4-hydroxybenzenesulfonate","","- C14 H13 N O8 S -","- C14 H13 N O8 S -","- C112 H104 N8 O64 S8 -","8","1","BT6575","Smith, Graham; Wermuth, Urs D.; White, Jonathan M.","The 1:1 proton-transfer compound of 5-sulfosalicylic acid with 4-aminobenzoic acid","Acta Crystallographica Section E","2005","61","2","o313","o316","10.1107/S1600536805000152","","","0.71073","MoKα","","0.0434","0.04","","","0.1141","0.1171","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204998","10.4278","0.0005","13.3828","0.0006","18.0857","0.0009","90","","90","","90","","2523.9","0.2","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6,10-bis(acetyloxy)-8-isopropyl-4,4,11a-trimethyl-2-oxo-2,3,4,6,11,11a- hexahydrobenzo[5,6]cyclohepta[1,2-b]pyran-9-yl acetate","","- C26 H32 O8 -","- C26 H32 O8 -","- C104 H128 O32 -","4","1","BT6576","K. Ravikumar; B. Sridhar; M. Marathanda Murthy","Bharangin triacetate","Acta Crystallographica Section E","2005","61","2","o380","o382","10.1107/S1600536805000838","","","0.71073","MoKα","","0.055","0.0526","","","0.1271","0.1285","","","","","","1.246","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204999","7.493","0.002","16.237","0.003","8.253","0.002","90","","92.91","0.03","90","","1002.8","0.4","295","2","295","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Poly[tetrasilver(I)-di-μ-aqua-bis[μ~8~-3-carboxylato-4- hydroxybenzenesulfonato]","","- C14 H12 Ag4 O14 S2 -","- C14 H12 Ag4 O14 S2 -","- C28 H24 Ag8 O28 S4 -","2","0.5","BT6577","Gao, Shan; Zhu, Zhi-Bao; Huo, Li-Hua; Ng, Seik Weng","Poly[di-μ-aqua-bis(μ~8~-3-carboxylato-4-hydroxybenzenesulfonato)tetrasilver(I)]","Acta Crystallographica Section E","2005","61","2","m282","m284","10.1107/S1600536805000516","","","0.71073","MoKα","","0.029","0.026","","","0.066","0.068","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205000","8.309","0.001","11.264","0.002","12.611","0.002","112.743","0.006","97.608","0.007","95.516","0.007","1064.8","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[triaquadisilver(I)]bis[μ~4~-3-carboxy-4-hydroxybenzenesulfonato] monohydrate]","","- C14 H18 Ag2 O16 S2 -","- C14 H18 Ag2 O16 S2 -","- C28 H36 Ag4 O32 S4 -","2","1","BT6578","Gao, Shan; Zhu, Zhi-Bao; Huo, Li-Hua; Ng, Seik Weng","Poly[[triaquabis(μ~4~-3-carboxy-4-hydroxybenzenesulfonato)disilver(I)] monohydrate]","Acta Crystallographica Section E","2005","61","2","m279","m281","10.1107/S1600536805000504","","","0.71073","MoKα","","0.031","0.028","","","0.072","0.074","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205001","20.517","0.003","11.689","0.002","13.686","0.003","90","","124.33","0.03","90","","2710.5","1.3","295","2","295","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Dipyridinium diaquatetrachlorotin(IV) 1,5-naphthalenedisulfonate","","- C20 H22 Cl4 N2 O8 S2 Sn -","- C20 H22 Cl4 N2 O8 S2 Sn -","- C80 H88 Cl16 N8 O32 S8 Sn4 -","4","0.5","BT6579","Gao, Shan; Huo, Li-Huo; Zhao, Hui; Ng, Seik Weng","Dipyridinium diaquatetrachlorotin(IV) 1,5-naphthalenedisulfonate","Acta Crystallographica Section E","2005","61","2","m285","m287","10.1107/S1600536805000528","","","0.71073","MoKα","","0.0268","0.0258","","","0.0731","0.0739","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205002","13.199","0.003","5.699","0.001","11.039","0.002","90","","112.79","0.03","90","","765.5","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[bis[aquamercury(I)]-di-μ-aqua-μ-1,5-naphthalenedisulfonato]","","- C10 H14 Hg2 O10 S2 -","- C10 H14 Hg2 O10 S2 -","- C20 H28 Hg4 O20 S4 -","2","0.5","BT6580","Zhu, Zhi-Biao; Shan Gao; Huo, Li-Hua; Ng, Seik Weng","Poly[bis[aquamercury(I)]-di-μ-aqua-μ-1,5-naphthalenedisulfonato]","Acta Crystallographica Section E","2005","61","2","m288","m289","10.1107/S160053680500053X","","","0.71073","MoKα","","0.054","0.046","","","0.117","0.136","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205003","8.16","0.005","8.451","0.005","11.629","0.005","97.921","0.005","108.234","0.005","110.548","0.005","685","0.7","293","2","293","2","","","","","","","","4","P 1","P 1","1","","4-(2,6-dimethylphenoxy)phthalonitrile","","- C16 H12 N2 O -","- C16 H12 N2 O -","- C32 H24 N4 O2 -","2","2","BT6581","Büyükgüngör, Orhan; Kos̨ar, Bas̨ak; Akdemir, Nesuhi; Ağar, Erbil; Gümrükçüoğlu, Ismail","4-(2,6-Dimethylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","2","o335","o336","10.1107/S1600536805001078","","","0.71069","MoKα","","0.042","0.0388","","","0.1102","0.1128","","","","","","1.027","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205004","6.6691","0.0004","7.8721","0.0007","9.7547","0.0006","90","","94.404","0.007","90","","510.61","0.06","150","2","150","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","Poly[di-μ~4~-acetato-di-μ~2~-azido-copper(II)disodium(II)]","","- C4 H6 Cu N6 Na2 O4 -","- C4 H6 Cu N6 Na2 O4 -","- C8 H12 Cu2 N12 Na4 O8 -","2","0.5","BT6583","Näther, Christian; Greve, Jan; Jeß, Inke","Poly[di-μ~4~-acetato-di-μ~2~-azido-copper(II)disodium(I)] at 150K","Acta Crystallographica Section E","2005","61","2","m314","m316","10.1107/S160053680500108X","","","0.71073","MoKα","","0.0444","0.0392","","","0.1014","0.1046","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205005","20.454","0.003","15.749","0.003","14.603","0.003","90","","120.05","0.004","90","","4071.8","1.3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[μ-4'-(2-pyridyl)-2,2':6',2''-terpyridine]disilver(I) bis(hexafluorophosphate)","","- C40 H28 Ag2 F12 N8 P2 -","- C40 H28 Ag2 F12 N8 P2 -","- C160 H112 Ag8 F48 N32 P8 -","4","0.5","BT6584","Hou, Lei; Li, Dan; Ng, Seik Weng","Bis[μ-4'-(2-pyridyl)-2,2':6',2''-terpyridine]disilver(I) bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","2","m404","m406","10.1107/S1600536805002618","","","0.71073","MoKα","","0.0846","0.0681","","","0.1942","0.2028","","","","","","1.168","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205006","11.4626","0.0006","12.0032","0.0009","16.7541","0.0009","90","","90","","90","","2305.2","0.2","150","2","150","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","Poly[tetra-μ~2~-azido-di-μ~2~-4,4'-bipyridine-sodium(I)iron(III)]","","- C20 H16 Fe N16 Na -","- C20 H16 Fe N16 Na -","- C80 H64 Fe4 N64 Na4 -","4","0.5","BT6585","Näther, Christian; Greve, Jan; Jeß, Inke","Poly[tetra-μ~2~-azido-di-μ~2~-4,4'-bipyridine-sodium(I)iron(III)]","Acta Crystallographica Section E","2005","61","2","m317","m319","10.1107/S1600536805001091","","","0.71073","MoKα","","0.032","0.029","","","0.0739","0.0753","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205007","10.6219","0.0007","7.6529","0.0003","11.1018","0.0007","90","","104.804","0.007","90","","872.49","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[(2-iodopyrazine-κN^4^)copper(I)]-μ~3~-thiocyanato-κ^3^N:S:S]","","- C5 H3 Cu I N3 S -","- C5 H3 Cu I N3 S -","- C20 H12 Cu4 I4 N12 S4 -","4","1","BT6587","Näther, Christian; Wriedt, Mario; Jeß, Inke","Poly[[(2-iodopyrazine-κ<i>N</i>^4^)copper(I)]-μ~3~-thiocyanato-κ^3^<i>N</i>:<i>S</i>:<i>S</i>]","Acta Crystallographica Section E","2005","61","2","m329","m331","10.1107/S1600536805001327","","","0.71073","MoKα","","0.0488","0.0372","","","0.08","0.0856","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205008","15.422","0.002","3.8275","0.0006","19.282","0.003","90","","103.29","0.01","90","","1107.7","0.3","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H16 N4 O4 -","- C34 H16 N4 O4 -","- C68 H32 N8 O8 -","2","0.5","BT6588","Mizuguchi, Jin; Hino, Kazuyuki; Sato, Kazuyuki; Takahashi, Hiroo; Suzuki, Shigeru","<i>N,N</i>'-Di-3-pyridylperylene-3,4:9,10-bis(dicarboximide)","Acta Crystallographica Section E","2005","61","2","o434","o436","10.1107/S1600536805001996","","","1.5418","CuKα","","","0.0391","","","","0.0731","","","","","","0.94","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205009","17.599","0.001","7.1705","0.0005","20.679","0.002","90","","111.004","0.005","90","","2436.2","0.3","93.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H16 N4 O4 -","- C34 H16 N4 O4 -","- C136 H64 N16 O16 -","4","1","BT6589","Mizuguchi, Jin; Hino, Kazuyuki; Sato, Kazuyuki; Takahashi, Hiroo; Suzuki, Shigeru","<i>N,N</i>'-Di-2-pyridylperylene-3,4:9,10-bis(dicarboximide)","Acta Crystallographica Section E","2005","61","2","o437","o439","10.1107/S160053680500200X","","","1.5418","CuKα","","","0.0624","","","","0.0452","","","","","","1.889","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205010","21.232","0.002","15.89","0.002","6.9311","0.0008","90","","90","","90","","2338.4","0.5","93.2","","","","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C34 H16 N4 O4 -","- C34 H16 N4 O4 -","- C136 H64 N16 O16 -","4","0.5","BT6590","Hino, Kazuyuki; Sato, Kazuyuki; Takahashi, Hiroo; Suzuki, Shigeru; Mizuguchi, Jin","<i>N,N</i>'-Di-4-pyridylperylene-3,4:9,10-bis(dicarboximide)","Acta Crystallographica Section E","2005","61","2","o440","o441","10.1107/S1600536805002011","","","1.5418","CuKα","","","0.0737","","","","0.1475","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205011","15.795","0.003","7.917","0.002","9.829","0.002","90","","90.65","0.03","90","","1229","0.5","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","poly[[diaquacalcium(II)]-μ~4~-benzene-1,3-dioxyacetato]","","- C10 H12 Ca O8 -","- C10 H12 Ca O8 -","- C40 H48 Ca4 O32 -","4","1","BT6591","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Ng, Seik Weng","Twinned poly[[diaquacalcium(II)]-μ~4~-benzene-1,3-dioxyacetato]","Acta Crystallographica Section E","2005","61","2","m407","m409","10.1107/S1600536805002588","","","0.71073","MoKα","","0.075","0.061","","","0.166","0.203","","","","","","1.11","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205012","13.341","0.003","13.981","0.003","14.185","0.003","70.33","0.01","75.8","0.01","66.64","0.01","2268","0.9","275","2","295","2","","","","","","","","6","P -1","-P 1","2","","Tetrakis(μ~2~-4-tolylthioacetato-κ^2^O:O')bis[(pyridine-κN)copper(II)]","","- C46 H46 Cu2 N2 O8 S4 -","- C46 H46 Cu2 N2 O8 S4 -","- C92 H92 Cu4 N4 O16 S8 -","2","1","BT6592","Gao, Shan; Huo, Li-Hua; Shu, Hong; Ng, Seik Weng","Tetrakis(μ~2~-4-tolylthioacetato-κ^2^<i>O</i>:<i>O</i>')bis[(pyridine-κ<i>N</i>)copper(II)]","Acta Crystallographica Section E","2005","61","2","m389","m391","10.1107/S1600536805002412","","","0.71073","MoKα","","0.053","0.037","","","0.106","0.12","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205013","20.61","0.004","12.246","0.002","12.907","0.003","90","","90","","90","","3257.6","1.1","295","2","295","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Aquabis(3,5-dicarboxybenzoato-κO)bis(hexamethylenetetramine-κN)nickel(II)","","- C30 H36 N8 Ni O13 -","- C30 H36 N8 Ni O13 -","- C120 H144 N32 Ni4 O52 -","4","0.5","BT6593","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","Aquabis(3,5-dicarboxybenzoato-κ<i>O</i>)bis(hexamethylenetetramine-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2005","61","2","m392","m393","10.1107/S1600536805002424","","","0.71073","MoKα","","0.059","0.047","","","0.115","0.122","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205014","13.3078","0.0019","7.9299","0.0011","15.168","0.002","90","","90","","90","","1600.7","0.4","273","2","273","2","","","","","","","","3","P n a 21","P 2c -2n","33","","15,18-dimethyl-5-dioxo-14- oxapentacyclo[11.4.1.0^2,15^.0^4,13^.0^6,11^]octadeca-3,6,8,10-tetraene- 18-carbaldehyde","","- C20 H18 O4 -","- C20 H18 O4 -","- C80 H72 O16 -","4","1","BT6594","K. Ravikumar; B. Sridhar; S. Venkat Reddy; U. Sampath Kumar; J. Madhusudana Rao","The natural naphthoquinone sterekunthal-B","Acta Crystallographica Section E","2005","61","2","o494","o496","10.1107/S160053680500259X","","","0.71073","MoKα","","0.0399","0.0386","","","0.1027","0.1049","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205015","7.9612","0.0002","11.802","0.0003","15.3935","0.0004","90","","99.614","0.001","90","","1426.03","0.06","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[bis[aqua(1,10-phenanthroline)zinc(II)]-μ~4~-1,2,4,5- benzenetetracarboxylato]","","- C34 H22 N4 O10 Zn2 -","- C34 H22 N4 O10 Zn2 -","- C68 H44 N8 O20 Zn4 -","2","0.5","BV6008","Liu, Fu-Chen; Wang, Xiu-Li; Li, Jian-Rong; Ng, Seik Weng","<i>catena</i>-Poly[bis[aqua(1,10-phenanthroline)zinc(II)]-μ~4~-benzene-1,2,4,5-tetracarboxylato]","Acta Crystallographica Section E","2005","61","2","m299","m301","10.1107/S1600536805000711","","","0.71073","MoKα","","0.048","0.04","","","0.1","0.105","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205016","5.0587","0.0003","13.4343","0.0007","11.4989","0.0006","90","","96.149","0.001","90","","776.97","0.07","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexaaquamanganese(II) 5,5'-(1,4-phenylene)bis-tetrazolate","","- C8 H16 Mn N8 O6 -","- C8 H16 Mn N8 O6 -","- C16 H32 Mn2 N16 O12 -","2","0.5","BV6009","Ma, Zhi-Jie; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun","Hexaaquamanganese(II) 5,5'-(1,4-phenylene)ditetrazolate","Acta Crystallographica Section E","2005","61","2","m361","m363","10.1107/S1600536805001418","","","0.71073","MoKα","","0.0304","0.029","","","0.0797","0.0807","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205017","12.642","0.003","12.987","0.003","14.501","0.003","86.15","0.03","75.77","0.03","70.17","0.03","2170.6","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tris(1,10-phenanthroline-κN,N')manganese(II) bis(perchlorate) chloroform disolvate","","- C38 H26 Cl8 Mn N6 O8 -","- C38 H26 Cl8 Mn N6 O8 -","- C76 H52 Cl16 Mn2 N12 O16 -","2","1","BV6010","Cui, Guang-Hua; Li, Jian-Rong","Tris(1,10-phenanthroline-κ<i>N</i>,<i>N</i>')manganese(II) bis(perchlorate) chloroform disolvate","Acta Crystallographica Section E","2005","61","2","m349","m350","10.1107/S160053680500156X","","","0.71073","MoKα","","0.1129","0.0729","","","0.1849","0.205","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205018","11.75","0.006","13.512","0.007","14.068","0.007","65.43","0.006","86.264","0.007","81.663","0.007","2009.8","1.8","571","2","571","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-N-acetyl-N-phenylglycinato-κ^2^O,O')bis[(N-acetyl-N- phenylglycinato-κ^3^O,O,O)(1,10-phenanthroline-κ^2^N,N')cerium(III)] dihydrate","","- C84 H80 Ce2 N10 O20 -","- C84 H80 Ce2 N10 O20 -","- C84 H80 Ce2 N10 O20 -","1","0.5","CF6392","Fu, Ai-Yun; Fu, Shi-Zhou; Yu, Tao","Tetrakis(μ-<i>N</i>-acetyl-<i>N</i>-phenylglycinato-κ^2^<i>O,O</i>')bis[(<i>N</i>-acetyl-<i>N</i>-phenylglycinato-κ^3^<i>O,O,O</i>)(1,10-phenanthroline-κ^2^<i>N,N</i>')cerium(III)] dihydrate","Acta Crystallographica Section E","2005","61","2","m223","m225","10.1107/S1600536804034014","","","0.71073","MoKα","","0.0768","0.0468","","","0.1031","0.1226","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205019","11.163","0.004","6.651","0.002","21.519","0.007","90","","100.015","0.006","90","","1573.3","0.9","297","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-(Methylenedioxy)benzaldehyde benzoylhydrazone ethanol solvate","","- C17 H18 N2 O4 -","- C17 H18 N2 O4 -","- C68 H72 N8 O16 -","4","1","CF6394","Ai-Xiu Li; Li-Li Liu","3,4-(Methylenedioxy)benzaldehyde benzoylhydrazone ethanol solvate","Acta Crystallographica Section E","2005","61","2","o277","o279","10.1107/S1600536805000437","","","0.71073","MoKα","","0.0906","0.0451","","","0.1053","0.1364","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205020","6.4862","0.0001","27.931","0.0005","6.4787","0.0001","90","","109.894","0.0007","90","","1103.68","0.03","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","2-Azido-2-deoxy-3,4-O-isopropylidene-2-C-methyl-D-ribono-1,5-lactone","","- C9 H13 N3 O4 -","- C9 H13 N3 O4 -","- C36 H52 N12 O16 -","4","2","CF6395","Punzo, Francesco; Watkin, David J.; Jenkinson, Sarah F.; da Cruz, Filipa P.; Fleet, George W. J.","2-Azido-2-deoxy-3,4-<i>O</i>-isopropylidene-2-<i>C</i>-methyl-<small>D</small>-ribono-1,5-lactone","Acta Crystallographica Section E","2005","61","2","o511","o512","10.1107/S160053680500067X","","","0.71073","MoKα","","0.063","0.0446","","0.1018","0.0953","0.1018","","","","","","0.9941","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205021","9.5559","0.0002","13.8885","0.0005","15.2346","0.0005","90","","91.557","0.002","90","","2021.15","0.11","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetra-n-butylammonium hexafluorophosphate","","- C16 H36 F6 N P -","- C16 H36 F6 N P -","- C64 H144 F24 N4 P4 -","4","1","CF6396","Zafra Stein; Israel Goldberg","Tetra-<i>n</i>-butylammonium hexafluorophosphate at 110K","Acta Crystallographica Section E","2005","61","2","o272","o274","10.1107/S1600536805000462","","","0.71073","MoKα","","0.074","0.0483","","","0.1169","0.1301","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205022","7.74","0.002","5.6749","0.0013","11.484","0.002","90","","101.055","0.002","90","","495.06","0.19","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","p-Phenylene diacetate","","- C10 H10 O4 -","- C10 H10 O4 -","- C20 H20 O8 -","2","0.5","CF6399","Juan Men; Fengcai Gu; Huifang Sun","<i>p</i>-Phenylene diacetate","Acta Crystallographica Section E","2005","61","2","o471","o472","10.1107/S1600536805002199","","","0.71073","MoKα","","0.0632","0.0393","","","0.1052","0.1162","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205023","6.635","0.005","9.239","0.007","9.359","0.008","115.53","0.03","107.51","0.02","95.6","0.02","476.2","0.7","296.1","","296.1","","","","","","","","","4","P -1","-P 1","2","","Diaquabis(μ-4-hydroxybenzenecarboxylato-κ^2^O,O')disilver(I)(Ag—Ag) tetrahydrate","","- C14 H22 Ag2 O12 -","- C14 H22 Ag2 O12 -","- C14 H22 Ag2 O12 -","1","0.5","CF6400","Wang, Yue; Okabe, Nobuo","Diaquabis(μ-4-hydroxybenzenecarboxylato-κ^2^<i>O</i>,<i>O</i>')disilver(I)(<i>Ag</i>—<i>Ag</i>) tetrahydrate","Acta Crystallographica Section E","2005","61","2","m382","m384","10.1107/S1600536805002217","","","0.71075","MoKα","","0.0276","0.0249","","","0.064","0.0653","","","","","","1.073","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205024","24.26","0.001","9.0818","0.0005","15.0164","0.0008","90","","115.516","0.001","90","","2985.8","0.3","90","1","90","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(tetrahydroborate-H,H')-bis(triphenylphosphine)-copper(I)","","- C36 H34 B Cu P2 -","- C36 H34 B Cu P2 -","- C144 H136 B4 Cu4 P8 -","4","0.5","CI6482","Moncol, Jan; Gembicky, Milan; Coppens, Philip","(Tetrahydroborato)bis(triphenylphosphine)copper(I): a redetermination at 90K","Acta Crystallographica Section E","2005","61","2","m242","m243","10.1107/S1600536804030314","","","0.71069","MoKα","","0.0245","0.0225","","","0.0633","0.0643","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205025","10.472","0.003","13.526","0.004","14.963","0.005","113.44","0.005","100.681","0.006","104.926","0.006","1777.1","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(8E)-8-benzylidene-3,4,5,6,7,8-hexahydro-4-phenylquinazoline-2(1H)-thione","","- C21 H20 N2 S -","- C21 H20 N2 S -","- C84 H80 N8 S4 -","4","2","CI6498","Zhang, Xiu-Ling; Liang, Zu-Pei","(8<i>E</i>)-8-Benzylidene-3,4,5,6,7,8-hexahydro-4-phenylquinazoline-2(1<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","2","o217","o219","10.1107/S1600536804033859","","","0.71073","MoKα","","0.1142","0.0479","","","","0.129","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205026","13.8103","0.0009","11.5082","0.0007","15.0809","0.0009","90","","113.236","0.001","90","","2202.4","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-hydroxy-2-naphthoate","","- C13 H12 O3 -","- C13 H12 O3 -","- C104 H96 O24 -","8","2","CI6506","Jin, Cheng-Zhi; Jin, Long-Fei","Ethyl 3-hydroxy-2-naphthoate","Acta Crystallographica Section E","2005","61","2","o275","o276","10.1107/S1600536805000176","","","0.71073","MoKα","","0.121","0.0636","","","0.1221","0.1467","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205027","7.7115","0.0007","18.8101","0.0016","15.2619","0.0013","90","","97.023","0.001","90","","2197.2","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[(1,10-phenanthroline)nickel(II)]-μ-4,4'-oxydibenzoato] 0.25-hydrate]","","- C26 H16.5 N2 Ni O5.25 -","- C26 H16 N2 Ni O5.25 -","- C104 H64 N8 Ni4 O21 -","4","1","CI6507","Hong-Ping Xiao; Jia-Guo Wang; Xin-Hua Li; Mao-Lin Hu; Wei-Bing Zhang","<i>catena</i>-Poly[[[(1,10-phenanthroline)nickel(II)]-μ-4,4'-oxydibenzoato] 0.25-hydrate]","Acta Crystallographica Section E","2005","61","2","m257","m259","10.1107/S1600536805000218","","","0.71073","MoKα","","0.0709","0.05","","","0.1191","0.1268","","","","","","1.024","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205028","8.3212","0.0008","8.9609","0.0009","9.8813","0.001","97.07","0.002","101.475","0.002","108.355","0.002","671.54","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H19 N2 O5 P -","- C10 H19 N2 O5 P -","- C20 H38 N4 O10 P2 -","2","1","CI6511","He-Jiao Hu; Cui-Rong Sun; Hong Zhang; Yuan-Jiang Pan","<i>N</i>-(Dicyclopropylmethylamino)-4,5-dihydro-1,3-oxazolium dihydrogenphosphate","Acta Crystallographica Section E","2005","61","2","o413","o415","10.1107/S1600536805001571","","","0.71073","MoKα","","0.0325","0.0298","","","0.0827","0.0843","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205029","8.2642","0.0013","11.4273","0.0018","12.099","0.0019","90","","94.709","0.002","90","","1138.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Methoxyphenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C12 H13 N3 O2 -","- C12 H13 N3 O2 -","- C48 H52 N12 O8 -","4","1","CI6512","Jun Wan; Chun-Li Li; Xue-Mei Li; Shu-Sheng Zhang","1-(4-Methoxyphenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","2","o307","o308","10.1107/S1600536805000681","","","0.71073","MoKα","","0.044","0.0397","","","0.1076","0.1122","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205030","9.111","0.003","18.921","0.007","16.536","0.005","90","","92.368","0.006","90","","2848.2","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,3'-(p-phenylenedimethylene)bis(1-methylimiadzolium)‒tetrachloroargentate(I) (3/2)","","- C48 H60 Ag2 Cl8 N12 -","- C48 H60 Ag2 Cl8 N12 -","- C96 H120 Ag4 Cl16 N24 -","2","0.5","CI6513","Wang, Jun-Wen; Xu, Feng-Bo; Li, Qing-Shan; Song, Hai-Bin; Zhang, Zheng-Zhi","3,3'-(<i>p</i>-Phenylenedimethylene)bis(1-methylimidazolium)‒tetrachloroargentate(I) (3/2)","Acta Crystallographica Section E","2005","61","2","m367","m369","10.1107/S1600536805001583","","","0.71073","MoKα","","0.0951","0.0506","","","0.1156","0.1315","","","","","","1.074","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205031","4.6082","0.0001","12.965","0.004","18.105","0.005","100.074","0.005","92.978","0.005","96.526","0.005","1055.3","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","3-Geranyloxy-6-methyl-1,8-dihydroxyanthraquinone","3-(3,7-Dimethylocta-2,6-dienyloxy)-1,8-dihydroxy-6-methyl-9,10-anthraquinone","","- C25 H26 O5 -","- C25 H26 O5 -","- C50 H52 O10 -","2","1","CI6514","Nawong Boonnak; Suchada Chantrapromma; Hoong-Kun Fun; Shazia Anjum; Shamsher Ali; Atta-ur-Rahman; Chatchanok Karalai","3-(3,7-Dimethylocta-2,6-dienyloxy)-1,8-dihydroxy-6-methyl-9,10-anthraquinone","Acta Crystallographica Section E","2005","61","2","o410","o412","10.1107/S1600536805001674","","","0.71073","MoKα","","0.1426","0.0856","","","0.1924","0.2192","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205032","7.8361","0.0006","4.009","0.0003","21.572","0.002","90","","97.586","0.007","90","","671.75","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-methylenedithio-1,3-dithiol-2-one","","- C4 H2 O S4 -","- C4 H2 O S4 -","- C16 H8 O4 S16 -","4","1","CI6515","Xue, Gang; Yu, Wentao; Fang, Qi","4,5-Methylenedithio-1,3-dithiol-2-one","Acta Crystallographica Section E","2005","61","2","o429","o430","10.1107/S160053680500173X","","","0.71073","MoKα","","0.0348","0.0263","","","0.0634","0.0677","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205033","22.779","0.003","11.7073","0.0012","16.8032","0.0016","90","","124.978","0.006","90","","3671.7","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-{[(1Z)-(3-Methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4- ylidene)(phenyl)methyl]amino}propionic acid","","- C20 H19 N3 O3 -","- C20 H19 N3 O3 -","- C160 H152 N24 O24 -","8","1","CI6517","Hai-Zhen Xu; Xin Zhang; Gui-Sheng Yu","3-{[(1<i>Z</i>)-(3-Methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4-ylidene)(phenyl)methyl]amino}propionic acid","Acta Crystallographica Section E","2005","61","2","o456","o458","10.1107/S1600536805002023","","","0.71073","MoKα","","0.0673","0.0396","","","0.1045","0.1182","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205034","15.113","0.002","15.692","0.002","16.806","0.002","90","","90","","90","","3985.6","0.9","293","2","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(1,4,7,10,13,16-hexaoxacyclooctadecane-κ^6^O)potassium chlorochromate","","- C12 H24 Cl Cr K O9 -","- C12 H24 Cl Cr K O9 -","- C96 H192 Cl8 Cr8 K8 O72 -","8","1","CV6410","Kotlyar, Sergei A.; Zubatyuk, Roman I.; Shishkin, Oleg V.; Chuprin, Gennady N.; Kiriyak, Andrey V.; Kamalov, Gerbert L.","(18-Crown-6)potassium chlorochromate","Acta Crystallographica Section E","2005","61","2","m293","m295","10.1107/S1600536805000085","","","0.71073","MoKα","","","0.0816","","","","0.2526","","","","","","0.909","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205035","7.2372","0.0008","8.1279","0.0009","9.1779","0.001","69.491","0.002","78.012","0.002","84.999","0.002","494.57","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaqua bis(6-nitro-3H-benzimidazol) copper(II) dinitrate","","- C14 H14 Cu N8 O12 -","- C14 H14 Cu N8 O12 -","- C14 H14 Cu N8 O12 -","1","0.5","CV6433","Cai-Feng Ding; Shu-Sheng Zhang; Bing-Qing Tian; Xue-Mei Li; Hong Xu; Ping-Kai Ouyang","Diaquabis(5-nitro-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)copper(II) dinitrate","Acta Crystallographica Section E","2005","61","2","m235","m236","10.1107/S1600536804034300","","","0.71073","MoKα","","0.0317","0.03","","","0.0812","0.0829","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205036","9.3325","0.0008","10.7217","0.0009","14.2612","0.0012","77.4","0.001","71.961","0.001","65.437","0.001","1227.44","0.18","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[(4'-phenyl-2,2':6',2''-terpyridine-κ^3^N,N',N'')zinc(II)]- μ-terephthalato-κ^2^O:O'] monohydrate]","","- C29 H21 N3 O5 Zn -","- C29 H21 N3 O5 Zn -","- C58 H42 N6 O10 Zn2 -","2","1","CV6436","Tu, Qi-Dong; Yin, Ye-Gao; He, Jun; Xiang, Jing; Li, Dan; Ng, Seik Weng","<i>catena</i>-Poly[[[(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')zinc(II)]-μ-terephthalato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2005","61","2","m254","m256","10.1107/S1600536805000127","","","0.71073","MoKα","","0.0813","0.0592","","","0.136","0.1512","","","","","","1.115","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205037","16.3545","0.0004","10.8868","0.0003","18.4635","0.0005","90","","104.102","0.002","90","","3188.32","0.15","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(±)-1-[(cyclohexyloxy)carbonyloxy]ethyl 2-ethoxy-1-{[2'-(1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-1H-benzimidazole- 7-carboxylate","","- C33 H34 N6 O6 -","- C33 H34 N6 O6 -","- C132 H136 N24 O24 -","4","1","CV6437","Fernández, Daniel; Vega, Daniel; Ellena, Javier A.","Candesartan cilexetil, an antihypertensive agent containing an extended double ester chain","Acta Crystallographica Section E","2005","61","2","o309","o312","10.1107/S1600536805000097","","","0.71073","MoKα","","0.1176","0.0877","","","0.2531","0.2917","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205038","10.8731","0.0009","18.7861","0.0014","20.5836","0.0019","90","","90","","90","","4204.5","0.6","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","4-Benzoyl-1,5-diphenyl-1H-pyrazole-3-carboxylic acid methanol solvate","","- C24 H20 N2 O4 -","- C24 H20 N2 O4 -","- C192 H160 N16 O32 -","8","1","CV6438","Yıldırım, İsmail; Özdemir, Namık; Akçamur, Yunus; Dinçer, Muharrem; Andaç, Ömer","4-Benzoyl-1,5-diphenyl-1<i>H</i>-pyrazole-3-carboxylic acid methanol solvate","Acta Crystallographica Section E","2005","61","2","o256","o258","10.1107/S1600536804034348","","","0.71073","MoKα","","0.1046","0.043","","","0.0738","0.0792","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205039","10.216","0.002","15.445","0.004","13.01","0.006","90","","106.37","0.02","90","","1969.6","1.1","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","tert-butylmerocyanine","4-[(1-Methyl-1,4-dihydropyridinylidene)ethylidene]-2,6-di-tert-butyl-2,5- cyclohexadien-1-one","","- C22 H29 N O -","- C22 H29 N O -","- C88 H116 N4 O4 -","4","1","CV6439","Masciocchi, Norberto; Scuderi, Patrizia; Maspero, Angelo","Brooker's di-<i>tert</i>-butylmerocyanine","Acta Crystallographica Section E","2005","61","2","o227","o229","10.1107/S1600536804034129","","","0.71073","MoKα","","0.1479","0.071","","","0.165","0.2074","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205040","10.1918","0.0009","17.7185","0.0016","14.1563","0.0013","90","","106","0.002","90","","2457.4","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Z)-Ethyl 3-phenyl-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","","- C29 H26 N O2 P -","- C29 H26 N O2 P -","- C116 H104 N4 O8 P4 -","4","1","CV6440","Huang, Xiao-Bo; Liu, Miao-Chang; Wu, Hua-Yue; Ding, Jin-Chang; Hu, Mao-Lin","(<i>Z</i>)-Ethyl 3-phenyl-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","Acta Crystallographica Section E","2005","61","2","o280","o281","10.1107/S1600536805000309","","","0.71073","MoKα","","0.0639","0.054","","","0.1248","0.1306","","","","","","1.116","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205041","8.8895","0.0011","8.9281","0.001","9.6787","0.0013","98.382","0.01","113.16","0.01","101.06","0.009","671.99","0.16","293","","293","","","","","","","","","4","P -1","-P 1","2","1,2,4,5,7-Pentabromo-5-methoxyindane","(1RS,2SR)-1,2,4,5,7-Pentabromo-5-methoxyindane","","- C10 H7 Br5 O -","- C10 H7 Br5 O -","- C20 H14 Br10 O2 -","2","1","CV6443","Mehmet Akkurt; Ísmail Çelik; Kıymet Berkil; Ahmet Tutar; Cem Cüneyt Ersanlı; Osman Çakmak; Orhan Büyükgüngör","(1<i>RS</i>,2S<i>R</i>)-1,2,4,5,7-Pentabromo-5-methoxyindane","Acta Crystallographica Section E","2005","61","2","o475","o477","10.1107/S160053680500111X","","","0.71073","MoKα","","0.1111","0.0412","","","0.0644","0.0735","","","","","","0.813","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205042","21.473","0.004","10.229","0.002","12.353","0.002","90","","98.68","0.02","90","","2682.2","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Melaminium benzoate dihydrate","","- C10 H16 N6 O4 -","- C10 H16 N6 O4 -","- C80 H128 N48 O32 -","8","1","CV6445","Genivaldo Julio Perpétuo; Jan Janczak","Melaminium benzoate dihydrate","Acta Crystallographica Section E","2005","61","2","o287","o289","10.1107/S1600536805000619","","","0.71073","MoKα","","0.0622","0.0361","","","0.0836","0.0942","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205043","4.6858","0.0007","8.2573","0.0009","17.627","0.002","90","","90","","90","","682.02","0.15","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","5-aminophthalide","5-Amino-3H-isobenzofuran-1-one","","- C8 H7 N O2 -","- C8 H7 N O2 -","- C32 H28 N4 O8 -","4","1","CV6446","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Prabhuswamy, Basappa; Bolte, Michael","5-Amino-3<i>H</i>-isobenzofuran-1-one (5-aminophthalide)","Acta Crystallographica Section E","2005","61","2","o343","o344","10.1107/S1600536805000851","","","0.71073","MoKα","","0.0317","0.0264","","","0.0652","0.0673","","","","","","1.044","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205044","15.4063","0.0019","6.0861","0.0006","15.4426","0.0016","90","","93.95","0.009","90","","1444.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","5-bromophthalide","5-Bromo-3H-isobenzofuran-1-one","","- C8 H5 Br O2 -","- C8 H5 Br O2 -","- C64 H40 Br8 O16 -","8","2","CV6447","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Prabhuswamy, Basappa; Bolte, Michael","5-Bromo-3<i>H</i>-isobenzofuran-1-one (5-bromophthalide)","Acta Crystallographica Section E","2005","61","2","o345","o346","10.1107/S160053680500084X","","","0.71073","MoKα","","0.0758","0.0488","","","0.1109","0.1215","","","","","","0.965","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205045","8.4201","0.0002","16.2404","0.0003","15.196","0.0004","90","","103.844","0.001","90","","2017.63","0.08","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(η^6^-N,N-Diethylaniline)(η^4^-1,2,3,4-tetramethylcyclobutadiene)cobalt(I) hexafluorophosphate","","- C18 H27 Co F6 N P -","- C18 H27 Co F6 N P -","- C72 H108 Co4 F24 N4 P4 -","4","1","CV6448","Kennedy, Alan R.; Pauson, Peter L.","(η^6^-<i>N,N</i>-Diethylaniline)(η^4^-1,2,3,4-tetramethylcyclobutadiene)cobalt(I) hexafluorophosphate","Acta Crystallographica Section E","2005","61","2","m302","m303","10.1107/S1600536805000863","","","0.71073","MoKα","","0.0946","0.0523","","","0.1212","0.1407","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205046","9.8221","0.001","10.6654","0.001","16.5207","0.0016","107.009","0.002","101.652","0.002","100.645","0.002","1565","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(Z)-3-Phenylethyl-5-phenylmethylidene-2-thioxo-1H-imidazolidin-4-one","","- C18 H16 N2 O S -","- C18 H16 N2 O S -","- C72 H64 N8 O4 S4 -","4","2","CV6452","Hua-Yue, Wu; Xiao-Bo, Huang; Jin-Chang, Ding; Miao-Chang, Liu; Mao-Lin, Hu","(<i>Z</i>)-5-Benzylidene-3-phenethyl-2-thioxoimidazolidin-4-one","Acta Crystallographica Section E","2005","61","2","o497","o499","10.1107/S1600536805002667","","","0.71073","MoKα","","0.1054","0.0757","","","0.1662","0.1895","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205047","17.944","0.001","11.9692","0.0006","6.9072","0.0003","90","","90","","90","","1483.5","0.13","298","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","(2-Phenylethyl)ammonium tetrabromothallate(III)","","- C8 H12 Br4 N Tl -","- C8 H12 Br4 N Tl -","- C32 H48 Br16 N4 Tl4 -","4","1","DN6172","M. Abdi; F. Zouari; N. Chniba-Boudjada; P. Bordet; A. Ben Salah","(2-Phenylethyl)ammonium tetrabromothallate(III)","Acta Crystallographica Section E","2005","61","2","m240","m241","10.1107/S1600536804033070","","","0.56085","AgKα","","0.0989","0.0511","","","0.107","0.1316","","","","","","1.03","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205048","8.447","0.005","10.821","0.007","11.759","0.007","67.224","0.009","70.794","0.009","77.127","0.009","930.2","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2-[(E)-Benzylideneamino]-N-(2-fluorophenyl)-4,5,6,7-tetrahydro-1- benzothiophene-3-carboxamide","","- C22 H19 F N2 O S -","- C22 H19 F N2 O S -","- C44 H38 F2 N4 O2 S2 -","2","1","DN6180","Vasu; Nirmala, K. A.; Chopra, Deepak; Mohan, S.; Saravanan, J.","2-[(<i>E</i>)-Benzylideneamino]-<i>N</i>-(2-fluorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","2","o236","o238","10.1107/S1600536804033008","","","0.71073","MoKα","","0.0533","0.0462","","","0.1217","0.1282","","","","","","1.038","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205049","16.6509","0.0003","9.7336","0.0002","8.9989","0.0003","90","","90","","90","","1458.48","0.06","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","creatininium nitrate","","","- C4 H8 N4 O4 -","- C4 H8 N4 O4 -","- C32 H64 N32 O32 -","8","1","DN6185","Fadila, Berrah; Hanane, Lamraoui; Nourredine, Benali-Cherif","Hydrogen bonding in creatininium nitrate","Acta Crystallographica Section E","2005","61","2","o210","o212","10.1107/S1600536804032349","","","0.71073","MoKα","","0.0641","0.04","","","0.1001","0.1098","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205050","10.8401","0.0007","17.359","0.001","15.611","0.001","90","","106.534","0.001","90","","2816.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(di-2-pyridylmethanediol-κ^3^N,O,N')nickel(II) dilactate","","- C28 H30 N4 Ni O10 -","- C28 H30 N4 Ni O10.001 -","- C112 H120 N16 Ni4 O40.004 -","4","1","DN6186","Li, Cui-Jin; Li, Wei; Tong, Ming-Liang; Ng, Seik Weng","Bis(di-2-pyridylmethanediol-κ^3^<i>N,O,N</i>')nickel(II) dilactate","Acta Crystallographica Section E","2005","61","2","m229","m231","10.1107/S1600536804033975","","","0.71073","MoKα","","0.059","0.045","","","0.105","0.112","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205051","23.557","0.002","8.5744","0.0006","15.848","0.001","90","","91.983","0.001","90","","3199.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(di-2-pyridylmethanediol-κ^3^N,O,N')copper(II) diacetate tetrahydrate","","- C26 H34 Cu N4 O12 -","- C26 H34 Cu N4 O12 -","- C104 H136 Cu4 N16 O48 -","4","0.5","DN6187","Li, Cui-Jin; Li, Wei; Tong, Ming-Liang; Ng, Seik Weng","A <i>C</i>-centered monoclinic modification of bis(di-2-pyridylmethanediol-κ^3^<i>N,O,N</i>')copper(II) diacetate tetrahydrate","Acta Crystallographica Section E","2005","61","2","m232","m234","10.1107/S1600536804033987","","","0.71073","MoKa","","0.043","0.037","","","0.114","0.119","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205052","10.7048","0.0017","16.38","0.003","28.722","0.005","90","","90","","90","","5036.2","1.5","110","2","110","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","bis[μ-6,6'-di-tert-butyl-4,4'-dimethyl-2,2- (ethylenedithio)diphenolato]bis[methylaluminium(I)]","","- C50 H70 Al2 O4 S4 -","- C50 H70 Al2 O4 S4 -","- C200 H280 Al8 O16 S16 -","4","0.5","DN6188","Ma, Haiyan; Melillo, Gianluca; Oliva, Leone; Spaniol, Thomas P.; Okuda, Jun","A dimeric alkyl complex supported by an <i>O,S,S,O</i>-tetradentate diphenolate ligand","Acta Crystallographica Section E","2005","61","2","m221","m222","10.1107/S1600536804033793","","","0.71073","MoKα","","0.0464","0.041","","","0.1057","0.1094","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205053","11.0319","0.0005","6.8524","0.0004","7.7018","0.0004","90","","105.444","0.003","90","","561.19","0.05","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-poly[[bis(1-methyl-1H-tetrazole-κN^4^)copper(II)]-di-μ-bromo]","","- C4 H8 Br2 Cu N8 -","- C4 H8 Br2 Cu N8 -","- C8 H16 Br4 Cu2 N16 -","2","0.5","DN6190","Ivashkevich, Ludmila S.; Lyakhov, Alexander S.; Gaponik, Pavel N.; Degtyarik, Michail M.","An X-ray powder diffraction study of <i>catena</i>-poly[[bis(1-methyl-1<i>H</i>-tetrazole-κ<i>N</i>^4^)copper(II)]-di-μ-bromo]","Acta Crystallographica Section E","2005","61","2","m394","m396","10.1107/S1600536805002205","","","1.5418","CuKα","","","","","","","","","","1.23","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205054","20.6438","0.0019","5.3153","0.0005","16.7247","0.0015","90","","97.039","0.002","90","","1821.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-Diphenyl-2,2'-(1,3,4-thiadiazolyl-2,5-dithio)diacetamide","","- C18 H16 N4 O2 S3 -","- C18 H16 N4 O2 S3 -","- C72 H64 N16 O8 S12 -","4","1","DN6192","Yong-Hong Wen; Shu-Sheng Zhang; Bao-Hui Yu; Xue-Mei Li; Qing Liu","<i>N</i>,<i>N</i>'-Diphenyl-2,2'-(1,3,4-thiadiazolyl-2,5-dithio)diacetamide","Acta Crystallographica Section E","2005","61","2","o347","o348","10.1107/S1600536805001479","","","0.71073","MoKα","","0.0493","0.039","","","0.0951","0.1017","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205055","10.748","0.003","14.417","0.004","10.92","0.003","90","","111.28","0.004","90","","1576.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dimethyl [phenyl(pyridine-4-carboxamido)methyl]phosphonate","","- C15 H17 N2 O4 P -","- C15 H17 N2 O4 P -","- C60 H68 N8 O16 P4 -","4","1","DN6194","Fang, Hua; Fang, Mei-Juan; Liu, Xiao-Xia; Lin, Jing-Jing; Zhao, Yu-Fen","Dimethyl [phenyl(pyridine-4-carboxamido)methyl]phosphonate","Acta Crystallographica Section E","2005","61","2","o408","o409","10.1107/S1600536805001492","","","0.71073","MoKα","","0.0658","0.0603","","","0.1361","0.1394","","","","","","1.152","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205056","9.001","0.0018","9.551","0.0019","14.251","0.003","90","","102.94","0.03","90","","1194","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Phenyl-3-[(1H-1,2,4-triazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione","","- C11 H10 N6 S -","- C11 H10 N6 S -","- C44 H40 N24 S4 -","4","1","DN6195","Fangfang Jian; Zhengshuai Bai; Kai Li; Hailian Xiao","4-Phenyl-3-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-1<i>H</i>-1,2,4-triazole-5-thione","Acta Crystallographica Section E","2005","61","2","o393","o395","10.1107/S1600536805001510","","","0.71073","MoKα","","0.0681","0.0335","","","0.0743","0.0841","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205057","8.086","0.004","10.635","0.005","14.519","0.007","90","","103.614","0.008","90","","1213.5","1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Bis[(2E)-3-(N,N-dimethylamino)-1-(2-pyridyl)prop-2-en-1- one]diisothiocyanatonickel(II)","","- C22 H24 N6 Ni O2 S2 -","- C22 H24 N6 Ni O2 S2 -","- C44 H48 N12 Ni2 O4 S4 -","2","0.5","DN6198","Gai-Xian Li; Jian-Qing Li; Xu-Zhen Kang","<i>trans</i>-Bis[(2<i>E</i>)-3-(<i>N,N</i>-dimethylamino)-1-(2-pyridyl)prop-2-en-1-one]diisothiocyanatonickel(II)","Acta Crystallographica Section E","2005","61","2","m410","m411","10.1107/S1600536805002795","","","0.71073","MoKα","","0.1219","0.0696","","","0.1248","0.1449","","","","","","0.975","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205058","7.173","0.0014","12.267","0.003","7.868","0.0016","90","","100.75","0.03","90","","680.2","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","4-Methyl-2-thioxo-2,3-dihydrothiazol-3-yl 4-methylphenyl carbonate","","- C12 H11 N O3 S2 -","- C12 H11 N O3 S2 -","- C24 H22 N2 O6 S4 -","2","1","FL6139","Hartung, Jens; Schneiders, Nina; Bergsträsser, Uwe","4-Methyl-2-thioxo-2,3-dihydrothiazol-3-yl 4-methylphenyl carbonate","Acta Crystallographica Section E","2005","61","2","o421","o422","10.1107/S1600536805001431","","","0.71073","MoKα","","0.0915","0.0707","","","0.1383","0.1499","","","","","","1.135","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205059","7.5364","0.0012","9.9","0.0016","23.288","0.004","90","","90","","90","","1737.5","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","16α,17-Epoxypregn-4-ene-3,11,20-trione","17-acetyl-10,13-dimethyl-1,2,6,7,9,10,12,13,14,15,16, 17-dodecahydro-8H-20-oxa-cyclopropa[16,17]cyclopenta[a]phenanthrene-3,11-dione","","- C21 H26 O4 -","- C21 H26 O4 -","- C84 H104 O16 -","4","1","FL6141","Nie, Qiang; Wang, Jingkang; Wang, Shi; Zhang, Meijing","16α,17-Epoxypregn-4-ene-3,11,20-trione","Acta Crystallographica Section E","2005","61","2","o398","o399","10.1107/S1600536805001443","","","0.71073","MoKα","","0.0524","0.0396","","","0.1023","0.1086","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205060","6.7128","0.0003","6.7911","0.0002","13.6379","0.0008","75.83","0.003","75.999","0.002","78.326","0.003","578.08","0.05","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","4-Aminopyridinium isonicotinate monohydrate","","- C11 H13 N3 O3 -","- C11 H13 N3 O3 -","- C22 H26 N6 O6 -","2","1","FL6142","Kennedy, Alan R.; Kittner, Madeleine","4-Aminopyridinium isonicotinate monohydrate","Acta Crystallographica Section E","2005","61","2","o333","o334","10.1107/S1600536805000887","","","0.71073","MoKα","","0.0507","0.0359","","","0.0825","0.0903","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205061","14.473","0.003","6.994","0.001","17.2","0.003","90","","103.37","0.03","90","","1693.9","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-acetyl-4,6-dimethyl-1,2,3,4-tetrahydropyrimidin-2-one","","- C8 H12 N2 O2 -","- C8 H12 N2 O2 -","- C64 H96 N16 O16 -","8","1","GH6009","Zavodnik, Valery E.; Shutalev, Anatoly D.; Gurskaya, Galina V.; Stash, Adam I.; Tsirelson, Vladimir G.","5-Acetyl-4,6-dimethyl-1,2,3,4-tetrahydropyrimidin-2-one","Acta Crystallographica Section E","2005","61","2","o365","o367","10.1107/S1600536805000383","","","0.71073","MoKα","","0.052","0.0294","","","0.0919","0.0948","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205062","10.8364","0.0008","19.4649","0.0015","12.6722","0.001","90","","103.926","0.001","90","","2594.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,6-Bis(4-methoxyphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","2,6-Bis(4-methoxyphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","","- C31 H28 N2 O4 -","- C31 H28 N2 O4 -","- C124 H112 N8 O16 -","4","1","GH6010","S. Natarajan; R. V. Krishnakumar; M. Subha Nandhini; V. P. Alex Raja; S. Perumal; K. Ravikumar","2,6-Bis(4-methoxyphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","Acta Crystallographica Section E","2005","61","2","o359","o361","10.1107/S1600536805000954","","","0.71073","MoKα","","0.0689","0.0508","","","0.1376","0.1512","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205063","7.8006","0.0005","11.6289","0.0008","11.9121","0.0008","67.701","0.001","75.488","0.001","78.896","0.001","962.12","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(2-amino-4,6-dimethylpyrimidine)(nickel(II)thiocyante)","Tetraaquadithiocyanatonickel(II) tetrakis(2-amino-4,6-dimethylpyrimidine) dihydrate","","- C26 H48 N14 Ni O6 S2 -","- C26 H48 N14 Ni O6 S2 -","- C26 H48 N14 Ni O6 S2 -","1","0.5","HB6132","Madhukar Hemamalini; Packianathan Thomas Muthiah; Ray J. Butcher","Tetraaquadithiocyanatonickel(II) tetrakis(2-amino-4,6-dimethylpyrimidine) dihydrate","Acta Crystallographica Section E","2005","61","2","m204","m206","10.1107/S1600536804033884","","","0.71073","MoKα","","0.0652","0.0445","","","0.1065","0.1151","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205064","23.562","0.003","6.5271","0.0005","28.881","0.004","90","","108.863","0.01","90","","4203.1","0.9","296","1","296","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[μ-2,8-Dimethyl-5,11-bis(dimethylaminoethyl)-1,4,5,6,7,10,11,12- octahydrodiimidazo[4,5-h;4,5-c][1,6]diazecine]bis[aquacopper(II)] diacetate hexahydrate","","- C28 H64 Cu2 N8 O16 -","- C28 H64 Cu2 N8 O16 -","- C112 H256 Cu8 N32 O64 -","4","0.5","HB6133","Gasque, Laura; Olguín, Juan; Bernès, Sylvain","[μ-2,8-Dimethyl-5,11-bis(dimethylaminoethyl)-1,4,5,6,7,10,11,12-octahydrodiimidazo[4,5-<i>h</i>;4,5-<i>c</i>][1,6]diazecine]bis[aquacopper(II)] diacetate hexahydrate","Acta Crystallographica Section E","2005","61","2","m274","m276","10.1107/S1600536805000206","","","0.71073","MoKα","","0.0408","0.032","","","0.0878","0.0927","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205065","10.715","0.002","9.2","0.001","11.692","0.002","90","","92.02","0.04","90","","1151.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(Benzoylthiocarbonyl)morpholine","","- C12 H13 N O2 S -","- C12 H13 N O2 S -","- C48 H52 N4 O8 S4 -","4","1","HB6134","Liu, Wei-Wei; Li, Yi-Zhi; Kong, Ling-Dong; Hu, Hong-Wen","4-(Benzoylthiocarbonyl)morpholine","Acta Crystallographica Section E","2005","61","2","o295","o297","10.1107/S1600536805000449","","","0.71073","MoKα","","0.0935","0.057","","","0.0987","0.1077","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205066","12.2038","0.0004","12.6561","0.0004","16.9518","0.0006","90","","95.714","0.001","90","","2605.24","0.15","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua(bromomaleatoκ-O)bis(phenanthroline-κ^2^N,N')manganese(II) monohydrate","","- C28 H21 Br Mn N4 O6 -","- C28 H21 Br Mn N4 O6 -","- C112 H84 Br4 Mn4 N16 O24 -","4","1","HB6135","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","Aqua(bromomaleato-κ<i>O</i>)bis(phenanthroline-κ^2^<i>N,N</i>')manganese(II) monohydrate","Acta Crystallographica Section E","2005","61","2","m271","m273","10.1107/S1600536805000486","","","0.71073","MoKα","","0.054","0.032","","","0.075","0.081","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205067","6.873","0.005","9.721","0.005","15.523","0.002","90","","96.49","0.01","90","","1030.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-oxopyridinato N-oxide-κ^2^O,O')copper(II)","","- C10 H8 Cu N2 O4 -","- C10 H8 Cu N2 O4 -","- C40 H32 Cu4 N8 O16 -","4","1","HB6136","Xu, Li; Li, Yi-Zhi; Liu, San-Hui; Chen, Xue-Tai; Zhou, Jian-Hao","Bis(2-oxopyridinatoN-oxide-κ^2^O,O')copper(II)","Acta Crystallographica, Section E: Structure Reports Online","2005","61","2","m364","m366","10.1107/s1600536805001819","","","0.71073","MoKα","","0.0512","0.0438","","","0.1094","0.1129","","","","","","0.989","","","","has coordinates","219069","2020-10-21","18:00:00",""
"2205068","8.343","0.002","12.302","0.003","17.54","0.004","98.82","0.03","102.77","0.03","97.7","0.03","1708.4","0.8","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,2'-bipyridine)(3-carboxy-4-hydroxybenzenesulfonato)copper(II) 3-carboxy-4-hydroxybenzenesulfonate","","- C34 H26 Cu N4 O12 S2 -","- C34 H26 Cu N4 O12 S2 -","- C68 H52 Cu2 N8 O24 S4 -","2","1","HB6137","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","Bis(2,2'-bipyridine)(3-carboxy-4-hydroxybenzenesulfonato)copper(II) 3-carboxy-4-hydroxybenzenesulfonate","Acta Crystallographica Section E","2005","61","2","m290","m292","10.1107/S1600536805000590","","","0.71073","MoKα","","0.143","0.067","","","0.122","0.147","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205069","14.35","0.004","5.306","0.0009","12.672","0.005","90","","109.96","0.02","90","","906.9","0.5","200","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Lithium hydrogen (RS)-phenylsuccinate","","- C10 H9 Li O4 -","- C10 H9 Li O4 -","- C40 H36 Li4 O16 -","4","1","HB6138","Fischer, Andreas","Lithium hydrogen (<i>RS</i>)-phenylsuccinate","Acta Crystallographica Section E","2005","61","2","m320","m322","10.1107/S1600536805001017","","","0.71073","MoKα","","0.0765","0.05","","","0.1142","0.13","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205070","17.6227","0.0009","11.3661","0.0005","17.1939","0.0007","90","","110.011","0.002","90","","3236","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[bis(μ-4-cyanobenzoato-κ^2^O:O)bis[(4-cyanobenzoato- κ^2^O,O')cobalt(II)]]-di-μ-4,4'-bipyridine-κ^4^N:N'] dihydrate dimethylformamide tetrasolvate]","","- C64 H64 Co2 N12 O14 -","- C64 H64 Co2 N12 O14 -","- C128 H128 Co4 N24 O28 -","2","0.5","HB6139","He, Hong-Yin; Zhu, Long-Guan; Ng, Seik Weng","<i>catena</i>-Poly[[[bis(μ-4-cyanobenzoato-κ^2^<i>O</i>:<i>O</i>)bis[(4-cyanobenzoato-κ^2^<i>O,O</i>')cobalt(II)]]-di-μ-4,4'-bipyridine-κ^4^<i>N</i>:<i>N</i>'] dihydrate dimethylformamide tetrasolvate]","Acta Crystallographica Section E","2005","61","2","m311","m313","10.1107/S1600536805001054","","","0.71073","MoKα","","0.083","0.065","","","0.175","0.188","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205071","13.4146","0.0009","10.2135","0.0008","7.8627","0.0006","90","","95.295","0.005","90","","1072.67","0.14","150","1","150","1","","","","","","","","5","C 1 c 1","C -2yc","9","","Methylchlorosila[1]ferrocenophane","","- C11 H11 Cl Fe Si -","- C11 H11 Cl Fe Si -","- C44 H44 Cl4 Fe4 Si4 -","4","1","HB6140","Chan, Wing Yan; Lough, Alan J.; Manners, Ian","Methylchlorosila[1]ferrocenophane","Acta Crystallographica Section E","2005","61","2","m375","m376","10.1107/S1600536805001352","","","0.71073","MoKα","","0.0478","0.0389","","","0.0909","0.0976","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205072","6.9687","0.0008","11.4468","0.0012","12.687","0.0013","110.396","0.002","100.042","0.002","100.915","0.002","899.1","0.17","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","8-Hydroxyquinolinium hemi(dibromosuccinate) dibromosuccinic acid","","- C30 H26 Br6 N2 O14 -","- C30 H26 Br6 N2 O14 -","- C30 H26 Br6 N2 O14 -","1","0.5","HB6142","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","8-Hydroxyquinolinium‒dibromosuccinate‒dibromosuccinic acid (2/1/2)","Acta Crystallographica Section E","2005","61","2","o402","o404","10.1107/S1600536805001704","","","0.71073","MoKα","","0.093","0.064","","","0.147","0.17","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205073","14.187","0.006","19.218","0.008","8.139","0.004","90","","108.061","0.007","90","","2109.7","1.6","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Ethylenediammonium diaquabis(ethylenediamine-κ^2^N,N')zinc(II) bis(pyridine-2,6-dicarboxylato-κ^3^,O,N,O')zincate(II) dihydrate","","- C34 H46 N10 O20 Zn3 -","- C34 H46 N10 O20 Zn3 -","- C68 H92 N20 O40 Zn6 -","2","0.25","HB6143","Fu, Ai-Yun; Wang, Da-Qi; Sun, De-Zhi","Ethylenediammonium diaquabis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')zinc(II) bis(pyridine-2,6-dicarboxylato-κ^3^,<i>O</i>,<i>N</i>,<i>O</i>')zincate(II) dihydrate","Acta Crystallographica Section E","2005","61","2","m401","m403","10.1107/S1600536805002576","","","0.71073","MoKα","","0.0893","0.0444","","","0.0681","0.0743","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205074","6.997","0.001","14.221","0.003","18.355","0.004","90","","90","","90","","1826.4","0.6","295","2","295","2","","","","","","","","6","P n n m","-P 2 2n","58","","[N,N'-Ethylenebis(salicylideneiminato)]nickel(II) chloroform solvate","","- C17 H15 Cl3 N2 Ni O2 -","- C17 H15 Cl3 N2 Ni O2 -","- C68 H60 Cl12 N8 Ni4 O8 -","4","0.5","HB6145","Cheng, Xiao-Li; Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","[<i>N</i>,<i>N</i>'-Ethylenebis(salicylideneiminato)]nickel(II) chloroform solvate","Acta Crystallographica Section E","2005","61","2","m385","m386","10.1107/S1600536805002187","","","0.71073","MoKα","","0.054","0.046","","","0.141","0.147","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205075","8.9669","0.0006","9.0527","0.0006","16.295","0.001","86.608","0.001","78.84","0.001","86.593","0.001","1293.9","0.15","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Bis[di-2-pyridyl(hydroxy)methanolato-κ^3^O,N,N')]iron(III) tetrafluoroborate trihydrate","","- C22 H24 B F4 Fe N4 O7 -","- C22 H24 B F4 Fe N4 O7 -","- C44 H48 B2 F8 Fe2 N8 O14 -","2","1","HB6146","Onggo, Djulia; Mimin, Aminah; Yamin, Bohari M.; Ng, Seik Weng","Bis[di-2-pyridyl(hydroxy)methanolato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>']iron(III) tetrafluoroborate trihydrate","Acta Crystallographica Section E","2005","61","2","m387","m388","10.1107/S1600536805002369","","","0.71073","MoKα","","0.086","0.067","","","0.161","0.172","","","","","","1.14","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205076","29.1857","0.0011","9.8249","0.0004","12.0285","0.0005","90","","101.902","0.002","90","","3375","0.2","110","2","110","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","p-bromophenylboronic acid","4-bromophenylboronic acid'","","- C6.08 H6.24 B Br O2.04 -","- C6.08 H6.24 B Br O2.04 -","- C97.28 H99.84 B16 Br16 O32.64 -","16","2","HG6113","Bhuvanesh, Nattamai S. P.; Reibenspies, Joseph H.","4-Bromophenylboronic acid ethanol 0.04-solvate","Acta Crystallographica Section E","2005","61","2","o362","o364","10.1107/S1600536804033744","","","1.54178","CuKα","","0.0645","0.0495","","","0.138","0.1487","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205077","8.185","0.002","14.756","0.003","15.092","0.005","90","","121.73","0.02","90","","1550.3","0.8","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Methoxyphenyl)-2-(6-methyl-2-nitro-3-pyridyloxy)propan-1-one","","- C16 H16 N2 O5 -","- C16 H16 N2 O5 -","- C64 H64 N8 O20 -","4","1","HG6119","Vencato, Ivo; Ferri, Pedro H.; Santos, Suzana C.; Pereira, Maristela; Lariucci, Carlito; Homar, Leon I. B.; Napolitano, Hamilton B.","1-(4-Methoxyphenyl)-2-(6-methyl-2-nitro-3-pyridyloxy)propan-1-one","Acta Crystallographica Section E","2005","61","2","o247","o249","10.1107/S1600536804032301","","","0.71073","MoKα","","0.102","0.052","","","0.134","0.162","","","","","","1.04","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205078","4.2065","0.0002","5.1845","0.0002","38.9371","0.0018","90","","91.723","0.002","90","","848.78","0.07","190","","190","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","n-Octanol","","- C8 H18 O -","- C8 H18 O -","- C32 H72 O4 -","4","1","HG6120","Shallard-Brown, Howard A.; Watkin, David J.; Cowley, Andrew R.","<i>n</i>-Octanol","Acta Crystallographica Section E","2005","61","2","o213","o214","10.1107/S1600536804032775","","","0.71073","MoKα","","0.1254","0.1254","","0.1565","0.1565","0.1565","","","","","","0.9944","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205079","19.089","0.003","8.4715","0.0011","23.161","0.003","90","","90.315","0.002","90","","3745.4","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(Benzotriazol-1-yl)-2-(α-hydroxybenzyl)-N-phenylthioacrylamide","","- C21 H16 N4 O S -","- C21 H16 N4 O S -","- C168 H128 N32 O8 S8 -","8","1","HG6121","Liu, Fa-Qian; Li, Wei-Hua; Lu, Lu-De; Yang, Xu-Jie; Wang, Xin; Bao-Rong Hou","2-(Benzotriazol-1-yl)-2-(α-hydroxybenzyl)-<i>N</i>-phenylthioacrylamide","Acta Crystallographica Section E","2005","61","2","o208","o209","10.1107/S1600536804033768","","","0.71073","MoKα","","0.0772","0.0395","","","0.107","0.1208","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205080","9.463","0.0017","12.879","0.002","16.44","0.003","90","","105.802","0.003","90","","1927.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(1-phenyl-1H-tetrazol-5-ylsulfanyl)butane","","- C18 H18 N8 S2 -","- C18 H18 N8 S2 -","- C72 H72 N32 S8 -","4","1","HG6123","Wang, Wei; Liu, Hui-Min; Zhang, Wen-Qin","1,4-Bis(1-phenyl-1<i>H</i>-tetrazol-5-ylsulfanyl)butane","Acta Crystallographica Section E","2005","61","2","o206","o207","10.1107/S1600536804033756","","","0.71073","MoKα","","0.0575","0.0377","","","0.0955","0.1086","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205081","13.68","0.009","6.916","0.005","19.968","0.014","90","","108.292","0.011","90","","1794","2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H21 N3 O3 -","- C19 H21 N3 O3 -","- C76 H84 N12 O12 -","4","1","HG6125","Zhang, Xin-Li; Li, Zong-Xiao","4-[(4-Hydroxybenzylidene)amino]-1,5-dimethyl-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-3-one methanol solvate","Acta Crystallographica Section E","2005","61","2","o266","o268","10.1107/S1600536804034324","","","0.71073","MoKα","","0.1228","0.0484","","","0.1102","0.1418","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205082","3.9117","0.0009","17.232","0.004","13.686","0.003","90","","97.116","0.004","90","","915.4","0.4","273","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-Amino-1H-3,1-benzothiazine-2,4-dithione","","- C8 H6 N2 S3 -","- C8 H6 N2 S3 -","- C32 H24 N8 S12 -","4","1","HG6127","Yu, Yun; Zhong, Hui-Ping; Yang, Kai-Bin; Huang, Rong-Bin; Zheng, Lan-Sun","7-Amino-1<i>H</i>-3,1-benzothiazine-2,4-dithione","Acta Crystallographica Section E","2005","61","2","o387","o388","10.1107/S1600536805000772","","","0.71073","MoKα","","0.0665","0.0589","","","0.1547","0.1602","","","","","","1.136","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205083","5.841","0.0005","13.363","0.0011","15.325","0.0017","90","","90","","90","","1196.17","0.19","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","4-Chlorophenyl thiobenzoate","4-Chlorophenyl thiobenzoate","","- C13 H9 Cl O S -","- C13 H9 Cl O S -","- C52 H36 Cl4 O4 S4 -","4","1","HG6128","T. Bhupathi Ganesh; A. Dhakshinamoorthy; K. Pitchumani; S. Athimoolam; B. Sridhar; R. K. Rajaram","4-Chlorophenyl thiobenzoate","Acta Crystallographica Section E","2005","61","2","o340","o342","10.1107/S1600536805000966","","","0.71073","MoKα","","0.0714","0.0371","","","0.0853","0.0964","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205084","9.4446","0.0001","12.4158","0.0001","15.0802","0.0002","72.645","0.001","78.207","0.001","77.39","0.001","1628.61","0.03","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","1,1,3,3-Tetraphenyl-1,2,3-triphosphenium tetrachloroaluminate dichloromethane solvate","","- C28 H28 Al Cl6 P3 -","- C28 H28 Al Cl6 P3 -","- C56 H56 Al2 Cl12 P6 -","2","1","HG6130","Deng, Robert M. K.; Dillon, Keith B.; Goeta, Andrés E.; Thompson, Amber L.","1,1,3,3-Tetraphenyl-1,2,3-triphosphenium tetrachloroaluminate dichloromethane solvate","Acta Crystallographica Section E","2005","61","2","m296","m298","10.1107/S1600536805000656","","","0.71073","MoKα","","0.0323","0.0288","","","0.0727","0.0753","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205085","24.002","0.004","10.9833","0.0017","24.364","0.003","90","","90","","90","","6422.9","1.7","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Sildenafil citrate monohydrate","1-{[3-(6,7-Dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-5-yl)- 4-ethoxyphenyl]sulfonyl}-4-methylpiperazinium citrate monohydrate","","- C28 H40 N6 O12 S -","- C28 H40 N6 O12 S -","- C224 H320 N48 O96 S8 -","8","1","HG6131","Yathirajan, Hemmige S.; Basavegowda, Nagaraj; Nagaraja, Padmarajaiah; Bolte, Michael","Sildenafil citrate monohydrate","Acta Crystallographica Section E","2005","61","2","o489","o491","10.1107/S1600536805002564","","","0.71073","MoKα","","0.1743","0.0785","","","0.1364","0.1543","","","","","","0.782","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205086","22.759","0.004","5.5729","0.0009","8.3902","0.0014","90","","90.929","0.002","90","","1064","0.3","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","1-(4-Hydroxyphenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C11 H11 N3 O2 -","- C11 H11 N3 O2 -","- C44 H44 N12 O8 -","4","1","HG6135","Fa-Qian Liu; Wei-Hua Li; Hai-Bin Song; Lu-De Lu; Xu-Jie Yang; Xin Wang","1-(4-Hydroxyphenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","2","o400","o401","10.1107/S1600536805001169","","","0.71073","MoKα","","0.0415","0.0296","","","0.071","0.0761","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205087","7.298","0.001","7.298","0.001","16.56","0.003","90","","90","","120","","763.8","0.2","123","2","123","","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","1,4,7-triazacyclononane hemihydrate","","- C6 H16 N3 O0.5 -","- C6 H16 N3 O0.5 -","- C24 H64 N12 O2 -","4","0.333333","IS6022","Battle, Andrew R.; Johnson, Daniel L.; Martin, Lisandra L.","1,4,7-Triazacyclononane hemihydrate","Acta Crystallographica Section E","2005","61","2","o330","o332","10.1107/S1600536805000814","","","0.71073","MoKα","","","0.0485","","","","0.1398","","","","","","1.118","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2205088","4.473","0.001","14.772","0.005","18.263","0.002","79.38","0.02","88.78","0.01","86.33","0.02","1183.6","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-[(4-Hydroxy-3-methoxyphenyl)methylenehydrazinocarbonyl]-(1H)-1,2,4-Triazole","","- C11 H11 N5 O3 -","- C11 H11 N5 O3 -","- C44 H44 N20 O12 -","4","2","IS6028","Fu-You Pan; Jian-Guo Yang","3-[<i>N</i>'-(4-Hydroxy-3-methoxybenzylidene)hydrazinocarbonyl]-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","2","o503","o505","10.1107/S1600536804034269","","","0.71073","MoKα","","0.1089","0.0432","","","0.1108","0.1401","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205089","14.3741","0.0004","14.1573","0.0004","17.9269","0.0005","90","","91.328","0.001","90","","3647.12","0.18","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraaquatetra(dimethylacetamide-κO)neodymium(III) hexacyanoferrate(III) trihydrate","","- C22 H50 Fe N10 Nd O11 -","- C22 H50 Fe N10 Nd O11 -","- C88 H200 Fe4 N40 Nd4 O44 -","4","1","IS6031","Overgaard, Jacob; Svendsen, Helle; Chevalier, Marie A.; Iversen, Bo B.","Tetraaquatetrakis(dimethylacetamide-κ<i>O</i>)neodymium(III) hexacyanoferrate(III) trihydrate","Acta Crystallographica Section E","2005","61","2","m268","m270","10.1107/S1600536805000577","","","0.71073","MoKα","","0.0374","0.0243","","","0.0646","0.0679","","","","","","1.074","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205090","14.896","0.003","5.968","0.0011","18.894","0.004","90","","95.752","0.004","90","","1671.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-tert-Butyl-3-(α-Hydroxy-4-isopropylbenzylidene)pyrrolidine-2,4-dione","","- C18 H23 N O3 -","- C18 H23 N O3 -","- C72 H92 N4 O12 -","4","1","IS6032","Hai-Zhen Xu; Xin Zhang; Xiao-Jun Zhao; Gui-Sheng Yu","1-<i>tert</i>-Butyl-3-(α-hydroxy-4-isopropylbenzylidene)pyrrolidine-2,4-dione","Acta Crystallographica Section E","2005","61","2","o292","o294","10.1107/S1600536805000589","","","0.71073","MoKα","","0.1166","0.0609","","","0.1652","0.2068","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205091","16.884","0.003","5.873","0.002","13.135","0.003","90","","108.38","0.01","90","","1236","0.6","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N'-(2-Chlorobenzylidene)-2-hydroxybenzohydrazide","","- C14 H11 Cl N2 O2 -","- C14 H11 Cl N2 O2 -","- C56 H44 Cl4 N8 O8 -","4","1","IS6033","Fu-You Pan; Jian-Guo Yang","<i>N</i>'-(2-Chlorobenzylidene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2005","61","2","o354","o355","10.1107/S1600536805000735","","","0.71073","MoKα","","0.1862","0.0438","","","0.1002","0.1401","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205092","9.5485","0.0016","8.2197","0.0013","25.94","0.004","90","","90","","90","","2035.9","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","2-Acetyl-3'-chloroacetanilide","N-(3-chlorophenyl)-3-oxobutanamide","","- C10 H10 Cl N O2 -","- C10 H10 Cl N O2 -","- C80 H80 Cl8 N8 O16 -","8","1","IS6034","Tai, Xi-Shi; Liu, Wan-Yi; Liu, Yan-Zhen; Li, Yi-Zhi","2-Acetyl-3'-chloroacetanilide","Acta Crystallographica Section E","2005","61","2","o389","o390","10.1107/S1600536805001145","","","0.71073","MoKα","","0.0844","0.0413","","","0.0678","0.0748","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205093","8.3294","0.0006","22.4059","0.0016","14.5461","0.0011","90","","102.241","0.001","90","","2653","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-Bipyridinium‒5-nitroisophthalate‒5-nitroisophthalic acid‒water (1/1/1/2)","","- C26 H22 N4 O14 -","- C26 H22 N4 O14 -","- C104 H88 N16 O56 -","4","1","IS6035","Di-Mei Chen; Xin-Hua Li; Hong-Ping Xiao; Mao-Lin Hu","2,2'-Bipyridinium 5-nitroisophthalate 5-nitroisophthalic acid dihydrate","Acta Crystallographica Section E","2005","61","2","o317","o319","10.1107/S1600536805000759","","","0.71073","MoKα","","0.0844","0.0732","","","0.1511","0.1569","","","","","","1.228","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205095","9.8406","0.0006","10.1729","0.0006","15.2354","0.0009","73.5009","0.0013","84.7304","0.0014","80.783","0.0013","1441.76","0.15","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(2,2'-bipyridine)(3-carboxylato-4-hydroxybenzenesulfonato)manganese(II) dihydrate","","- C27 H26 Mn N4 O9 S -","- C27 H26 Mn N4 O9 S -","- C54 H52 Mn2 N8 O18 S2 -","2","1","IS6038","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping; Ng, Seik Weng","Aquabis(2,2'-bipyridine)(3-carboxylato-4-hydroxybenzenesulfonato)manganese(II) dihydrate","Acta Crystallographica Section E","2005","61","2","m377","m378","10.1107/S1600536805002321","","","0.71073","MoKα","","0.059","0.048","","","0.119","0.125","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205096","9.3627","0.0012","9.61","0.0013","11.7698","0.0015","87.956","0.003","72.496","0.002","79.561","0.002","993","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Tetramethylpyrazinium‒trichloroacetate‒trichloroacetic acid (1/1/1)","","- C12 H14 Cl6 N2 O4 -","- C12 H14 Cl6 N2 O4 -","- C24 H28 Cl12 N4 O8 -","2","1","IS6039","Di-Mei Chen; Feng-Yi Xia; Mao-Lin Hu; Li Li; Zhi-Min Jin","2,3,5,6-Tetramethylpyrazinium‒trichloroacetate‒trichloroacetic acid (1/1/1)","Acta Crystallographica Section E","2005","61","2","o419","o420","10.1107/S1600536805001741","","","0.71073","MoKα","","0.0719","0.0631","","","0.1769","0.1853","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205097","9.9505","0.0014","11.1049","0.0014","12.1187","0.0014","74.621","0.002","66.75","0.002","89.352","0.002","1179.7","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","μ-Terephthalato-bis[bis(2,2'-bipyridine)copper(II)] diperchlorate dihydrate","","- C48 H40 Cl2 Cu2 N8 O14 -","- C48 H40 Cl2 Cu2 N8 O14 -","- C48 H40 Cl2 Cu2 N8 O14 -","1","0.5","IS6040","Sai-Zhen Yang; Xin-Hua Li","μ-Terephthalato-bis[bis(2,2'-bipyridine)copper(II)] bis(perchlorate) dihydrate","Acta Crystallographica Section E","2005","61","2","m356","m357","10.1107/S1600536805001753","","","0.71073","MoKα","","0.0496","0.0448","","","0.1193","0.1233","","","","","","1.049","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2205098","4.7477","0.0005","5.568","0.0011","44.455","0.005","87.619","0.013","87.92","0.009","77.733","0.011","1146.9","0.3","296","1","","","","","","","","","","3","P -1","-P 1","2","","Henicosane-1,21-dithiol","","- C21 H44 S2 -","- C21 H44 S2 -","- C42 H88 S4 -","2","1","IS6041","Naotake Nakamura; Hirotaka Shimizu; Yoshihiro Ogawa","Henicosane-1,21-dithiol","Acta Crystallographica Section E","2005","61","2","o450","o452","10.1107/S1600536805002400","","","1.5418","CuKα","","","0.056","","","","0.123","","","","","","1.001","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205099","19.9073","0.0015","10.2232","0.0005","11.0723","0.0007","90","","104.705","0.002","90","","2179.6","0.2","295","3","295","3","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(4-hydroxybenzoato-κ^2^O,O')(1,10-phenanthroline-κ^2^N,N')copper(II)","","- C26 H18 Cu N2 O6 -","- C26 H18 Cu N2 O6 -","- C104 H72 Cu4 N8 O24 -","4","0.5","IS6042","Jian-Rong Su; Jian-Ming Gu; Duan-Jun Xu","Bis(4-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section E","2005","61","2","m379","m381","10.1107/S1600536805002333","","","0.71073","MoKα","","0.049","0.039","","","0.104","0.109","","","","","","0.988","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205100","11.33","0.002","6.9142","0.0013","17.913","0.003","90","","107.145","0.003","90","","1340.9","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","4,5,9,14-Tetramethyl-19-norcholest-24-en-3-one","4,5,9,14-Tetramethyl-19-norcholest-24-en-3-one","","- C30 H50 O -","- C30 H50 O -","- C60 H100 O2 -","2","1","KP6020","Liu, Ke-Yue; Gao, Wen-Yuan; Zhang, Tie-Jun; Chen, Hai-Xia; Surname, Zhou-Bin","4,5,9,14-Tetramethyl-19-norcholest-24-en-3-one","Acta Crystallographica Section E","2005","61","2","o391","o392","10.1107/S1600536805000875","","","0.71073","MoKα","","0.091","0.0482","","","0.1131","0.1366","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205101","13.02","0.006","6.608","0.003","15.119","0.007","90","","113.109","0.007","90","","1196.4","1","293","2","566","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","6-fluoro-3-(4-piperidinio)benz[d]isoxazole chloride","","- C12 H14 Cl F N2 O -","- C12 H14 Cl F N2 O -","- C48 H56 Cl4 F4 N8 O4 -","4","1","KP6027","Yathirajan, H. S.; Narasimhamurthy, T.; Nagaraj, B.; Nagaraja, P.; Narasegowda, R. S.; Rathore, Ravindranath S.","N—H^+^···Cl^{-^} and C—H···O interactions in 6-fluoro-3-(4-piperidinio)benz[<i>d</i>]isoxazole chloride","Acta Crystallographica Section E","2005","61","2","o356","o358","10.1107/S1600536805000899","","","0.71073","MoKα","","0.0472","0.0422","","","0.1116","0.1155","","","","","","1.096","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205102","10.247","0.002","12.387","0.003","21.858","0.002","90","","90.59","0.01","90","","2774.3","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Benzoylacetone 4-methoxybenzoylhydrazonato-κ^3^O,N,O')(N- benzoylhydroxylaminato-κ^2^O,O')oxovanadium(IV)","","- C31 H26 N3 O6 V -","- C31 H26 N3 O6 V -","- C124 H104 N12 O24 V4 -","4","1","KP6031","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","(Benzoylacetone 4-methoxybenzoylhydrazonato-κ^3^<i>O,N,O</i>')(<i>N</i>-benzoylhydroxylaminato-κ^2^<i>O,O</i>')oxovanadium(IV)","Acta Crystallographica Section E","2005","61","2","m325","m326","10.1107/S1600536805000929","","","0.71073","MoKα","","0.047","0.036","","","0.105","0.11","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2205103","17.2129","0.0009","13.501","0.0007","11.3932","0.0006","90","","103.979","0.001","90","","2569.3","0.2","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(5-bromo-N-cyclohexylsalicylideneaminato-κ^2^N,O)nickel(II)","","- C26 H30 Br2 N2 Ni O2 -","- C26 H30 Br2 N2 Ni O2 -","- C104 H120 Br8 N8 Ni4 O8 -","4","0.5","KP6032","Sun, Yu-Xi; Ng, Seik Weng","Bis(5-bromo-<i>N</i>-cyclohexylsalicylideneaminato-κ^2^<i>N,O</i>)nickel(II)","Acta Crystallographica Section E","2005","61","2","m323","m324","10.1107/S1600536805000930","","","0.71073","MoKα","","0.044","0.033","","","0.084","0.091","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205104","11.663","0.002","11.695","0.002","18.348","0.004","90","","105.38","0.03","90","","2413","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(Z)-2,3-Bis(2-phenylindozin-3-yl)-2-butenedinitrile","","- C32 H20 N4 -","- C32 H20 N4 -","- C128 H80 N16 -","4","1","KP6033","Liu, Wei-Wei; Li, Yi-Zhi; Sun, Run-Kun; Hu, Hong-Wen; Wu, Qiang-Jin; Huang, Zi-Xiang","(<i>Z</i>)-2,3-Bis(2-phenylindolizin-3-yl)-2-butenedinitrile","Acta Crystallographica Section E","2005","61","2","o445","o447","10.1107/S1600536805001820","","","0.71073","MoKα","","0.1049","0.0648","","","0.1265","0.1371","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205105","10.433","0.001","7.458","0.001","7.238","0.001","90","","113.3","0.02","90","","517.25","0.14","14","","14","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","1,3,5-triazine-2,4,6-triamine","","- C3 H6 N6 -","- C3 H6 N6 -","- C12 H24 N24 -","4","1","LH6307","Cousson, A.; Nicolaï, B.; Fillaux, F.","Melamine (1,3,5-triazine-2,4,6-triamine): a neutron diffraction study at 14K","Acta Crystallographica Section E","2005","61","2","o222","o224","10.1107/S160053680403332X","","neutron","0.831","neutron","","0.0557","0.0467","","0.0438","0.0434","0.0434","","","","","","1.1111","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205106","18.7","0.003","19.717","0.004","15.728","0.003","90","","114.45","0.01","90","","5279","1.7","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Aqua{2-[(E)-3,5-dibromo-2-oxidobenzylideneamino]ethanesulfonato}(1,10- phenanthroline)zinc(II) ethanol solvate","","- C23 H23 Br2 N3 O6 S Zn -","- C23 H23 Br2 N3 O6 S Zn -","- C184 H184 Br16 N24 O48 S8 Zn8 -","8","1","LH6315","Shu-Hua Zhang; Yi-Min Jiang; Kai-Bei Yu","Aqua{2-[(<i>E</i>)-3,5-dibromo-2-oxidobenzylideneamino]ethanesulfonato}(1,10-phenanthroline)zinc(II) ethanol solvate","Acta Crystallographica Section E","2005","61","2","m209","m211","10.1107/S1600536804033562","","","0.71073","MoKα","","0.0865","0.034","","","0.0572","0.0623","","","","","","0.825","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205107","9.826","0.003","8.235","0.002","16.073","0.005","90","","95.857","0.005","90","","1293.8","0.6","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Mercury dibromide bis-oxypyridine","(2,2'-Bipyridine N,N'-dioxide-κ^2^O,O')dibromo-mercury(II)","","- C10 H8 Br2 Hg N2 O2 -","- C10 H8 Br2 Hg N2 O2 -","- C40 H32 Br8 Hg4 N8 O8 -","4","1","LH6337","Tedmann, Onyango M.; Zavalij, Peter Y.; Madan, Stanley K.; Oliver, Scott R.J.","(2,2'-Bipyridine <i>N</i>,<i>N</i>'-dioxide-κ^2^<i>O</i>,<i>O</i>')dibromomercury(II)","Acta Crystallographica Section E","2005","61","2","m212","m213","10.1107/S1600536804033690","","","0.71073","MoKα","","0.0669","0.0418","","","0.0991","0.1128","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205108","9.433","0.004","15.69","0.007","10.024","0.005","90","","108.998","0.006","90","","1402.8","1.1","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Mercury diiodide bis-oxypyridine","(2,2'-Bypiridine N,N'-dioxide-κ^2^O,O')diiodinemercury(II)","","- C10 H8 Hg I2 N2 O2 -","- C10 H8 Hg I2 N2 O2 -","- C40 H32 Hg4 I8 N8 O8 -","4","1","LH6338","Tedmann, Onyango M.; Zavalij, Peter Y.; Madan, Stanley K.; Oliver, Scott R.J.","(2,2'-Bipyridine <i>N</i>,<i>N</i>'-dioxide-κ^2^<i>O</i>,<i>O</i>')diiodomercury(II)","Acta Crystallographica Section E","2005","61","2","m214","m216","10.1107/S1600536804033707","","","0.71073","MoKα","","0.1003","0.0541","","","0.0606","0.0686","","","","","","0.86","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205109","27.612","0.0002","7.947","0.0003","5.977","0.001","90","","90","","90","","1311.5","0.2","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","p-methylphenyl p-toluenesulfonate","4-methylphenyl 4-toluenesulfonate","","- C14 H14 O3 S -","- C14 H14 O3 S -","- C56 H56 O12 S4 -","4","1","LH6339","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Fronczek, Frank R.","4-Methylphenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions","Acta Crystallographica Section E","2005","61","2","o242","o244","10.1107/S1600536804033343","","","0.71073","MoKα","","0.0744","0.0389","","","0.0779","0.0833","","","","","","0.852","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205110","5.36","0.009","8.697","0.014","27.46","0.05","90","","90.17","0.03","90","","1280","4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-3-hydroxy-1-phenylpropan-1-one","","- C15 H13 Cl O2 -","- C15 H13 Cl O2 -","- C60 H52 Cl4 O8 -","4","1","LH6340","Yu, Zhifang; Gu, Xiuyan; Zhao, Bing; Tian, Zhongzhen","3-(4-Chlorophenyl)-3-hydroxy-1-phenylpropan-1-one","Acta Crystallographica Section E","2005","61","2","o225","o226","10.1107/S1600536804033719","","","0.71073","MoKα","","0.0776","0.0453","","","0.1371","0.1668","","","","","","1.065","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205111","24.321","0.003","5.0468","0.0005","8.6066","0.0008","90","","90","","90","","1056.4","0.19","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","3-(p-Nitrobenzyl)-1,3-thiazolidine-2,4-dione","","- C10 H8 N2 O4 S -","- C10 H8 N2 O4 S -","- C40 H32 N8 O16 S4 -","4","1","LH6342","Yathirajan, Hemmige S.; Rai, Kuriya M. Lokanatha; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Prabhuswamy, Basappa; Bolte, Michael","3-(<i>p</i>-Nitrobenzyl)-1,3-thiazolidine-2,4-dione","Acta Crystallographica Section E","2005","61","2","o245","o246","10.1107/S1600536804033951","","","0.71073","MoKα","","0.0514","0.0483","","","0.1212","0.1235","","","","","","1.018","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205112","19.4607","0.001","10.5889","0.0015","9.0394","0.0012","90","","99.948","0.008","90","","1834.7","0.4","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Decylphenyl)pyridin-4(1H)-one","","- C21 H29 N O -","- C21 H29 N O -","- C84 H116 N4 O4 -","4","1","LH6343","Li, Chenguang; Wolf, Jeremy R.; Dyer, Daniel J.; Robinson, Paul D.","1-(4-Decylphenyl)pyridin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","2","o233","o235","10.1107/S1600536804033963","","","0.71069","MoKα","","0.127","0.038","","","0.098","0.129","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205113","15.83","0.001","9.785","0.0008","30.02","0.002","90","","96.533","0.002","90","","4619.8","0.6","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[μ-3,5-bis(2-pyridyl)-4-(4-isopropylphenyl)-4H-1,2,4-triazole[disilver(I) diperchlorate acetonitrile solvate","","- C44 H41 Ag2 Cl2 N11 O8 -","- C44 H41 Ag2 Cl2 N11 O8 -","- C176 H164 Ag8 Cl8 N44 O32 -","4","0.5","LH6344","You, Zhong-Lu; Shao, Si-Chang; Zhang, Shu-Ping; Zhu, Hai-Liang; Ng, Seik Weng","Bis[μ-3,5-bis(2-pyridyl)-4-(4-isopropylphenyl)-4<i>H</i>-1,2,4-triazole]disilver(I) diperchlorate acetonitrile solvate","Acta Crystallographica Section E","2005","61","2","m265","m267","10.1107/S1600536805000243","","","0.71073","MoKα","","0.096","0.053","","","0.122","0.15","","","","","","0.996","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205114","9.695","0.002","17.266","0.004","23.543","0.004","90","","90","","90","","3941","1.4","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","β-Methyl-γ-bis(N,O-8-quinolinoxy)germa-γ-lactone","","- C22 H18 Ge N2 O4 -","- C22 H18 Ge N2 O4 -","- C176 H144 Ge8 N16 O32 -","8","1","LH6346","Mahboob, Sumera; Parvez, Masood; Mazhar, Muhammad; Ali, Saqib","β-Methyl-γ,γ-bis(8-quinolinoxy)germa-γ-lactone","Acta Crystallographica Section E","2005","61","2","m358","m360","10.1107/S1600536805001455","","","0.71073","MoKα","","0.066","0.04","","","0.093","0.107","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205115","12.0013","0.0011","11.1465","0.0011","5.2327","0.0004","90","","90","","90","","699.99","0.11","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","7-Methyl-1H-indazole","","- C8 H8 N2 -","- C8 H8 N2 -","- C32 H32 N8 -","4","1","LH6347","Foces-Foces, C.","Hydrogen-bonded networks in 1<i>H</i>-indazoles: the case of 7-methyl-1<i>H</i>-indazole","Acta Crystallographica Section E","2005","61","2","o337","o339","10.1107/S160053680500070X","","","1.5418","CuKα","","0.044","0.0389","","","0.1098","0.1154","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205116","7.195","0.001","8.629","0.002","11.522","0.002","90","","97.59","0.03","90","","709.1","0.2","163","2","163","2","","","","","","","","5","P 1 21 1","P 2yb","4","hemiprotonated 1-methylcytosine","1-Methylcytosinium iodide 1-methylcytosine","","- C10 H15 I N6 O2 -","- C10 H15 I N6 O2 -","- C20 H30 I2 N12 O4 -","2","1","LH6348","Jens Müller; Eva Freisinger","[(1-Methylcytosine)~2~H]I, an asymmetric base pair","Acta Crystallographica Section E","2005","61","2","o320","o322","10.1107/S1600536805000693","","","0.71069","MoKα","","0.0247","0.0204","","","0.0421","0.0429","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205117","3.722","0.001","6.263","0.003","26.506","0.009","90","","94.41","0.02","90","","616","0.4","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H10 N4 O2 -","- C16 H10 N4 O2 -","- C32 H20 N8 O4 -","2","0.5","LH6349","Mizuguchi, Jin; Imoda, Tomohiko; Takahashi, Hiroo","3,6-Di-4-pyridylpyrrolo[3,4-<i>c</i>]pyrrole-1,4(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","2","o500","o502","10.1107/S1600536805002114","","","1.5419","CuKα","","","0.241","","","","0.5649","","","","","","1.778","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205118","9.5311","0.0008","12.5662","0.001","14.9862","0.0012","90","","103.774","0.007","90","","1743.3","0.3","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N,N'-(o-Phenylene)dibenzenesulfonamide","N,N'-(o-Phenylene)dibenzenesulfonamide","","- C18 H16 N2 O4 S2 -","- C18 H16 N2 O4 S2 -","- C72 H64 N8 O16 S8 -","4","1","LH6351","Bryan, Jeffrey C.; Rosenberg, Jay M.; Kavallieratos, Konstantinos","<i>N</i>,<i>N</i>'-(<i>o</i>-Phenylene)dibenzenesulfonamide","Acta Crystallographica Section E","2005","61","2","o396","o397","10.1107/S1600536805001133","","","0.71073","MoKα","","0.047","0.033","","","0.084","0.09","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205119","7.7129","0.0004","11.5063","0.0006","13.3854","0.0007","82.614","0.001","83.165","0.001","72.724","0.001","1120.8","0.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[bis[aqua(1,10-phenanthroline-κ^2^N,N')cobalt(II)]- di-μ-4,4'-oxydibenzoato-1:2κ^4^O:O']","","- C52 H36 Co2 N4 O12 -","- C52 H36 Co2 N4 O12 -","- C52 H36 Co2 N4 O12 -","1","0.5","LH6352","Xiao, Hong-Ping; Li, Xin-Hua; Ng, Seik Weng","<i>catena</i>-Poly[bis[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-di-μ-4,4'-oxydibenzoato-1:2κ^4^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","2","m344","m345","10.1107/S1600536805001558","","","0.71073","MoKα","","0.037","0.034","","","0.09","0.092","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205120","7.1227","0.0001","7.7284","0.0001","11.4138","0.0001","90","","90","","90","","628.296","0.013","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Lithium Chloride Dioxane","poly[μ~2~-chloro-μ~2~-dioxane-κ^2^O:O'-lithium(I)]","","- C4 H8 Cl Li O2 -","- C4 H8 Cl Li O2 -","- C16 H32 Cl4 Li4 O8 -","4","1","LH6353","Morris, J. Jacob; Noll, Bruce C.; Henderson, Kenneth W.","A redetermination of lithium chloride dioxane","Acta Crystallographica Section E","2005","61","2","m351","m353","10.1107/S1600536805001716","","","0.71073","MoKα","","0.0177","0.017","","","0.0452","0.0454","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205121","8.033","0.004","10.55","0.007","14.662","0.009","97.75","0.07","97.87","0.04","103.97","0.05","1176.1","1.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","trans-4-[(4-Dimethylaminophenyl)ethenyl]-N-methylquinolinium p-toluenesulfonate monohydrate","","- C27 H30 N2 O4 S -","- C27 H30 N2 O4 S -","- C54 H60 N4 O8 S2 -","2","1","LH6354","Coe, Benjamin J.; Hall, Jonathan J.; Harris, James A.; Brunschwig, B. S.; Coles, Simon J.; Hursthouse, Michael B.","<i>trans</i>-4-[(4-Dimethylaminophenyl)ethenyl]-<i>N</i>-methylquinolinium <i>p</i>-toluenesulfonate monohydrate","Acta Crystallographica Section E","2005","61","2","o464","o467","10.1107/S1600536805002138","","","0.71073","MoKα","","0.0637","0.045","","","0.1126","0.1258","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205122","19.805","0.003","7.988","0.002","7.369","0.002","90","","98.18","0.02","90","","1153.9","0.5","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2-Nitrophenylsulfonyl)glycine methyl ester","","- C9 H10 N2 O6 S -","- C9 H10 N2 O6 S -","- C36 H40 N8 O24 S4 -","4","1","NC6016","Laurent F. Bornaghi; Sally-Ann Poulsen; Peter C. Healy; Alan R. White","<i>N</i>-(2-Nitrophenylsulfonyl)glycine methyl ester","Acta Crystallographica Section E","2005","61","2","o323","o325","10.1107/S1600536805000784","","","0.7107","MoKα","","0.075","0.0496","","","0.1504","0.2061","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205123","5.8182","0.0005","9.5061","0.0007","15.461","0.001","90","","93.89","0.006","90","","853.15","0.11","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Cyano-3-(4-hydroxyphenyl)acrylic acid","","- C10 H7 N O3 -","- C10 H7 N O3 -","- C40 H28 N4 O12 -","4","1","NC6017","Karas, Michael; Fournier, Isabelle; Bolte, Michael","2-Cyano-3-(4-hydroxyphenyl)acrylic acid","Acta Crystallographica Section E","2005","61","2","o383","o384","10.1107/S1600536805001480","","","0.71073","MoKα","","0.0362","0.0325","","","0.09","0.093","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205124","14.692","0.002","14.692","0.002","8.0106","0.0013","90","","90","","90","","1729.1","0.4","173","2","173","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","2-(5-Ethylpyridin-2-yl)ethanol","","- C9 H13 N O -","- C9 H13 N O -","- C72 H104 N8 O8 -","8","1","NC6018","Yathirajan, Hemmige S.; Gaonkar, Santhosh L.; Bolte, Michael","2-(5-Ethylpyridin-2-yl)ethanol","Acta Crystallographica Section E","2005","61","2","o492","o493","10.1107/S1600536805001947","","","0.71073","MoKα","","0.0348","0.0284","","","0.0685","0.07","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205125","16.778","0.002","7.4093","0.0007","9.8472","0.0011","90","","106.097","0.009","90","","1176.1","0.2","173","2","173","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Phosphenium bromide","","- C12 H12 Br P -","- C12 H12 Br P -","- C48 H48 Br4 P4 -","4","0.5","NC6019","Dornhaus, Franz; Lerner, Hans-Wolfram; Bolte, Michael","Diphenylphosphenium bromide","Acta Crystallographica Section E","2005","61","2","o448","o449","10.1107/S1600536805002151","","","0.71073","MoKα","","0.0426","0.0406","","","0.0948","0.0961","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205126","11.0428","0.0012","18.507","0.002","10.1462","0.0011","90","","104.547","0.009","90","","2007.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1'-(1-Hydroxyethyl)-N,N-diphenylferrocene-1-carboxamide","","- C25 H23 Fe N O2 -","- C25 H23 Fe N O2 -","- C100 H92 Fe4 N4 O8 -","4","1","NG6077","Cetina, Mario; Đaković, Senka; Hergold-Brundić, Antonija; Rapić, Vladimir","1'-(1-Hydroxyethyl)-<i>N,N</i>-diphenylferrocene-1-carboxamide","Acta Crystallographica Section E","2005","61","2","m307","m310","10.1107/S1600536804033379","","","0.71073","MoKα","","0.0785","0.0663","","","0.1595","0.1687","","","","","","1.168","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205127","12.513","0.003","15.918","0.003","12.122","0.002","90","","115.32","0.03","90","","2182.5","0.9","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H52 Cu2 N8 O12 -","- C40 H52 Cu2 N8 O12 -","- C80 H104 Cu4 N16 O24 -","2","0.5","NG6080","Jin Yang; Li Li; Jian-Fang Ma; Ying-Ying Liu","A dinuclear copper complex with a <i>p</i>-aminobenzoate anion","Acta Crystallographica Section E","2005","61","2","m237","m239","10.1107/S1600536804034336","","","0.71073","MoKα","","0.0483","0.0299","","","0.0743","0.0896","","","","","","0.957","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2205128","5.5677","0.0011","6.3662","0.0013","11.62","0.002","102.11","0.03","95.59","0.03","106.68","0.03","380.26","0.16","296","2","296","2","","","","","","","","4","P -1","-P 1","2","Hexaaquamagnesium(II) benzene-1,4-dioxyacetate","Hexaaquamagnesium(II) p-phenylenebis(oxyacetate)","","- C10 H20 Mg O12 -","- C10 H20 Mg O12 -","- C10 H20 Mg O12 -","1","0.5","NG6081","Yang, Qian; Gao, Shan; Huo, Li-Hua","Hexaaquamagnesium(II) benzene-1,4-dioxyacetate","Acta Crystallographica Section E","2005","61","2","m277","m278","10.1107/S1600536805000498","","","0.71073","MoKα","","0.0529","0.0458","","","0.1204","0.122","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205129","8.4342","0.0018","9.391","0.002","10.36","0.002","79.941","0.003","71.597","0.003","89.332","0.003","765.8","0.3","183","2","183","2","","","","","","","","4","P -1","-P 1","2","Ethyl 2-aceto-3-tryptamino-2-propenoate","Ethyl 2-acetyl-3-[2-(1H-indol-3-yl)ethylamino]propenoate","","- C17 H20 N2 O3 -","- C17 H20 N2 O3 -","- C34 H40 N4 O6 -","2","1","OB6457","Fan, Ning-Juan; Li, Dong-Hong; Jiang, Xiao-Ming; Zhang, Yong-Bin; Guo, Wei; Xia, Chi-Zhong","Ethyl 2-acetyl-3-[2-(1<i>H</i>-indol-3-yl)ethylamino]propenoate","Acta Crystallographica Section E","2005","61","2","o373","o374","10.1107/S1600536805001261","","","0.71073","MoKα","","0.0531","0.0429","","","0.1054","0.1108","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205130","8.2523","0.0007","19.6807","0.0016","10.2857","0.0008","90","","105.388","0.001","90","","1610.6","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Acetamido-N-(2-chlorophenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide","","- C17 H17 Cl N2 O2 S -","- C17 H17 Cl N2 O2 S -","- C68 H68 Cl4 N8 O8 S4 -","4","1","OB6458","Chandra Kumar, K.; Kokila, M. K.; Puttaraja; Mohan, S.; Manjunath Shetty, K. S.; Kulkarni, Manohar V.","2-Acetamido-<i>N</i>-(2-chlorophenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","2","o304","o306","10.1107/S1600536805000103","","","0.71073","MoKα","","0.0484","0.043","","","0.1217","0.1273","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205131","15.3802","0.0006","5.4473","0.0002","18.0635","0.0008","90","","90","","90","","1513.37","0.11","120","","120","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R,4R,5S)-5-(Acetamidomethyl)-N-benzyl-3,4-dihydroxytetrahydrofuran- 3-carboxamide","","- C15 H20 N2 O5 -","- C15 H20 N2 O5 -","- C60 H80 N8 O20 -","4","1","OB6459","Punzo, Francesco; Watkin, David J.; Iezzi Simone, Michela; Fleet, George W. J.","(3<i>R</i>,4<i>R</i>,5<i>S</i>)-5-(Acetamidomethyl)-<i>N</i>-benzyl-3,4-dihydroxytetrahydrofuran-3-carboxamide","Acta Crystallographica Section E","2005","61","2","o513","o515","10.1107/S1600536805001467","","","0.71073","MoKα","","0.0465","0.034","","0.0769","0.0735","0.0769","","","","","","0.9344","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205132","8.1624","0.0003","8.5569","0.0003","11.6","0.0005","90","","90","","90","","810.2","0.05","120","","120","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2C-Methyl-D-arabinono-1,4-lactone","","- C6 H12 O6 -","- C6 H12 O6 -","- C24 H48 O24 -","4","1","OB6460","Punzo, Francesco; Watkin, David J.; Jenkinson, Sarah F.; Fleet, George W. J.","2<i>C</i>-Methyl-<small>D</small>-arabinono-1,4-lactone monohydrate","Acta Crystallographica Section E","2005","61","2","o326","o327","10.1107/S1600536805000723","","","0.71073","MoKα","","0.0369","0.0306","","0.0709","0.0687","0.0709","","","","","","0.977","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205133","18.285","0.004","10.779","0.003","16.152","0.004","90","","113.652","0.004","90","","2916","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(±)-(3aRS,4SR)-9-Chloro-3a,4-diethoxy-6,8-dimethoxy-2- (2-chloro-4-nitrophenyl)-4-(4-chlorophenyl)chromano[4,3-d]-Δ^1,9b^-1,2,3- thiadiazoline","","- C27 H24 Cl3 N3 O7 S -","- C27 H24 Cl3 N3 O7 S -","- C108 H96 Cl12 N12 O28 S4 -","4","1","OB6461","Yong-Zhou Hu; Hua-Zhou Ying","(±)-(3a<i>RS</i>,4<i>SR</i>)-9-Chloro-2-(2-chloro-4-nitrophenyl)-4-(4-chlorophenyl)-3a,4-diethoxy-6,8-dimethoxychromano[4,3-<i>d</i>]-Δ^1,9^^b^-1,2,3-thiadiazoline","Acta Crystallographica Section E","2005","61","2","o416","o418","10.1107/S1600536805001807","","","0.71073","MoKα","","0.0875","0.0485","","","0.1026","0.1148","","","","","","0.891","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205134","13.337","0.003","5.3977","0.0014","14.312","0.004","90","","109.898","0.019","90","","968.8","0.4","298","1","298","1","","","","","","","","4","P 1 21 1","P 2yb","4","","4,4'-(2-Methyl-1H-imidazole-4,5-diyl)bis[2(S)-methyl-3-azoniabutanoate] acetic acid monohydrate","","- C14 H26 N4 O7 -","- C14 H26 N4 O7 -","- C28 H52 N8 O14 -","2","1","OB6462","Gasque, Laura; Mijangos, Edgar; Bernès, Sylvain","4,4'-(2-Methyl-1<i>H</i>-imidazole-4,5-diyl)bis[2(<i>S</i>)-methyl-3-azoniabutanoate] acetic acid monohydrate","Acta Crystallographica Section E","2005","61","2","o284","o286","10.1107/S1600536805000115","","","0.71073","MoKα","","0.0585","0.0413","","","0.106","0.1173","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205135","7.4853","0.0017","13.449","0.003","22.653","0.005","90","","90","","90","","2280.5","0.9","297","2","297","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(±)-(1SR,8RS,10RS)-9,9,10-Tribromotricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene","","- C11 H9 Br3 -","- C11 H9 Br3 -","- C88 H72 Br24 -","8","1","OB6464","Ersanlı, Cem Cüneyt; Çoruh, Ufuk; Tuncer, Hökelek; Vázquez-López, Ezequiel M.; Arif, Daştan","(±)-(1<i>SR</i>,8<i>RS</i>,10<i>RS</i>)-9,9,10-Tribromotricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene","Acta Crystallographica Section E","2005","61","2","o263","o265","10.1107/S1600536805000255","","","0.71073","MoKα","","0.0863","0.0326","","","0.059","0.0662","","","","","","0.817","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205136","5.737","0.002","18.801","0.006","16.518","0.006","90","","93.368","0.004","90","","1778.6","1.1","150.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[bis(μ~4~-hexafluoroglutarato)bis(tetrahydrofuran)tetrasilver(I)]- μ~2~-4,4'-biphenyldicarbonitrile]","","- C32 H24 Ag4 F12 N2 O10 -","- C32 H24 Ag4 F12 N2 O10 -","- C64 H48 Ag8 F24 N4 O20 -","2","0.5","OB6465","Liu, Shu-Qin; Konaka, Hisashi; Kuroda-Sowa, Takayoshi; Munakata, Megumu","<i>catena</i>-Poly[[bis(μ~4~-hexafluoroglutarato)bis(tetrahydrofuran)tetrasilver(I)]-μ~2~-4,4'-biphenyldicarbonitrile]","Acta Crystallographica Section E","2005","61","2","m251","m253","10.1107/S1600536805000267","","","0.7107","MoKα","","","0.025","","","","0.0465","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205137","15.105","0.002","7.398","0.002","15.056","0.002","90","","112.72","0.01","90","","1551.9","0.5","273","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Nitrato[1-(2-pyridylmethyliminomethyl)naphthalen-2-olato]zinc(II)","","- C17 H13 N3 O4 Zn -","- C17 H13 N3 O4 Zn -","- C68 H52 N12 O16 Zn4 -","4","1","OB6466","Yang, De-Suo","Nitrato[1-(2-pyridylmethyliminomethyl)naphthalen-2-olato]zinc(II)","Acta Crystallographica Section E","2005","61","2","m247","m248","10.1107/S1600536805000279","","","0.71073","MoKα","","0.0464","0.039","","","0.1086","0.1137","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205138","14.996","0.001","13.597","0.001","25.156","0.002","90","","90","","90","","5129.3","0.7","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis[4-bromo-2-(cyclohexyliminomethyl)phenolato]copper(II)","","- C26 H30 Br2 Cu N2 O2 -","- C26 H30 Br2 Cu N2 O2 -","- C208 H240 Br16 Cu8 N16 O16 -","8","1","OB6467","Yang, De-Suo","Bis[4-bromo-2-(cyclohexyliminomethyl)phenolato]copper(II)","Acta Crystallographica Section E","2005","61","2","m249","m250","10.1107/S1600536805000280","","","0.71073","MoKα","","0.0705","0.0431","","","0.1043","0.1169","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205139","7.252","0.004","7.442","0.004","13.43","0.008","93.49","0.05","98.74","0.05","94.56","0.05","712.2","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2-Methyl-6-(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)phenol","","- C17 H24 O -","- C17 H24 O -","- C34 H48 O2 -","2","1","OB6469","Oleg Ya. Borbulevych","2-Methyl-6-(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)phenol","Acta Crystallographica Section E","2005","61","2","o378","o379","10.1107/S1600536805001236","","","0.71073","MoKα","","0.12","0.0457","","","0.1035","0.1148","","","","","","0.785","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205140","17.032","0.002","3.9694","0.0005","35.819","0.005","90","","90","","90","","2421.6","0.5","95","2","95","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Ethyl 1,3-dibromoazulene-6-carboxylate","","- C13 H10 Br2 O2 -","- C13 H10 Br2 O2 -","- C104 H80 Br16 O16 -","8","2","OB6470","Hussain, Zakir; Oeser, Thomas; Hopf, Henning","Ethyl 1,3-dibromoazulene-6-carboxylate","Acta Crystallographica Section E","2005","61","2","o478","o479","10.1107/S1600536805001972","","","0.71073","MoKα","","0.044","0.042","","","0.091","0.092","","","","","","1.111","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205141","12.2243","0.0006","19.1241","0.001","8.5207","0.0019","90","","90","","90","","1992","0.5","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","12,13-Dihydro-12-oxo-13-phenylbenzo[b]naphth[f][1,4]oxazepine-2,3-dicarbonitrile","","- C25 H13 N3 O2 -","- C25 H13 N3 O2 -","- C100 H52 N12 O8 -","4","1","RN6033","Is̨ik, S̨amil; Yavuz, Metin; Akdemir, Nesuhi; Ağar, Erbil; Özil, Musa","12,13-Dihydro-12-oxo-13-phenylbenzo[<i>b</i>]naphth[<i>f</i>][1,4]oxazepine-2,3-dicarbonitrile","Acta Crystallographica Section E","2005","61","2","o427","o428","10.1107/S1600536805000991","","","0.71073","MoKα","","0.0599","0.0331","","","0.0694","0.0759","","","","","","0.879","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205142","19.7","0.004","13.097","0.003","20.021","0.004","90","","90","","90","","5165.6","1.9","298","2","298","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Hexaaquazinc(II) bis(perchlorate) 2,5-dimethylpyrazine 1,4-dioxide","","- C12 H28 Cl2 N4 O18 Zn -","- C12 H28 Cl2 N4 O18 Zn -","- C96 H224 Cl16 N32 O144 Zn8 -","8","1","RN6035","Lu, Jian Jun; Shi, Jing Min","Hexaaquazinc(II) bis(perchlorate) bis(2,5-dimethylpyrazine 1,4-dioxide)","Acta Crystallographica Section E","2005","61","2","m327","m328","10.1107/S1600536805001005","","","0.71073","MoKα","","0.0705","0.0542","","","0.1312","0.1415","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205143","9.5998","0.0012","10.8872","0.0013","14.4903","0.0018","79.303","0.002","76.243","0.002","80.467","0.002","1433.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(Z)-1-phenyl-2-(3-phenylthiazolidin-2-ylidene)ethanone","","- C17 H15 N O S -","- C17 H15 N O S -","- C68 H60 N4 O4 S4 -","4","2","RN6038","Liang-zhong Xu; Hai-Zhen Xu; Hai-Bin Song; Yong-Qi Qin; Kai Zhou","(<i>Z</i>)-1-Phenyl-2-(3-phenylthiazolidin-2-ylidene)ethanone","Acta Crystallographica Section E","2005","61","2","o459","o460","10.1107/S1600536805002102","","","0.71073","MoKα","","0.0506","0.0351","","","0.0874","0.0955","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205144","17.099","0.003","14.758","0.003","8.002","0.0016","90","","95","0.03","90","","2011.6","0.7","293","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Azidobis(2,2'-bipyridine)cadmium(II)","","- C20 H16 Cd N10 -","- C20 H16 Cd N10 -","- C80 H64 Cd4 N40 -","4","1","RZ6033","Fangfang Jian; Chunlei Li; Hailian Xiao; Pingping Sun","Azidobis(2,2'-bipyridine)cadmium(II)","Acta Crystallographica Section E","2005","61","2","m217","m218","10.1107/S1600536804033537","","","0.71073","MoKα","","0.0447","0.025","","","0.0639","0.0707","","","","","","1.071","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205145","5.8303","0.0001","9.8983","0.0002","24.1599","0.0004","90","","90","","90","","1394.27","0.04","120","","120","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,2':5,6-Di-O-isopropylidene-2-C-hydroxmethyl-D-talono-1,4-lactone","","- C13 H20 O7 -","- C13 H20 O7 -","- C52 H80 O28 -","4","1","RZ6034","Christopher C. Harding; David J. Watkin; Andrew R. Cowley; Raquel Soengas; Ulla P. Skytte; George W. J. Fleet","2,2':5,6-Di-<i>O</i>-isopropylidene-2-<i>C</i>-hydroxymethyl-<small>D</small>-talono-1,4-lactone","Acta Crystallographica Section E","2005","61","2","o250","o252","10.1107/S1600536804033549","","","0.71073","MoKα","","0.0407","0.0337","","0.0781","0.0758","0.0781","","","","","","0.9556","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205146","9.5001","0.001","9.8823","0.001","9.9403","0.001","98.039","0.002","115.157","0.002","104.092","0.002","787.18","0.14","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","5-(4-nitrophenyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline","","- C18 H18 N2 O3 -","- C18 H18 N2 O3 -","- C36 H36 N4 O6 -","2","1","RZ6039","K.Ravikumar; B.Sridhar; M. Mahesh; V. V. Narayana Reddy","A diastereoisomer of pyrano[3,2-<i>c</i>]quinoline","Acta Crystallographica Section E","2005","61","2","o461","o463","10.1107/S1600536805002448","","","0.71073","MoKα","","0.0731","0.061","","","0.1318","0.1386","","","","","","1.153","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205147","11.818","0.004","7.422","0.003","24.425","0.009","90","","90","","90","","2142.4","1.4","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Poly[disilver(I)(Ag—Ag)-μ-4-chlorobenzoato-μ-piperazine]","","- C18 H18 Ag2 Cl2 N2 O4 -","- C18 H18 Ag2 Cl2 N2 O4 -","- C72 H72 Ag8 Cl8 N8 O16 -","4","1","SJ6025","Yang, Song; Zou, Ying; Zhu, Hai-liang","Poly[disilver(I)(<i>Ag</i>—<i>Ag</i>)-μ-4-chlorobenzoato-μ-piperazine]","Acta Crystallographica Section E","2005","61","2","m219","m220","10.1107/S1600536804033732","","","0.71073","MoKα","","0.0505","0.0351","","","0.0833","0.1006","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205148","6.2771","0.0013","9.792","0.002","19.073","0.004","90","","90","","90","","1172.3","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-Phenylselanyl-3,5-methano-2H-cyclopenta[b]furan-2-one","2-Phenylselanyl-3,5-methano-2H-cyclopenta[b]furan-2-one","","- C14 H14 O2 Se -","- C14 H14 O2 Se -","- C56 H56 O8 Se4 -","4","1","SJ6027","Thomas Francis; D. Alan R. Happer; Ward T. Robinson","2-Phenylselanyl-3,5-methano-2<i>H</i>-cyclopenta[<i>b</i>]furan-2-one","Acta Crystallographica Section E","2005","61","2","o453","o455","10.1107/S160053680500231X","","","0.71073","MoKα","","0.027","0.0227","","","0.0525","0.0542","","","","","","1.012","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205149","14.768","0.002","13.048","0.002","15.084","0.002","90","","118.349","0.003","90","","2558","0.6","113.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H25 Cl2 N5 O5 Ru -","- C24 H25 Cl2 N5 O5 Ru -","- C96 H100 Cl8 N20 O20 Ru4 -","4","1","SJ6039","Kojima, Takahiko; Weber, David M.; Choma, Christin T.","{<i>N</i>-[Bis(2-pyridyl)methyl]-<i>N</i>,<i>N</i>-bis(2-pyridylmethyl)amine-κ^5^<i>N</i>}chlororuthenium(II) perchlorate methanol solvate","Acta Crystallographica Section E","2005","61","2","m226","m228","10.1107/S1600536804032209","","","0.7107","MoKα","","","0.044","","","","0.1195","","","","","","1.319","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205150","7.866","0.0004","20.076","0.0009","8.106","0.0003","90","","97.794","0.002","90","","1268.26","0.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","o-methylphenyl p-toluenesulfonate","2-methylphenyl 4-toluenesulfonate","","- C14 H14 O3 S -","- C14 H14 O3 S -","- C56 H56 O12 S4 -","4","1","SJ6042","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Fronczek, Frank R.","2-Methylphenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O, C—H···π and π‒π interactions","Acta Crystallographica Section E","2005","61","2","o239","o241","10.1107/S1600536804033112","","","0.71073","MoKα","","0.069","0.0409","","","0.1047","0.1174","","","","","","0.919","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205151","11.2017","0.001","9.7789","0.0006","13.2237","0.0014","90","","115.035","0.009","90","","1312.4","0.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 Cu N4 O6 -","- C28 H22 Cu N4 O6 -","- C56 H44 Cu2 N8 O12 -","2","0.5","SJ6045","Jian-Rong Su; Jian-Ming Gu; Duan-Jun Xu","Bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)bis(4-hydroxybenzoato-κ^2^<i>O,O</i>')copper(II)","Acta Crystallographica Section E","2005","61","2","m244","m246","10.1107/S1600536804034221","","","0.71069","MoKα","","0.045","0.038","","","0.102","0.106","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205152","5.8464","0.0009","8.8422","0.0014","26.927","0.004","90","","90","","90","","1392","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,2R)-Ethyl 1-azido-2-hydroxy-2,3-dihydro-1H-pyrrolo[1,2-a]indole-9-carboxylate","","- C14 H14 N4 O3 -","- C14 H14 N4 O3 -","- C56 H56 N16 O12 -","4","1","SU6146","Fernandes, Manuel A.; Koning, Charles B. de; Michael, Joseph P.; Petersen, Riaan L.","(1<i>R</i>,2<i>R</i>)-Ethyl 1-azido-2-hydroxy-2,3-dihydro-1<i>H</i>-pyrrolo[1,2-<i>a</i>]indole-9-carboxylate","Acta Crystallographica Section E","2005","61","2","o269","o271","10.1107/S1600536805000231","","","0.71073","MoKα","","0.0535","0.0323","","","0.0762","0.0828","","","","","","1.086","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205153","7.527","0.005","24.889","0.005","11.757","0.005","90","","106.007","0.005","90","","2117.2","1.7","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Ethyl-1-[2-(1-ethylmorpholinium-1-yl)ethyl]benzimidazolium diiodide monohydrate","","- C17 H29 I2 N3 O2 -","- C17 H29 I2 N3 O2 -","- C68 H116 I8 N12 O8 -","4","1","SU6148","Mehmet Akkurt; Sema Öztürk Yıldırım; Hasan Küçükbay; Ülkü Yılmaz; Orhan Büyükgüngör","3-Ethyl-1-[2-(1-ethylmorpholinium-1-yl)ethyl]benzimidazolium diiodide monohydrate","Acta Crystallographica Section E","2005","61","2","o301","o303","10.1107/S160053680403301X","","","0.71073","MoKα","","0.0273","0.0249","","","0.0558","0.0565","","","","","","1.093","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205154","7.296","0.001","8.014","0.002","10.208","0.002","86.97","0.02","70.53","0.02","73.04","0.02","537.6","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 4,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C9 H14 N2 O2 S -","- C9 H14 N2 O2 S -","- C18 H28 N4 O4 S2 -","2","1","SU6149","Zavodnik, Valery E.; Shutalev, Anatoly D.; Gurskaya, Galina V.; Stash, Adam I.; Tsirelson, Vladimir G.","Ethyl 4,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2005","61","2","o468","o470","10.1107/S1600536805001935","","","0.71073","MoKα","","0.0468","0.0296","","","0.0927","0.0949","","","","","","1.118","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205155","6.824","0.003","11.887","0.006","25.224","0.01","90","","90","","90","","2046.1","1.6","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Guanidinium 4-hydroxypyridinium-2,6-dicarboxylate","","- C8 H10 N4 O5 -","- C8 H10 N4 O5 -","- C64 H80 N32 O40 -","8","1","SU6151","Moghimi, Abolghasem; Aghabozorg, Hossein; Soleimannejad, Janet; Ramezanipour, Farshid","Guanidinium 4-hydroxypyridinium-2,6-dicarboxylate","Acta Crystallographica Section E","2005","61","2","o442","o444","10.1107/S1600536805001121","","","0.71073","MoKα","","0.0814","0.0562","","","0.1247","0.1333","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205156","8.351","0.001","11.22","0.001","13.566","0.001","89.4","0.01","75.91","0.01","85.68","0.01","1229.3","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(3,5-dimethyl-1H-pyrazole-κN^2^)[N,N-bis(3,5-dimethyl-1H-pyrazol-1-ylmethyl- κN^2^)-2-hydroxyethylamine-κN]nitratocopper(II) nitrate","","- C19 H31 Cu N9 O7 -","- C19 H31 Cu N9 O7 -","- C38 H62 Cu2 N18 O14 -","2","1","SU6154","Ramdani, Abdelkrim; El Kodadi, Mohamed; Fouad, Malek; Eddike, Driss; Tillard, Monique; Claude Belin","A redetermination of [<i>N</i>,<i>N</i>-bis(3,5-dimethyl-1<i>H</i>-pyrazol-1-ylmethyl-κ<i>N</i>^2^)-2-hydroxyethylamine-κ<i>N</i>](3,5-dimethyl-1<i>H</i>-pyrazole-κ<i>N</i>^2^)nitratocopper(II) nitrate","Acta Crystallographica Section E","2005","61","2","m346","m348","10.1107/S1600536805001170","","","0.71069","MoKα","","0.0999","0.0873","","","0.2229","0.2312","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205157","17.61","0.001","17.61","0.001","17.206","0.001","90","","90","","90","","5335.8","0.5","295","2","295","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","Bis[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato-κ^3^N,N',O]cobalt(III) nitrate","","- C26 H20 Br2 Co N5 O5 -","- C26 H20 Br2 Co N5 O5 -","- C208 H160 Br16 Co8 N40 O40 -","8","1","SU6156","Sun, Yu-Xi","Bis[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]cobalt(III) nitrate","Acta Crystallographica Section E","2005","61","2","m335","m337","10.1107/S1600536805001182","","","0.71073","MoKα","","0.0667","0.0392","","","0.0902","0.1045","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205158","7.204","0.002","19.175","0.002","12.716","0.002","90","","95.93","0.02","90","","1747.1","0.6","295","2","295","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[4-Bromo-2-(pyridin-2-ylmethylaminomethyl)phenolato](methanol)copper(II) perchlorate","","- C14 H14 Br Cl Cu N2 O6 -","- C14 H14 Br Cl Cu N2 O6 -","- C56 H56 Br4 Cl4 Cu4 N8 O24 -","4","1","SU6157","Sun, Yu-Xi","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato](methanol)copper(II) perchlorate","Acta Crystallographica Section E","2005","61","2","m338","m340","10.1107/S1600536805001194","","","0.71073","MoKα","","0.0652","0.041","","","0.0919","0.1034","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205160","7.838","0.002","9.039","0.002","11.988","0.002","106.95","0.01","102.77","0.01","93.04","0.01","786","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Aqua[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]copper(II) nitrate monohydrate","","- C13 H14 Br Cu N3 O6 -","- C13 H14 Br Cu N3 O6 -","- C26 H28 Br2 Cu2 N6 O12 -","2","1","SU6159","Sun, Yu-Xi; Gao, Gen-Zhi; Pei, Hong-Xia; Zhang, Rui","Aqua[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]copper(II) nitrate monohydrate","Acta Crystallographica Section E","2005","61","2","m370","m372","10.1107/S1600536805001984","","","0.71073","MoKα","","0.0932","0.0502","","","0.0908","0.1054","","","","","","0.983","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205161","7.576","0.001","13.3","0.002","30.306","0.002","90","","90","","90","","3053.7","0.6","298","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Azido[1-(isobutylaminomethyliminomethyl)-2-naphtholato]nickel(II)","","- C15 H17 N5 Ni O -","- C15 H17 N5 Ni O -","- C120 H136 N40 Ni8 O8 -","8","1","SU6160","Sun, Yu-Xi; Gao, Gen-Zhi; Zhang, Rui; Pei, Hong-Xia","Azido[1-(isobutylaminomethyliminomethyl)-2-naphtholato]nickel(II)","Acta Crystallographica Section E","2005","61","2","m397","m398","10.1107/S1600536805001881","","","0.71073","MoKα","","0.0534","0.0433","","","0.1134","0.1208","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205162","7.133","0.0006","8.005","0.0009","8.452","0.0011","99.571","0.009","112.751","0.006","93.146","0.008","435.08","0.09","122","1","122","1","","","","","","","","3","P -1","-P 1","2","2,5-Dimethoxybenzene-1,4-dicarbaldehyde","2,5-Dimethoxybenzene-1,4-dicarbaldehyde","","- C10 H10 O4 -","- C10 H10 O4 -","- C20 H20 O8 -","2","1","SU6161","Christian B. Nielsen; Michael Pittelkow; Henning Osholm Sørensen","2,5-Dimethoxybenzene-1,4-dicarbaldehyde","Acta Crystallographica Section E","2005","61","2","o473","o474","10.1107/S1600536805002229","","","0.71073","MoKα","","0.0784","0.0461","","","0.1114","0.13","","","","","","1.024","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205163","15.045","0.009","22.154","0.012","9.972","0.005","90","","106.05","0.04","90","","3194","3","126","2","126","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Fe(III)Cl(OEP)","Chloro(2,3,7,8,12,13,17,18-octaethylporphyrinato)iron(III)","","- C36 H44 Cl Fe N4 -","- C36 H44 Cl Fe N4 -","- C144 H176 Cl4 Fe4 N16 -","4","1","SU6162","Senge, Mathias O.","Chloro(2,3,7,8,12,13,17,18-octaethylporphyrinato)iron(III)","Acta Crystallographica Section E","2005","61","2","m399","m400","10.1107/S1600536805002461","","","0.71073","MoKα","","0.0673","0.0477","","","0.1242","0.1365","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205164","8.514","0.004","13.361","0.006","14.02","0.005","92.84","0.03","101.53","0.03","105.96","0.03","1493.2","1.2","130","2","130","2","","","","","","","","5","P -1","-P 1","2","Dibenzyl 5-(2-chloroethyl)-3,7-diethyl-2,8-dimethyldipyrromethane-1,9-dicarboxylate","dibenzyl 3,3'-diethyl-4,4'-dimethyl-2,2'-(3-chloropropane-1,1-diyl)dipyrrole- 5,5'-dicarboxylate","","- C33 H37 Cl N2 O4 -","- C33 H37 Cl N2 O4 -","- C66 H74 Cl2 N4 O8 -","2","1","SU6163","Senge, Mathias O.","Dibenzyl 5-(2-chloroethyl)-3,7-diethyl-2,8-dimethyldipyrromethane-1,9-dicarboxylate","Acta Crystallographica Section E","2005","61","2","o506","o508","10.1107/S160053680500245X","","","0.71073","MoKα","","0.0622","0.0446","","","0.1058","0.1169","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205165","7.298","0.001","8.003","0.001","11.985","0.002","100.18","0.01","101.95","0.01","100.86","0.01","655.38","0.17","295","2","298","2","","","","","","","","5","P -1","-P 1","2","","Dichloro[N,N-dimethyl-N'-(pyridin-2-ylmethylidene)ethane-1,2-diamine]zinc(II)","","- C10 H15 Cl2 N3 Zn -","- C10 H15 Cl2 N3 Zn -","- C20 H30 Cl4 N6 Zn2 -","2","1","SU6165","Sun, Yu-Xi","Dichloro[<i>N,N</i>-dimethyl-<i>N</i>'-(pyridin-2-ylmethylidene)ethane-1,2-diamine]zinc(II)","Acta Crystallographica Section E","2005","61","2","m373","m374","10.1107/S1600536805002278","","","0.71073","MoKα","","0.0349","0.0306","","","0.0679","0.0703","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205166","7.1714","0.0004","8.1184","0.0003","26.4299","0.0014","90","","95.721","0.002","90","","1531.09","0.13","294","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Methyl 2-[(ferrocenylcarbonyl)amino]thiophene-3-carboxylate","","- C17 H15 Fe N O3 S -","- C17 H15 Fe N O3 S -","- C68 H60 Fe4 N4 O12 S4 -","4","1","TK6199","Alley, Steven; Gallagher, John F.; Kenny, Peter T. M.; Lough, Alan J.","Methyl 2-[(ferrocenylcarbonyl)amino]thiophene-3-carboxylate","Acta Crystallographica Section E","2005","61","2","m201","m203","10.1107/S1600536804033355","","","0.71073","MolybdenumKα","","0.048","0.033","","","0.072","0.079","","","","","","1.04","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205167","20.907","0.004","11.951","0.004","26.516","0.005","90","","111.06","0.03","90","","6183","3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[1-(3-Aminopropyl)-4,7-dithia-1-azacyclononane- κ^4^N,N',S,S']bis(dimethylformamide-κO)nickel(II) bis(tetraphenylborate) acetonitrile disolvate","","- C67 H80 B2 N6 Ni O2 S2 -","- C67 H80 B2 N6 Ni O2 S2 -","- C268 H320 B8 N24 Ni4 O8 S8 -","4","1","TK6203","Blake, Alexander J.; Lippolis, Vito","[1-(3-Aminopropyl)-4,7-dithia-1-azacyclononane-κ^4^<i>N</i>,<i>N</i>',<i>S,S</i>']bis(dimethylformamide-κ<i>O</i>)nickel(II) bis(tetraphenylborate) acetonitrile disolvate","Acta Crystallographica Section E","2005","61","2","m207","m208","10.1107/S1600536804033380","","","0.71073","MoKα","","0.087","0.069","","","0.182","0.205","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205168","11.2502","0.001","6.9682","0.0006","24.014","0.002","90","","93.963","0.002","90","","1878","0.3","180","2","180","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","2,6-Bis[2,4-bis(heptyloxy)phenyl]pyridine","","- C41 H61 N O4 -","- C41 H61 N O4 -","- C82 H122 N2 O8 -","2","0.5","TK6205","Alcock, Nathaniel W.; Rourke, Jonathan P","2,6-Bis[2,4-bis(heptyloxy)phenyl]pyridine","Acta Crystallographica Section E","2005","61","2","o368","o369","10.1107/S1600536805001248","","","0.71073","MoKα","","0.13","0.06","","","0.134","0.168","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205169","9.891","0.004","10.188","0.004","13.592","0.005","106.179","0.007","106.822","0.007","97.75","0.007","1224","0.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","N,N-Bis(anthracen-9-ylmethyl)propylamine","","- C33 H29 N -","- C33 H29 N -","- C66 H58 N2 -","2","1","WK6030","Liu, Qing-Xiang; Song, Hai-Bin; Zheng-Ming Li","<i>N</i>,<i>N</i>-Bis(anthracen-9-ylmethyl)propylamine","Acta Crystallographica Section E","2005","61","2","o385","o386","10.1107/S1600536804034026","","","0.71073","MoKα","","0.197","0.077","","","0.158","0.208","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205170","18.838","0.003","16.557","0.002","10.065","0.012","90","","111.354","0.014","90","","2924","4","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","DL-phenylalaninium trichloroacetate","DL-Phenylalaninium trichloroacetate","","- C11 H12 Cl3 N O4 -","- C11 H12 Cl3 N O4 -","- C88 H96 Cl24 N8 O32 -","8","1","WK6038","K. Rajagopal; R. V. Krishnakumar; S. Natarajan","<small>DL</small>-Phenylalaninium trichloroacetate","Acta Crystallographica Section E","2005","61","2","o203","o205","10.1107/S160053680403404X","","","0.71073","MoKα","","0.0744","0.0534","","","0.143","0.1541","","","","","","1.027","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205171","8","0.004","8.753","0.004","9.752","0.005","102.716","0.009","94.939","0.008","94.976","0.009","659.7","0.6","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-methoxycarbonylamino-3-phenylpropionate","","- C13 H17 N O4 -","- C13 H17 N O4 -","- C26 H34 N2 O8 -","2","1","WK6039","Bin Tan; Hua Fang; Zan-Bin Wei; Li-Ren Jin","Ethyl 2-methoxycarbonylamino-3-phenylpropionate","Acta Crystallographica Section E","2005","61","2","o298","o300","10.1107/S1600536804034063","","","0.71073","MoKα","","0.072","0.056","","","0.151","0.162","","","","","","1.01","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205172","9.2724","0.0005","11.7943","0.0006","24.4404","0.0011","90","","99.18","0.002","90","","2638.6","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzyl 2-amino-6-chloro-9H-purine-9-carboxylate","","- C13 H10 Cl N5 O2 -","- C13 H10 Cl N5 O2 -","- C104 H80 Cl8 N40 O16 -","8","2","WK6041","Adebambo, Kassim F.; Howarth, Nicola; Rosair, Georgina M.","Benzyl 2-amino-6-chloro-9<i>H</i>-purine-9-carboxylate","Acta Crystallographica Section E","2005","61","2","o486","o488","10.1107/S1600536805002047","","","0.71073","MoKα","","0.0482","0.0343","","","0.0883","0.0946","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205173","5.6741","0.0017","5.6741","0.0017","11.249","0.005","90","","90","","90","","362.2","0.2","150","2","150","2","","","","","","","","3","I -4","I -4","82","","","","- Ge Hg2 Se4 -","- Ge Hg2 Se4 -","- Ge2 Hg4 Se8 -","2","0.25","WM6045","Yongkwan Dong; Sangrok Kim; Hoseop Yun","Reinvestigation of Hg~2~GeSe~4~ based on single-crystal data","Acta Crystallographica Section E","2005","61","2","i9","i11","10.1107/S1600536804034105","","","0.7107","MoKα","","","0.0556","","","","0.1449","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205174","9.1272","0.0016","10.282","0.002","9.1902","0.0014","90","","90","","90","","862.5","0.3","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","","Cerium diruthenium decaaluminium","","- Al10 Ce Ru2 -","- Al10 Ce Ru2 -","- Al40 Ce4 Ru8 -","4","0.25","WM6046","Tursina, Anna I.; Nesterenko, Sergei N.; Murashova, Elena V.; Chernyshev, Ilya V.; Noël, Henri; Seropegin, Yuri D.","CeRu~2~Al~10~ with the YbFe~2~Al~10~ structure type","Acta Crystallographica Section E","2005","61","2","i12","i14","10.1107/S1600536805000310","","","0.71073","MoKα","","0.0462","0.0434","","","0.1204","0.1227","","","","","","1.095","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205175","4.1539","0.0003","4.1539","0.0003","16.508","0.002","90","","90","","120","","246.68","0.04","153","2","153","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Cesium ytterbium diselenide","","- Cs Se2 Yb -","- Cs Se2 Yb -","- Cs2 Se4 Yb2 -","2","0.0833333","WM6047","Deng, Bin; Ibers, James A.","CsYbSe~2~","Acta Crystallographica Section E","2005","61","2","i15","i17","10.1107/S1600536805001157","","","0.71073","MoKα","","0.0208","0.0186","","","0.0405","0.0408","","","","","","1.703","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205176","9.1244","0.0006","11.0468","0.0007","13.0895","0.0007","90","","90.152","0.006","90","","1319.36","0.14","296","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Tetratellurium bis[heptachlorodigallate(III)]","","- Cl14 Ga4 Te4 -","- Cl14 Ga4 Te4 -","- Cl28 Ga8 Te8 -","2","0.5","WM6049","Lindsjö, Martin; Kloo, Lars","Tetratellurium bis[heptachlorodigallate(III)], Te~4~[Ga~2~Cl~7~]~2~","Acta Crystallographica Section E","2005","61","2","i18","i19","10.1107/S1600536805001960","","","0.71073","MoKα","","0.0514","0.0322","","","0.0541","0.0599","","","","","","1.11","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205177","5.127","0.002","13.75","0.006","22.503","0.009","90","","90","","90","","1586.4","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2Z)-2-(anthracen-9-ylmethylene)-5,6-dihydroimidazo[2,1-b]thiazol-3(2H)-one","","- C20 H14 N2 O S -","- C20 H14 N2 O S -","- C80 H56 N8 O4 S4 -","4","1","WN6312","Liang, Zu-Pei; Li, Jian","(2<i>Z</i>)-2-(Anthracen-9-ylmethylene)-5,6-dihydroimidazo[2,1-<i>b</i>]thiazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","2","o220","o221","10.1107/S1600536804033847","","","0.71073","MoKα","","0.1549","0.0743","","","","0.1981","","","","","","1.118","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205178","6.1138","0.0012","7.6933","0.0015","19.824","0.004","90","","90","","90","","932.4","0.3","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","3,8-Dimethyl-1,6-dioxa-4,9-diaza-5λ^5^-phosphaspiro[4.4]nonane-2,7-dione","","- C6 H11 N2 O4 P -","- C6 H11 N2 O4 P -","- C24 H44 N8 O16 P4 -","4","0.5","WN6313","Yu, Lin; Liu, Zhao; Fang, Hua; Zhao, Yu-Fen","(3<i>S</i>,8<i>S</i>)-3,8-Dimethyl-1,6-dioxa-4,9-diaza-5λ^5^-phosphaspiro[4.4]nonane-2,7-dione","Acta Crystallographica Section E","2005","61","2","o261","o262","10.1107/S160053680403421X","","","0.71073","MoKα","","0.0885","0.0685","","","0.1787","0.1979","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205179","27.665","0.009","5.1444","0.0016","13.907","0.004","90","","98.401","0.005","90","","1958","1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(4S)-4-(Methoxycarbonylmethylaminocarbonyl)-4-(3,4,5- trimethoxybenzamido)butanoic acid","","- C18 H24 N2 O9 -","- C18 H24 N2 O9 -","- C72 H96 N8 O36 -","4","1","WN6314","Li, Xun; Xu, Wen-Fang; Wu, Ji-Feng; Wang, Jun-Li; Yuan, Yu-Mei","(4<i>S</i>)-4-(Methoxycarbonylmethylaminocarbonyl)-4-(3,4,5-trimethoxybenzamido)butanoic acid","Acta Crystallographica Section E","2005","61","2","o349","o351","10.1107/S1600536805001339","","","0.71073","MoKα","","0.0895","0.0606","","","0.1405","0.1546","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205180","9.5294","0.0009","8.4805","0.0008","33.362","0.003","90","","90","","90","","2696.1","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Oxo-2-phenylethyl morpholine-4-carbodithioate","","- C13 H15 N O2 S2 -","- C13 H15 N O2 S2 -","- C104 H120 N8 O16 S16 -","8","1","WN6317","Liang-Zhong Xu; Kai Li; Guan-Ping Yu; Guo-Dong Si; Cheng-Long Yu","2-Oxo-2-phenylethyl morpholine-4-carbodithioate","Acta Crystallographica Section E","2005","61","2","o215","o216","10.1107/S1600536804033999","","","0.71073","MoKα","","0.0525","0.0268","","","0.0645","0.0957","","","","","","0.866","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205181","13.48","0.003","9.796","0.002","13.757","0.003","90","","97.556","0.003","90","","1800.8","0.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,5-Dimethyl-2-phenyl-4-[(E,E)-3-phenylprop-2-enylideneamino]- 1H-pyrazol-3(2H)-one","","- C20 H19 N3 O -","- C20 H19 N3 O -","- C80 H76 N12 O4 -","4","1","WN6320","Li, Zong-Xiao; Zhang, Xin-Li","1,5-Dimethyl-2-phenyl-4-[(<i>E,E</i>)-3-phenylprop-2-enylideneamino]-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","2","o375","o377","10.1107/S1600536805001340","","","0.71073","MoKα","","0.1039","0.0492","","","0.1112","0.1451","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205182","4.0781","0.0006","16.344","0.003","18.664","0.003","90","","90","","90","","1244","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(4-chlorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one","","- C15 H11 Cl O2 -","- C15 H11 Cl O2 -","- C60 H44 Cl4 O8 -","4","1","WN6321","T. Ravishankar; K. Chinnakali; S. Nanjundan; P. Selvam; Hoong-Kun Fun; Xiao-Lan Yu","1-(4-Chlorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","2","o405","o407","10.1107/S1600536805001686","","","0.71073","MoKα","","0.0587","0.0448","","","0.1003","0.1078","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205183","13.4346","0.0008","11.4998","0.0007","16.6055","0.001","90","","90","","90","","2565.5","0.3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1-(4-hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-ene-1-one","","- C16 H14 O3 -","- C16 H14 O3 -","- C128 H112 O24 -","8","1","WN6322","Sathiya Moorthi, S.; Chinnakali, K.; Nanjundan, S.; Radhika, R.; Fun, Hoong-Kun; Yu, Xiao-Lan","1-(4-Hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","2","o480","o482","10.1107/S1600536805001698","","","0.71073","MoKα","","0.0516","0.044","","","0.1193","0.126","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205184","11.7495","0.0013","5.4876","0.0006","20.165","0.002","90","","95.918","0.002","90","","1293.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Bromophenyl)-3-(3-hydroxyphenyl)prop-2-ene-1-one","","- C15 H11 Br O2 -","- C15 H11 Br O2 -","- C60 H44 Br4 O8 -","4","1","WN6324","S. Sathiya Moorthi; K. Chinnakali; S. Nanjundan; C. Sreekuttan Unnithan; Hoong-Kun Fun; Xiao-Lan Yu","1-(4-Bromophenyl)-3-(3-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","2","o483","o485","10.1107/S1600536805002370","","","0.71073","MoKα","","0.0512","0.0346","","","0.083","0.0911","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205185","4.9785","0.0006","21.127","0.002","10.9004","0.0013","90","","102.209","0.002","90","","1120.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2'-(2-Thienylmethylidene)-2-hydroxybenzohydrazide","","- C12 H10 N2 O2 S -","- C12 H10 N2 O2 S -","- C48 H40 N8 O8 S4 -","4","1","WW6323","Pan, Fu-You; Yang, Jian-Guo","2'-(2-Thienylmethylidene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2005","61","2","o352","o353","10.1107/S1600536804034099","","","0.71073","MoKα","","0.0609","0.0517","","","0.1489","0.1568","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205186","7.0492","0.0009","10.6716","0.0014","11.7464","0.0015","90","","103.426","0.002","90","","859.49","0.19","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1,10-phenanthrolin-1-ium 5-sulfosalicylate","","- C19 H14 N2 O6 S -","- C19 H14 N2 O6 S -","- C38 H28 N4 O12 S2 -","2","1","WW6336","Fan, Sai-Rong; Xiao, Hong-Ping; Zhu, Long-Guan","A cation‒anion complex: 1,10-phenanthrolin-1-ium 5-sulfonatosalicylic acid","Acta Crystallographica Section E","2005","61","2","o253","o255","10.1107/S1600536804034245","","","0.71073","MoKα","","0.0433","0.0429","","","0.1057","0.106","","","","","","1.18","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205187","6.4744","0.0016","23.758","0.006","7.5236","0.0019","90","","108.715","0.003","90","","1096.1","0.5","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","catena-Poly [tetraqua cadmium(II)-μ-hexane-1,6-diamineK~2~N:N'] terephthalate dihydrate]","","- C14 H32 Cd N2 O10 -","- C14 H32 Cd N2 O10 -","- C28 H64 Cd2 N4 O20 -","2","0.5","WW6340","Meng, Xiang-Gao; Lin, Zhi-Dong","<i>catena</i>-Poly[[tetraaquacadmium(II)-μ-hexane-1,6-diamine-κ^2^<i>N</i>:<i>N</i>'] terephthalate dihydrate]","Acta Crystallographica Section E","2005","61","2","m263","m264","10.1107/S1600536804034233","","","0.71073","MoKα","","0.0377","0.0364","","","0.0839","0.0845","","","","","","1.215","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205188","7.805","0.003","10.705","0.005","11.805","0.005","107.729","0.007","98.068","0.007","91.09","0.008","928.2","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1-(2,6-Dihydroxyphenyl)butanone","","- C10 H12 O3 -","- C10 H12 O3 -","- C40 H48 O12 -","4","2","WW6341","Hua-Rong Huang; Xiao-Long Feng; Zhi-Gang She; Yong-Cheng Lin; L. L. P. Vrijmoed; E. B. Gareth Jones","1-(2,6-Dihydroxyphenyl)butanone","Acta Crystallographica Section E","2005","61","2","o282","o283","10.1107/S160053680500022X","","","0.71073","MoKα","","0.0881","0.0492","","","0.122","0.1432","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205189","8.3046","0.0004","9.5443","0.0004","12.0048","0.0008","81.22","0.003","70.03","0.002","83.678","0.002","882.1","0.08","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[bis(1H-imidazole-κN^3^)zinc(II)]-μ-terephthalato-κO:O'] trihydrate]","","- C14 H18 N4 O7 Zn -","- C14 H18 N4 O7 Zn -","- C28 H36 N8 O14 Zn2 -","2","1","WW6342","Lin, Dong-Dong; Yin, Kai-Liang; Xu, Duan-Jun","<i>catena</i>-Poly[[[bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II)]-μ-terephthalato-κ^2^<i>O</i>:<i>O</i>'] trihydrate]","Acta Crystallographica Section E","2005","61","2","m260","m262","10.1107/S1600536805000164","","","0.71073","MoKα","","0.031","0.027","","","0.069","0.071","","","","","","1.123","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205190","10.2362","0.0012","8.9429","0.0011","10.3855","0.0012","90","","91.887","0.002","90","","950.2","0.2","295","2","295","2","","","","","","","","6","P 1 c 1","P -2yc","7","","2-(1H-Benzotriazol-1-yl)-3-(4-chlorophenyl)-3-hydroxy-N-phenylprop- 2-enethioamide","","- C21 H15 Cl N4 O S -","- C21 H15 Cl N4 O S -","- C42 H30 Cl2 N8 O2 S2 -","2","1","WW6347","Xu, Liangzhong; Yang, Shuanghua; Zhu, Chongyi; Li, Kai; Liu, Faqian","2-(1<i>H</i>-Benzotriazol-1-yl)-3-(4-chlorophenyl)-3-hydroxy-<i>N</i>-phenylprop-2-enethioamide","Acta Crystallographica Section E","2005","61","2","o259","o260","10.1107/S160053680500019X","","","0.71073","MoKα","","0.0563","0.0349","","","0.082","0.09","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205191","4.8223","0.0015","5.4732","0.0016","25.484","0.007","90","","90","","90","","672.6","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-hydroxy-1-phenylethanone","","- C8 H8 O2 -","- C8 H8 O2 -","- C32 H32 O8 -","4","1","YA6231","Pengying Zhao; Qiyun Shao; Weiyi Zhou; Jie Li; Chunbao Li","2-Hydroxy-1-phenylethanone","Acta Crystallographica, Section E","2005","61","2","o328","o329","10.1107/S1600536805000760","","","0.71073","MoKα","","0.063","0.036","","","0.102","0.142","","","","","","1.23","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205192","6.328","0.002","7.696","0.003","35.175","0.012","90","","92.678","0.006","90","","1711.2","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,10-Phenanthrolin-1-ium 2-carboxy-4-nitrobenzoate","","- C20 H13 N3 O6 -","- C20 H13 N3 O6 -","- C80 H52 N12 O24 -","4","1","YA6232","Guo, Ming-Lin","1,10-Phenanthrolin-1-ium 2-carboxy-4-nitrobenzoate","Acta Crystallographica Section E","2005","61","2","o431","o433","10.1107/S1600536805001765","","","0.71073","MoKα","","0.1","0.056","","","0.122","0.146","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205193","19.4776","0.0016","14.0453","0.0011","21.1035","0.0017","90","","90","","90","","5773.3","0.8","273","2","273","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","bis(butane-1,4-diammonium) bis(hydrogenphosphato)pentamolybdate monohydrate,","","- C8 H32 Mo5 N4 O24 P2 -","- C8 H32 Mo5 N4 O24 P2 -","- C64 H256 Mo40 N32 O192 P16 -","8","1","AC6148","Shailesh Upreti; A. Ramanan","Butane-1,4-diammonium diphosphopentamolybdate: a new inorganic‒organic hybrid solid","Acta Crystallographica Section E","2005","61","3","m414","m416","10.1107/S1600536805001856","","","0.71073","MoKα","","0.0273","0.0269","","","0.0747","0.0751","","","","","","1.283","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205194","8.237","0.003","8.438","0.003","14.59","0.006","83.554","0.007","75.631","0.007","84.998","0.007","974.3","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-Benzoylthiosemicarbazide","","- C8 H9 N3 O S -","- C8 H9 N3 O S -","- C32 H36 N12 O4 S4 -","4","2","AC6151","Bian, He-Dong; Guo, Gui-Quan; Yu, Qing; Liang, Hong; Yang, Xiao-E; Zhu, Li-Gang","<i>N</i>-Benzoylthiosemicarbazide","Acta Crystallographica Section E","2005","61","3","o639","o640","10.1107/S1600536805003867","","","0.71073","MoKα","","0.0738","0.0422","","","0.0992","0.1241","","","","","","1.086","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205195","15.3509","0.0006","11.6315","0.0004","5.9802","0.0002","90","","90","","90","","1067.79","0.07","123","2","123","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2-(1-Piperidinyl)-1,3-benzothiazole","","- C12 H14 N2 S -","- C12 H14 N2 S -","- C48 H56 N8 S4 -","4","1","AC6153","Alvarez, Ricardo G.; Kennedy, Alan R.; Khalaf, Abedawn I.; Suckling, Colin J.; Waigh, Roger D.","2-(1-Piperidinyl)-1,3-benzothiazole","Acta Crystallographica Section E","2005","61","3","o569","o570","10.1107/S160053680500320X","","","0.71073","MoKα","","0.0361","0.0284","","","0.0617","0.0647","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205196","6.039","0.0012","7.221","0.0014","8.561","0.0017","84.48","0.03","81.33","0.03","71.08","0.03","348.67","0.14","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C3 H4 B Cl3 N2 -","- C3 H4 B Cl3 N2 -","- C6 H8 B2 Cl6 N4 -","2","1","AC6154","R. Angharad Baber; Andrew E. A. Bull; Jonathan P. H. Charmant; Nicholas C. Norman; A. Guy Orpen","<i>N</i>-Imidazole‒boron trichloride adduct","Acta Crystallographica Section E","2005","61","3","o553","o554","10.1107/S1600536805002631","","","0.71073","MoKα","","0.0344","0.0296","","","0.068","0.07","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205197","10.044","0.006","11.398","0.003","13.82","0.003","90","","109.79","0.04","90","","1488.7","1.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","10-(4-Fluorobenzylidene)anthrone","","- C21 H13 F O -","- C21 H13 F O -","- C84 H52 F4 O4 -","4","1","AC6156","Wei Zhou; Weixiao Hu; Luping Lv; Chunnian Xia","10-(4-Fluorobenzylidene)anthrone","Acta Crystallographica Section E","2005","61","3","o592","o593","10.1107/S1600536805002655","","","0.71073","MoKα","","0.0506","0.0333","","","0.0934","0.1032","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205198","8.6894","0.0007","24.3903","0.0015","7.8153","0.0006","90","","100.46","0.006","90","","1628.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2-Benzoylphenoxy)phthalonitrile","","- C21 H12 N2 O2 -","- C21 H12 N2 O2 -","- C84 H48 N8 O8 -","4","1","AC6158","Akbal, Tufan; Akdemir, Nesuhi; Ağar, Erbil; Kantar, Cihan; Erdönmez, Ahmet","4-(2-Benzoylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","3","o683","o684","10.1107/S160053680500440X","","","0.71073","MoKα","","0.0425","0.0332","","","0.0827","0.0852","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205199","18.223","0.001","5.5837","0.0004","11.5842","0.0007","90","","101.725","0.004","90","","1154.12","0.13","110","2","110","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 2,3,5,6-tetramethylbenzoate","","- C13 H18 O2 -","- C13 H18 O2 -","- C52 H72 O8 -","4","1","AC6159","Pinkus, A. G.; Klausmeyer, Kevin K.; Feazell, Rodney P.; Lin, Ellen C. H. Y.","Ethyl 2,3,5,6-tetramethylbenzoate","Acta Crystallographica Section E","2005","61","3","o662","o663","10.1107/S1600536805004319","","","0.71073","MoKα","","0.0567","0.0387","","","0.0961","0.1076","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205200","6.941","0.0007","8.141","0.0009","11.212","0.0006","90","","90.994","0.006","90","","633.46","0.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-dimorpholinobenzene","","- C14 H20 N2 O2 -","- C14 H20 N2 O2 -","- C28 H40 N4 O4 -","2","0.5","AC6160","Quail, J. Wilson; Doroudi, Alireza; Das, Umashankar; Dimmock, Jonathan R.","1,4-Dimorpholinobenzene","Acta Crystallographica Section E","2005","61","3","o693","o695","10.1107/S160053680500454X","","","0.71073","MoKα","","0.083","0.0519","","","0.1008","0.1154","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205201","18.466","0.003","16.745","0.002","13.914","0.0019","90","","129.174","0.002","90","","3335.3","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[μ-1-(2-pyridyl-κN)ethanone 4-phenylthiosemicarbazonato-κ^2^N^1^,S]bis[iodomercury(II)]","","- C28 H26 Hg2 I2 N8 S2 -","- C28 H26 Hg2 I2 N8 S2 -","- C112 H104 Hg8 I8 N32 S8 -","4","0.5","BR6172","Yamin, Bohari M.; Yusof, M. Sukeri M.","Bis[μ-1-(2-pyridyl-κ<i>N</i>)ethanone 4-phenylthiosemicarbazonato-κ^2^<i>N</i>^1^,<i>S</i>]bis[iodomercury(II)]","Acta Crystallographica Section E","2005","61","3","m454","m456","10.1107/S1600536805002898","","","0.71073","MoKα","","0.033","0.026","","","0.066","0.068","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205202","7.0074","0.0009","7.339","0.001","7.796","0.001","81.24","0.001","71.08","0.001","88.15","0.001","374.78","0.09","301","2","301","2","","","","","","","","5","P -1","-P 1","2","","diammonium zinc(II) dihydrogendiphosphate dihydrate","","- H16 N2 O16 P4 Zn -","- H16 N2 O16 P4 Zn -","- H16 N2 O16 P4 Zn -","1","0.5","BR6177","Essehli, Rachid; Lachkar, Mohammed; Svoboda, Ingrid; Fuess, Hartmut; El Bali, Brahim","Synthesis, crystal structure and vibrational spectra of a new diammonium zinc(II) dihydrogendiphosphate dihydrate, (NH~4~)~2~Zn(H~2~P~2~O~7~)~2~·2H~2~O","Acta Crystallographica Section E","2005","61","3","i32","i34","10.1107/S1600536805004642","","","0.71073","MoKα","","0.0328","0.0318","","","0.0896","0.0904","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205203","7.1952","0.0001","12.572","0.0002","5.8035","0.0001","90","","90","","90","","524.973","0.014","300","","300","","","","","","","","","5","P b n m","-P 2c 2ab","62","","europium lanthanum barium zinc oxide","","- Ba Eu1.8 La0.2 O5 Zn -","- Ba Eu1.8 La0.2 O5 Zn -","- Ba4 Eu7.2 La0.8 O20 Zn4 -","4","0.5","BR6178","Hernández-Pérez, José Apuleyo; Villafuerte-Castrejón, María-Elena; Bucio, Lauro","Eu~1.8~La~0.2~BaZnO~5~: a Rietveld refinement using X-ray powder diffraction","Acta Crystallographica Section E","2005","61","3","i23","i25","10.1107/S1600536805002886","","","1.54175","CuKα","","","","","","","","","","1.67","","","","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205204","7.0276","0.0007","7.5566","0.0006","10.2883","0.0008","90","","90.665","0.012","90","","546.32","0.08","296","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 Co K2 N6 Na -","- C6 Co K2 N6 Na -","- C12 Co2 K4 N12 Na2 -","2","0.5","BR6179","Ilyukhin, Andrey B.; Kotov, Vitalii Yu.","Dipotassium sodium hexacyanocobalt(III)","Acta Crystallographica Section E","2005","61","3","i26","i27","10.1107/S160053680500334X","","","0.71073","MoKα","","","0.0193","","","","0.0555","","","","","","0.998","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205205","34.037","0.003","8.3818","0.0007","13.0137","0.0011","90","","103.502","0.001","90","","3610.1","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(1,2-di-4-pyridylethene)bis(5-hydroxylisophthalato)zirconium(II) monohydrate","","- C40 H32 N4 O11 Zr -","- C40 H32 N4 O11 Zr -","- C160 H128 N16 O44 Zr4 -","4","0.5","BR6180","Ya-Juan Zhao; Ruo-Wang Liu; Xin-Hua Li","Bis(1,2-di-4-pyridylethene)bis(5-hydroxyisophthalato)zirconium(II) monohydrate","Acta Crystallographica Section E","2005","61","3","m535","m537","10.1107/S1600536805003697","","","0.71073","MoKα","","0.0719","0.064","","","0.1843","0.194","","","","","","1.124","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205206","7.4749","0.0006","17.426","0.002","14.443","0.002","90","","101.087","0.008","90","","1846.2","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-4-(Ferrocenylideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one","","- C22 H21 Fe N3 O -","- C22 H21 Fe N3 O -","- C88 H84 Fe4 N12 O4 -","4","1","BR6181","Wu, Hong-Fei; Wang, Hong-Xing","<i>trans</i>-4-(Ferrocenylideneamino)-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","3","m580","m581","10.1107/S1600536805004344","","","0.71073","MoKα","","0.0467","0.0329","","","0.0733","0.0761","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205207","4.5079","0.0013","12.556","0.004","7.135","0.002","90","","111.094","0.004","90","","376.79","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cerium(III) hydroxide sulfate","","- Ce H O5 S -","- Ce H O5 S -","- Ce4 H4 O20 S4 -","4","1","BR6182","Yan Yang; Li-Hong Zhu; Ming-Hua Zeng; Xiao-Long Feng","Cerium(III) hydroxide sulfate, Ce(OH)SO~4~","Acta Crystallographica Section E","2005","61","3","i41","i43","10.1107/S1600536805005179","","","0.71073","MoKα","","0.0165","0.0154","","","0.0395","0.04","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205208","22.266","0.0005","10.658","0.0005","7.492","0.0005","90","","103.743","0.005","90","","1727.03","0.15","295","2","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Bis(3-carboxyanilinium) hexafluorostannate(IV)","","","- C14 H16 F6 N2 O4 Sn -","- C14 H16 F6 N2 O4 Sn -","- C56 H64 F24 N8 O16 Sn4 -","4","0.5","BR6183","Bouacida, Sofiane; Merazig, Hocine; Beghidja, Adel; Beghidja, Chahrazed","Bis(3-carboxyanilinium) hexafluorostannate(IV)","Acta Crystallographica Section E","2005","61","3","m577","m579","10.1107/S160053680500512X","","","0.71073","MoKα","","0.0334","0.0269","","","0.0602","0.0627","","","","","","1.098","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205209","9.883","0.002","10.103","0.002","15.892","0.002","90","","106.59","0.01","90","","1520.7","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3R,5S)-1-Benzyl 2-tert-butyl 4-[N,N'-bis(tert-butyloxycarbonyl)hydrazino]-5-oxopyrrolidine-1,5-dicarboxylate","","- C27 H39 N3 O9 -","- C27 H39 N3 O9 -","- C54 H78 N6 O18 -","2","1","BT6586","Krzysztof Kaczmarek; Wojciech M. Wolf; Janusz Zabrocki","(2<i>S</i>,4<i>R</i>)-1-Benzyl 2-<i>tert</i>-butyl 4-[<i>N</i>,<i>N</i>'-bis(<i>tert</i>-butyloxycarbonyl)hydrazino]-5-oxopyrrolidine-1,2-dicarboxylate","Acta Crystallographica Section E","2005","61","3","o629","o631","10.1107/S1600536805003880","","","1.54178","CuKα","","0.1419","0.0522","","","0.1154","0.1581","","","","","","1.09","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205210","19.115","0.002","12.012","0.001","22.071","0.002","90","","90.024","0.001","90","","5067.7","0.8","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(μ-5-chloro-2-hydroxyacetophenone 4-nitrobenzoylhydrazonato)bis[dipyridinecadmium(II)]","","- C50 H40 Cd2 Cl2 N10 O8 -","- C50 H40 Cd2 Cl2 N10 O8 -","- C200 H160 Cd8 Cl8 N40 O32 -","4","0.5","BT6595","Ali, Hapipah M.; Kamalul Aripin, Nurul Fadhilah; Ng, Seik Weng","Bis(μ-5-chloro-2-hydroxyacetophenone 4-nitrobenzoylhydrazonato)bis[dipyridinecadmium(II)]","Acta Crystallographica Section E","2005","61","3","m433","m434","10.1107/S1600536805002953","","","0.71073","MoKα","","0.075","0.058","","","0.124","0.131","","","","","","1.15","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205211","12.486","0.002","9.443","0.001","16.839","0.002","90","","108.289","0.002","90","","1885.1","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[diaquahexapyridine-μ~2~-sulfato-dicobalt(II)]-μ-sulfato] tetrahydrate]","","- C30 H42 Co2 N6 O14 S2 -","- C30 H42 Co2 N6 O14 S2 -","- C60 H84 Co4 N12 O28 S4 -","2","0.5","BT6596","Ali, Hapipah M.; Puvaneswary, Subramaniam; Ng, Seik Weng","<i>catena</i>-Poly[[[diaquahexapyridine-μ-sulfato-dicobalt(II)]-μ-sulfato] tetrahydrate]","Acta Crystallographica Section E","2005","61","3","m474","m475","10.1107/S1600536805003429","","","0.71073","MoKα","","0.0591","0.0475","","","0.106","0.1114","","","","","","1.137","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205212","6.066","0.001","8.643","0.002","13.272","0.003","104.87","0.03","97.27","0.03","93.29","0.03","664.2","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[diaqua[3-(2-pyridyl)-1H-pyrazole-κN^2^]cadmium(II)]- μ-squarato-κ^2^O:O']","","- C12 H11 Cd N3 O6 -","- C12 H11 Cd N3 O6 -","- C24 H22 Cd2 N6 O12 -","2","1","BT6598","Huo, Li-Hua; Cheng, Xiao Li; Zhao, Hui; Ng, Seik Weng","<i>catena</i>-Poly[[diaqua[3-(2-pyridyl)-1<i>H</i>-pyrazole-κ<i>N</i>^2^]cadmium(II)]-μ-squarato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","3","m460","m462","10.1107/S1600536805003041","","","0.71073","MoKα","","0.024","0.022","","","0.072","0.073","","","","","","1.34","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205213","13.4048","0.0011","6.1275","0.0004","30.239","0.002","90","","94.81","0.003","90","","2475","0.3","120","2","120","2","","","","","","","","3","C 1 2 1","C 2y","5","","3β-Taraxerol","","- C30 H50 O -","- C30 H50 O -","- C120 H200 O4 -","4","1","BT6599","Kouam, Simeon F.; Flörke, Ulrich; Krohn, Karsten; Akhtar, M. Nadeem; Ngadjui, Bonaventure T.; Abegaz, Berhanu M.","3β-Taraxerol from <i>Bridelia micrantha</i>","Acta Crystallographica Section E","2005","61","3","o599","o600","10.1107/S1600536805003934","","","0.71073","MoKα","","0.0703","0.0519","","","0.1043","0.1097","","","","","","0.981","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205214","18.448","0.002","9.9631","0.0004","20.029","0.002","90","","108.422","0.005","90","","3492.7","0.5","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-(1H-Indol-3-yl)-4-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione","","- C21 H18 N2 O5 -","- C21 H18 N2 O5 -","- C168 H144 N16 O40 -","8","1","BT6600","Christian Peifer; Schollmeyer, Dieter; Gerd Dannhardt","3-(1<i>H</i>-Indol-3-yl)-4-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1<i>H</i>-pyrrole-2,5-dione","Acta Crystallographica Section E","2005","61","3","o721","o723","10.1107/S1600536805004605","","","1.54178","CuKα","","0.0448","0.0441","","","0.1198","0.1205","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205215","7.994","0.002","20.04","0.004","13.644","0.004","90","","106.586","0.012","90","","2094.8","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5,6,7-Trimethoxy-2,3-dihydro-1H,8H-benzo[a]pyrrolo[3,4-c]carbazole-1,3-dione dimethyl sulfoxide solvate","","- C23 H22 N2 O6 S -","- C23 H22 N2 O6 S -","- C92 H88 N8 O24 S4 -","4","1","BT6601","Christian Peifer; Schollmeyer, Dieter; Gerd Dannhardt","5,6,7-Trimethoxy-2,3-dihydro-1<i>H</i>,8<i>H</i>-benzo[<i>a</i>]pyrrolo[3,4-<i>c</i>]carbazole-1,3-dione dimethyl sulfoxide solvate","Acta Crystallographica Section E","2005","61","3","o724","o725","10.1107/S160053680500485X","","","1.54178","CuKα","","0.1118","0.0756","","","0.1702","0.1874","","","","","","1.113","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205216","8.1986","0.0005","14.0252","0.0009","23.482","0.001","90","","90","","90","","2700.1","0.3","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Bharangin triacetate","6,10-bis(acetyloxy)-8-isopropyl-4,4,11a-trimethyl-2-oxo-2,3,4,6,11,11a- hexahydrobenzo[5,6]cyclohepta[1,2-b]pyran-9-yl acetate","","- C26 H32 O8 -","- C26 H32 O8 -","- C104 H128 O32 -","4","1","BT6602","Ravikumar, K.; Sridhar, B.; Marthanda Murthy, M.","A stereoisomer of bharangin triacetate","Acta Crystallographica Section E","2005","61","3","o687","o689","10.1107/S1600536805004617","","","0.71073","MoKα","","0.0632","0.0596","","","0.1551","0.158","","","","","","1.103","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205217","9.339","0.003","5.766","0.003","24.662","0.009","90","","90.07","0.03","90","","1328","0.9","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cytosinium 3,5-dinitrosalicylate","6-amino-2-oxo-2,3-dihydropyrimidinium 3,5-dinitrosalicylate","","- C11 H9 N5 O8 -","- C11 H9 N5 O8 -","- C44 H36 N20 O32 -","4","1","BT6603","Graham Smith; Urs D. Wermuth; Peter C. Healy","Cytosinium 3,5-dinitrosalicylate","Acta Crystallographica Section E","2005","61","3","o746","o748","10.1107/S160053680500499X","","","0.71069","MoKα","","0.105","0.0444","","","0.1193","0.1597","","","","","","0.926","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205218","9.966","0.002","12.079","0.002","16.345","0.002","90","","92.42","0.02","90","","1965.8","0.6","143","2","143","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,3-Di-tert-butyl-6-(trimethylsilylethynyl)fulvene","","- C19 H30 Si -","- C19 H30 Si -","- C76 H120 Si4 -","4","1","BT6604","Berger, Harald; Bubenitschek, Peter; Hopf, Henning; Jones, Peter G.","1,3-Di-<i>tert</i>-butyl-6-(trimethylsilylethynyl)fulvene","Acta Crystallographica Section E","2005","61","3","o710","o711","10.1107/S1600536805004745","","","0.71073","MoKα","","0.0692","0.0512","","","0.1242","0.1387","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205219","9.1329","0.0008","18.882","0.002","8.8856","0.0007","90","","103.264","0.001","90","","1491.4","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[diethylenetriaminium [ferrate(III)-tri-μ-sulfato-κ^6^O:O'] monohydrate]","","- C4 H18 Fe N3 O13 S3 -","- C4 H18 Fe N3 O13 S3 -","- C16 H72 Fe4 N12 O52 S12 -","4","1","BT6605","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[diethylenetriaminium [ferrate(III)-tri-μ-sulfato-κ^6^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2005","61","3","m593","m595","10.1107/S1600536805005349","","","0.71073","MoKα","","0.059","0.044","","","0.101","0.109","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205220","8.7918","0.0007","6.9963","0.0005","25.032","0.001","90","","90.289","0.002","90","","1539.7","0.18","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[hexamethylenediaminium [ferrate(III)-μ-hydroxo-κ^2^O:O-di-μ-sulfato-κ^4^O:O'] monohydrate]","","- C6 H21 Fe N2 O10 S2 -","- C6 H21 Fe N2 O10 S2 -","- C24 H84 Fe4 N8 O40 S8 -","4","1","BT6606","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[hexamethylenediaminium [ferrate(III)-μ-hydroxo-κ^2^<i>O</i>:<i>O</i>-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2005","61","3","m596","m597","10.1107/S1600536805005350","","","0.71073","MoKα","","0.053","0.035","","","0.091","0.1","","","","","","0.994","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205221","10.249","0.001","13.648","0.001","16.082","0.002","90","","102.045","0.002","90","","2200","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[diethylenetriaminium(3+)] tris(sulfate) monohydrate","","- C8 H34 N6 O13 S3 -","- C8 H34 N6 O13 S3 -","- C32 H136 N24 O52 S12 -","4","0.5","BT6607","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Bis[diethylenetriaminium(3+)] tris(sulfate) monohydrate","Acta Crystallographica Section E","2005","61","3","o772","o773","10.1107/S1600536805005362","","","0.71073","MoKα","","0.074","0.058","","","0.143","0.154","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205222","6.3192","0.0008","22.253","0.003","5.4903","0.0007","90","","90","","90","","772.05","0.17","295","2","295","2","","","","","","","","5","P n n m","-P 2 2n","58","","Trimethylenetetraaminium(4+) bis(sulfate) monohydrate","","- C6 H24 N4 O9 S2 -","- C6 H24 N4 O9 S2 -","- C12 H48 N8 O18 S4 -","2","0.25","BT6608","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Triethylenetetraminium(4+) bis(sulfate) monohydrate","Acta Crystallographica Section E","2005","61","3","o774","o775","10.1107/S1600536805005477","","","0.71073","MoKα","","0.081","0.07","","","0.174","0.185","","","","","","1.14","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205223","7.465","0.0015","8.067","0.0016","12.411","0.003","90","","98.16","0.03","90","","739.8","0.3","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(imidazolium) hexachlorotin(IV)","","- C6 H10 Cl6 N4 Sn -","- C6 H10 Cl6 N4 Sn -","- C12 H20 Cl12 N8 Sn2 -","2","0.5","BV6013","Zhang, Hui; Fang, Liang; Dronskowski, Richard; Kruse, Klaus; Yuan, Runzhang","Bis(imidazolium) hexachlorostannate(IV)","Acta Crystallographica Section E","2005","61","3","m543","m544","10.1107/S1600536805004770","","","0.71073","MoKα","","0.0204","0.0183","","","0.0453","0.0462","","","","","","1.07","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205224","4.7272","0.0001","7.6955","0.0003","10.1387","0.0004","100.743","0.0013","96.0038","0.0015","99.3371","0.0018","354.09","0.02","150","","150","","","","","","","","","3","P -1","-P 1","2","","n-Butyl acetate","","- C6 H12 O2 -","- C6 H12 O2 -","- C12 H24 O4 -","2","1","CF6393","Howard A. Shallard-Brown; David J. Watkin; Andrew R. Cowley","<i>n</i>-Butyl acetate","Acta Crystallographica Section E","2005","61","3","o561","o562","10.1107/S1600536805000371","","","0.71073","MoKα","","0.0567","0.0399","","0.104","0.097","0.104","","","","","","0.9722","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205225","7.195","0.002","7.106","0.002","9.131","0.003","90","","92.866","0.005","90","","466.3","0.2","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","3-(Imidazolidin-2-ylidene)-6-methyl-3,4,5,6-tetrahydro-2H-pyran-2,4-dione","","- C9 H12 N2 O3 -","- C9 H12 N2 O3 -","- C18 H24 N4 O6 -","2","0.5","CF6397","Jing-Jun Hao; Hu Xu; Hai-Bing Song; You-Ming Wang; Zheng-Ming Li","3-(Imidazolidin-2-ylidene)-6-methyl-3,4,5,6-tetrahydro-2<i>H</i>-pyran-2,4-dione","Acta Crystallographica Section E","2005","61","3","o749","o750","10.1107/S1600536805004812","","","0.71073","MoKα","","0.0689","0.0446","","","0.1212","0.1377","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205226","9.653","0.002","9.78","0.002","19.179","0.004","90","","90","","90","","1810.6","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","phenylacy (2S,4S)-N-tert-butoxycarbonyl-4-hydroxyprolinate","Phenylacyl (2S,4S)-1-tert-butoxycarbonyl-4-hydroxyprolinate","","- C18 H23 N O6 -","- C18 H23 N O6 -","- C72 H92 N4 O24 -","4","1","CF6401","Chabaud, Pauline; Worf, Monica; Courcambeck, Jérôme; Camplo, Michel; Pèpe, Gérard","Phenacyl (2<i>S</i>,4<i>S</i>)-1-<i>tert</i>-butoxycarbonyl-4-hydroxyprolinate","Acta Crystallographica Section E","2005","61","3","o792","o794","10.1107/S1600536805005404","","","0.71073","MoKα","","0.0439","0.0418","","","0.1308","0.1388","","","","","","0.899","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205227","9.7976","0.0009","14.3385","0.0013","11.9807","0.001","90","","94.534","0.004","90","","1677.8","0.3","299","1","299","1","","","","","","","","4","P 1 21 1","P 2yb","4","","N,N'-Bis[(R)-2-hydroxy-2-phenylethyl]-N,N'-bis[(S)-1-phenylethyl]pyridine-2,6- dicarboxamide","","- C39 H39 N3 O4 -","- C39 H39 N3 O4 -","- C78 H78 N6 O8 -","2","1","CF6402","Sosa-Rivadeneyra, Martha; Quintero, Leticia; Anaya de Parrodi, Cecilia; Juaristi, Eusebio; Bernès, Sylvain","<i>N,N</i>'-Bis[(<i>R</i>)-2-hydroxy-2-phenylethyl]-<i>N,N</i>'-bis[(<i>S</i>)-1-phenylethyl]pyridine-2,6-dicarboxamide: stabilization of an asymmetric conformer through the formation of a double intramolecular hydrogen bond","Acta Crystallographica Section E","2005","61","3","o536","o538","10.1107/S160053680500228X","","","0.71073","MoKα","","0.0439","0.0358","","","0.0914","0.0967","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205228","15.532","0.004","11.119","0.003","23.247","0.005","90","","90","","90","","4014.8","1.7","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-tert-Butoxy-1-phenyl-1-(2,2,6,6-tetramethylpiperidin-1-yloxy)ethane","","- C21 H35 N O2 -","- C21 H35 N O2 -","- C168 H280 N8 O16 -","8","1","CF6403","Batsanov, Andrei S.; Reid, Alistair J.; Cameron, Neil","2-<i>tert</i>-Butoxy-1-phenyl-1-(2,2,6,6-tetramethylpiperidin-1-yloxy)ethane","Acta Crystallographica Section E","2005","61","3","o716","o717","10.1107/S1600536805004976","","","0.71073","MoKα","","0.0451","0.0389","","","0.1064","0.1144","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205229","21.662","0.002","16.726","0.002","7.405","0.001","90","","90","","90","","2683","0.5","295","2","295","2","","","","","","","","5","C m c a","-C 2ac 2","64","","catena-Poly[[μ-4,4'-bipyridine-bis[aquacopper(II)]]-di-μ-2-nitroterephthalato]","","- C26 H18 Cu2 N4 O14 -","- C26 H18 Cu2 N4 O14 -","- C104 H72 Cu8 N16 O56 -","4","","CF6404","He, Hong-Yin; Zhu, Long-Guan; Ng, Seik Weng","<i>catena</i>-Poly[[[μ-4,4'-bipyridine-bis[aquacopper(II)]]-di-μ-2-nitroterephthalato]","Acta Crystallographica Section E","2005","61","3","m601","m602","10.1107/S1600536805005751","","","0.71073","MoKα","","0.087","0.05","","","0.125","0.137","","","","","","0.92","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2205230","6.8108","0.0008","11.0797","0.0012","13.3766","0.0015","75.862","0.002","84.841","0.002","81.296","0.002","966.09","0.19","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-nitrophenyl)methyleneimino]- 1H-pyrazole-3-carbonitrile","","- C18 H8 Cl2 F3 N5 O2 -","- C18 H8 Cl2 F3 N5 O2 -","- C36 H16 Cl4 F6 N10 O4 -","2","1","CF6405","Zhong, Ping; Yang, Zhiping; Shi, Qian","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-nitrophenyl)methyleneimino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","3","o786","o787","10.1107/S1600536805005659","","","0.71073","MoKα","","0.07","0.0579","","","0.1523","0.1615","","","","","","1.038","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205231","12.818","0.003","13.026","0.003","16.554","0.004","90","","106.07","0.02","90","","2656","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis(2,4-dimethylbenzene)-2,3-dimethyl-1,4-diazabuta-1,3-diene]- fac-tricarbonyl(trifluoroacetato)rhenium(I)","","- C25 H24 F3 N2 O5 Re -","- C25 H24 F3 N2 O5 Re -","- C100 H96 F12 N8 O20 Re4 -","4","1","CF6407","Kia, Reza; Mirkhani, Valiollah; Deák, Andrea; Kálmán, Alajos","[<i>N</i>,<i>N</i>'-Bis(2,4-dimethylbenzene)-2,3-dimethyl-1,4-diazabuta-1,3-diene]-<i>fac</i>-tricarbonyl(trifluoroacetato)rhenium(I)","Acta Crystallographica Section E","2005","61","3","m566","m567","10.1107/S1600536805005003","","","0.71073","MoKα","","0.1059","0.0417","","","0.0785","0.0869","","","","","","0.924","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205232","19.191","0.005","7.719","0.002","12.64","0.003","90","","94.845","0.018","90","","1865.7","0.8","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-(2-chloro-1,4-dihydro-1,4-dioxonaphthalen-3-ylamino)-4-phenylthiazole-5- carboxylate","","- C22 H15 Cl N2 O4 S -","- C22 H15 Cl N2 O4 S -","- C88 H60 Cl4 N8 O16 S4 -","4","1","CF6409","Daniel E. Lynch; Ian McClenaghan","Ethyl 2-(2-chloro-1,4-dihydro-1,4-dioxonaphthalen-3-ylamino)-4-phenylthiazole-5-carboxylate","Acta Crystallographica Section E","2005","61","3","o790","o791","10.1107/S1600536805005647","","","0.71073","MoKα","","0.1162","0.0939","","","0.2312","0.2507","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205233","40.922","0.006","6.8025","0.0009","15.151","0.002","90","","90","0.002","90","","4217.6","1","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis(propane-1,2-diamine-κ^2^N,N')copper(II) terephthalate dihydrate","","- C14 H32 Cu N4 O8 -","- C14 H32 Cu N4 O8 -","- C112 H256 Cu8 N32 O64 -","8","1","CI6501","Lin, Zhi-Dong; Liu, Li-Ming; Lu, Jin-Yu; Meng, Xiang-Gao","Diaquabis(propane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')copper(II) terephthalate dihydrate","Acta Crystallographica Section E","2005","61","3","m590","m592","10.1107/S1600536805002977","","","0.71073","MoKα","","0.0569","0.0465","","","0.1319","0.1407","","","","","","1.096","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205234","10.2104","0.0014","12.1592","0.0016","13.9932","0.0019","66.705","0.002","70.878","0.002","70.7","0.002","1466.6","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-4-bromoisophthalato)bis[bis(1,10-phenanthroline)manganese(II)] tetrahydrate","","- C64 H46 Br2 Mn2 N8 O12 -","- C64 H46 Br2 Mn2 N8 O12 -","- C64 H46 Br2 Mn2 N8 O12 -","1","0.5","CI6516","Hong-Ping Xiao; Mao-Lin Hu; Ji-Xin Yuan","Bis(μ-4-bromoisophthalato)bis[bis(1,10-phenanthroline)manganese(II)] tetrahydrate","Acta Crystallographica Section E","2005","61","3","m443","m445","10.1107/S1600536805003004","","","0.71073","MoKα","","0.0985","0.0754","","","0.1429","0.1525","","","","","","1.203","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205235","4.877","0.003","8.104","0.006","11.832","0.007","105.6","0.07","91.87","0.07","102.17","0.07","438.3","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2-Methyl-7-oxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-3-ium chloride","","- C7 H9 Cl N4 O -","- C7 H9 Cl N4 O -","- C14 H18 Cl2 N8 O2 -","2","1","CI6518","Chernyshev, Ilya V.; Tursina, Anna I.","2-Methyl-7-oxo-5,6,7,8-tetrahydropyrimido[4,5-<i>d</i>]pyrimidin-3-ium chloride, a product of the thermal decomposition of nimustine hydrochloride (ACNU)","Acta Crystallographica Section E","2005","61","3","o544","o546","10.1107/S1600536805002874","","","0.71073","MoKα","","0.1478","0.0376","","","0.0662","0.0863","","","","","","0.969","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205236","8.398","0.003","8.68","0.003","13.558","0.004","93.725","0.005","91.749","0.004","106.977","0.004","942","0.5","571","2","571","2","","","","","","","","6","P -1","-P 1","2","","k^2^O-copper(II)","","- C38 H30 Cl2 Cu N10 O8 -","- C38 H30 Cl2 Cu N10 O8 -","- C38 H30 Cl2 Cu N10 O8 -","1","0.5","CI6521","Zhang, Shu-Ping; Liu, Zhao-Di; Ma, Ji-Long; Yang, Song; Shao, Si-Chang","<i>trans</i>-Bis[4-(4-methylphenyl)-3,5-di-2-pyridyl-4<i>H</i>-1,2,4-triazole]diperchlorato-κ^2^<i>O</i>-copper(II)","Acta Crystallographica Section E","2005","61","3","m423","m424","10.1107/S1600536805002540","","","0.71073","MoKα","","0.0631","0.0423","","","0.0968","0.11","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205237","7.374","0.002","7.707","0.002","10.928","0.003","83.34","0.004","82.215","0.004","63.269","0.003","548.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Benzyloxy-3-nitropyridine","","- C12 H10 N2 O3 -","- C12 H10 N2 O3 -","- C24 H20 N4 O6 -","2","1","CI6522","Cui, Yu; Liu, Hui-Min; Zhang, Wen-Qin","2-Benzyloxy-3-nitropyridine","Acta Crystallographica Section E","2005","61","3","o685","o686","10.1107/S1600536805004204","","","0.71073","MoKα","","0.0648","0.0401","","","0.1045","0.1127","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205238","12.598","0.003","13.021","0.003","13.652","0.003","116.04","0.03","101.84","0.03","106.21","0.03","1787.3","1.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","bis(2-oxidonaphthalene-1-carbaldehyde benzoylhydrazonato)vanadium(IV) dichloromethane hexane hemisolvate","","- C40 H33 Cl2 N4 O4 V -","- C40 H33 Cl2 N4 O4 V -","- C80 H66 Cl4 N8 O8 V2 -","2","1","CI6524","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","A trigonal prismatic coordination geometry for vanadium in bis(2-oxidonaphthalene-1-carbaldehyde benzoylhydrazonato)vanadium(IV) dichloromethane hexane hemisolvate","Acta Crystallographica Section E","2005","61","3","m519","m521","10.1107/S1600536805004174","","","0.71073","MoKα","","0.077","0.056","","","0.16","0.174","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205239","21.394","0.002","7.796","0.002","6.918","0.002","90","","93.7","0.02","90","","1151.4","0.5","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[(4-Fluorophenyl)methylenehydrazinocarbonyl]-1H-1,2,4-triazole monohydrate","","- C10 H10 F N5 O2 -","- C10 H10 F N5 O2 -","- C40 H40 F4 N20 O8 -","4","1","CI6525","Fu-You Pan; Jian-Guo Yang","3-[(4-Fluorophenyl)methylenehydrazinocarbonyl]-1<i>H</i>-1,2,4-triazole monohydrate","Acta Crystallographica Section E","2005","61","3","o712","o713","10.1107/S1600536805004162","","","0.71073","MoKα","","0.2202","0.0569","","","0.1315","0.1888","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205240","10.0183","0.0008","12.1239","0.001","13.4174","0.0011","91.415","0.002","101.451","0.002","112.473","0.001","1466.8","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(1-Benzoyl-1-phenylethyl)-3-phenylsulfanyl-1-phenylsulfonyl-1H-indole","","- C35 H27 N O3 S2 -","- C35 H27 N O3 S2 -","- C70 H54 N2 O6 S4 -","2","1","CI6526","Malathy Sony, S. M.; Palani, K.; Charles, P.; Ponnuswamy, M. N.; Sureshbabu, N.; Srinivasan, P. C.; Nethaji, M.","2-(1-Benzoyl-1-phenylethyl)-3-phenylsulfanyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","3","o578","o580","10.1107/S1600536805003569","","","0.71073","MoKα","","0.0851","0.0615","","","0.1518","0.1678","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205241","5.9532","0.0008","8.1287","0.0001","38.848","0.005","90","","90","","90","","1879.9","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Purpuriol","[6-(benzoyloxy)-1,4,5-trihydroxycyclohex-2-en-1-yl]methyl benzoate","","- C21 H20 O7 -","- C21 H20 O7 -","- C84 H80 O28 -","4","1","CI6527","Supattra Angchuan; Suchada Chantrapromma; Hoong-Kun Fun; Chatchanok Karalai","[6-(Benzoyloxy)-1,4,5-trihydroxycyclohex-2-en-1-yl]methyl benzoate","Acta Crystallographica Section E","2005","61","3","o699","o701","10.1107/S1600536805004575","","","0.71073","MoKα","","0.0627","0.0549","","","0.1176","0.1208","","","","","","1.201","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205242","9.4496","0.0004","9.4496","0.0004","15.3237","0.0004","90","","90","","120","","1185.01","0.08","110","2","110","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","Tris(biacetyl dihydrazone-κ^2^N,N')zinc(II) bis(perchlorate)","","- C12 H30 Cl2 N12 O8 Zn -","- C12 H30 Cl2 N12 O8 Zn -","- C24 H60 Cl4 N24 O16 Zn2 -","2","0.166667","CI6528","Helena Elengoz; Rinat Shoshnik; Israel Goldberg","Tris(biacetyl dihydrazone-κ^2^<i>N,N</i>')zinc(II) bis(perchlorate) at 110K","Acta Crystallographica Section E","2005","61","3","m538","m540","10.1107/S1600536805004757","","","0.71073","MoKα","","0.0512","0.0354","","","0.0814","0.0897","","","","","","0.982","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205243","9.5905","0.0007","9.5905","0.0007","15.2874","0.0008","90","","90","","120","","1217.72","0.14","110","2","110","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","Tris(biacetyl dihydrazone-κ^2^N,N')cadmium(II) bis(perchlorate) at 110 K","","?","- C12 H30 Cd Cl2 N12 O8 -","- C24 H60 Cd2 Cl4 N24 O16 -","2","0.166667","CI6529","Einat Tirosh; Rozi Maman; Israel Goldberg","Tris(biacetyl dihydrazone-κ^2^<i>N</i>,<i>N</i>')cadmium(II) bis(perchlorate) at 110K","Acta Crystallographica Section E","2005","61","3","m541","m542","10.1107/S1600536805004769","","","0.71073","MoKα","","0.0459","0.0324","","","0.0839","0.0904","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205244","9.066","0.0018","10.283","0.002","11.889","0.002","90","","99.07","0.03","90","","1094.5","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Phenyl-1-(propan-2-ylidene)thiosemicarbazide","","- C10 H13 N3 S -","- C10 H13 N3 S -","- C40 H52 N12 S4 -","4","1","CV6449","Fangfang Jian; Zhengshuai Bai; Hailian Xiao; Kai Li","4-Phenyl-1-(propan-2-ylidene)thiosemicarbazide","Acta Crystallographica Section E","2005","61","3","o653","o654","10.1107/S1600536805004320","","","0.71073","MoKα","","0.0482","0.0373","","","0.1105","0.1185","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205245","9.3365","0.0011","22.824","0.005","9.3508","0.0012","90","","98.629","0.008","90","","1970.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[(2,6-Diisopropylphenyl)iminomethyl]-2-naphthol","","- C23 H25 N O -","- C23 H25 N O -","- C92 H100 N4 O4 -","4","1","CV6451","Lin, Jin; Cui, Guang-Hua; Li, Jian-Rong; Xu, Shan-Sheng","3-{[(2,6-Diisopropylphenyl)imino]methyl}-2-naphthol","Acta Crystallographica Section E","2005","61","3","o627","o628","10.1107/S1600536805002035","","","0.71073","MoKα","","0.1176","0.0536","","","0.1332","0.1656","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205246","9.196","0.002","9.407","0.002","13.322","0.003","90","","90","","90","","1152.4","0.4","295","2","295","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","2,6-Diammonio-4-toluenesulfonate chloride dihydrate","","- C7 H15 Cl N2 O5 S -","- C7 H15 Cl N2 O5 S -","- C28 H60 Cl4 N8 O20 S4 -","4","0.5","CV6455","Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","2,6-Diammonio-4-toluenesulfonate chloride dihydrate","Acta Crystallographica Section E","2005","61","3","o612","o613","10.1107/S1600536805003922","","","0.71073","MoKα","","0.041","0.039","","","0.127","0.13","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205247","4.7521","0.0002","8.87","0.0004","13.1941","0.0006","73.916","0.002","81.771","0.002","74.706","0.002","513.98","0.04","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2,3,5,6-Tetramethylpyrazine‒p-nitrophenol (1/2)","","- C20 H22 N4 O6 -","- C20 H22 N4 O6 -","- C20 H22 N4 O6 -","1","0.5","CV6456","Xiao-Qing Cai; Mao-Lin Hu; Ya-Juan Zhao; Ya-Qian Cheng; Shun Wang","2,3,5,6-Tetramethylpyrazine‒<i>p</i>-nitrophenol (1/2)","Acta Crystallographica Section E","2005","61","3","o614","o615","10.1107/S160053680500382X","","","0.71073","MoKα","","0.0809","0.0767","","","0.1667","0.1696","","","","","","1.273","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205248","17.1636","0.0009","16.518","0.0009","14.6151","0.0008","90","","100.798","0.001","90","","4070.1","0.4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[diaqua(2-sulfonatobenzoato)nickel(II)]-μ-1,2-di-4- pyridylethylene] 0.25-hydrate]","","- C19 H18.5 N2 Ni O7.25 S -","- C19 H18 N2 Ni O7.25 S -","- C152 H144 N16 Ni8 O58 S8 -","8","1","CV6457","Xiao, Hong-Ping; Li, Xin-Hua; Hu, Mao-Lin","<i>catena</i>-Poly[[[diaqua(2-sulfonatobenzoato)nickel(II)]-μ-1,2-di-4-pyridylethylene] 0.25-hydrate]","Acta Crystallographica Section E","2005","61","3","m506","m508","10.1107/S1600536805003831","","","0.71073","MoKα","","0.0346","0.0315","","","0.0814","0.083","","","","","","1.03","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205249","8.9306","0.0011","10.0106","0.0012","14.4694","0.0017","90","","94.02","0.01","90","","1290.4","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-[(Methoxyglycyl)carbonyl]tetrathiafulvalene","","- C10 H9 N O3 S4 -","- C10 H9 N O3 S4 -","- C40 H36 N4 O12 S16 -","4","1","CV6459","Batsanov, Andrei S.; Viles, Sarah L.; Moore, Adrian J.","4-[(Methoxyglycyl)carbonyl]tetrathiafulvalene","Acta Crystallographica Section E","2005","61","3","o648","o650","10.1107/S160053680500396X","","","0.71073","MoKα","","0.0342","0.0277","","","0.0718","0.0754","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205250","7.5493","0.0008","9.786","0.001","13.148","0.001","69.753","0.001","80.542","0.001","71.34","0.001","861.85","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[(1,10-phenanthroline)lead(II)]-μ~5~-1,3-benzenedicarboxylato]","","- C20 H12 N2 O4 Pb -","- C20 H12 N2 O4 Pb -","- C40 H24 N4 O8 Pb2 -","2","1","CV6460","Wang, Hai-Dong; He, Hong-Yin; Wang, Yue-Jian; Zhu, Long-Guan; Ng, Seik Weng","Poly[[(1,10-phenanthroline)lead(II)]-μ~5~-1,3-benzenedicarboxylato]","Acta Crystallographica Section E","2005","61","3","m531","m532","10.1107/S1600536805004599","","","0.71073","MoKα","","0.034","0.028","","","0.056","0.059","","","","","","0.96","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205251","16.285","0.0004","11.6795","0.0003","10.7413","0.0003","90","","103.635","0.001","90","","1985.42","0.09","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-Bis(2-cyanoethylsulfanyl)-6,7-bis(methylsulfanyl)tetrathiafulvalene","","- C14 H14 N2 S8 -","- C14 H14 N2 S8 -","- C56 H56 N8 S32 -","4","1","CV6462","Bond, Andrew D.; Jeppesen, Jan O.","2,3-Bis(2-cyanoethylsulfanyl)-6,7-bis(methylsulfanyl)tetrathiafulvalene","Acta Crystallographica Section E","2005","61","3","o765","o766","10.1107/S1600536805005489","","","0.71073","MoKα","","0.0542","0.0328","","","0.0818","0.0865","","","","","","1.137","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205252","9.7162","0.0001","14.3502","0.0002","15.8887","0.0001","71.175","0.003","79.856","0.003","78.059","0.001","2037.12","0.05","273","1","273","1","","","","","","","","6","P -1","-P 1","2","","dichloro[(RS)-1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl- κN^4^)pentan-3-ol]copper(II) ethanol tetrasolvate","","- C72 H112 Cl6 Cu N12 O8 -","- C72 H112 Cl6 Cu N12 O8 -","- C72 H112 Cl6 Cu N12 O8 -","1","0.5","DN6189","Pei-Zhi Zhang; Jun Wu","A copper(II) complex of the fungicide tebuconazole","Acta Crystallographica Section E","2005","61","3","m560","m562","10.1107/S1600536805004939","","","0.71069","MoKα","","0.0778","0.0505","","","0.1081","0.1177","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205253","14.2339","0.0008","7.7622","0.0004","17.801","0.001","90","","110.94","0.001","90","","1836.87","0.17","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[[cis-diaqua(2,2'-bipyridine)copper(II)]-μ-3-carboxylato-4- hydroxybenzenesulfonato]","","- C17 H16 Cu N2 O8 S -","- C17 H16 Cu N2 O8 S -","- C68 H64 Cu4 N8 O32 S4 -","4","1","DN6199","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping; Ng, Seik Weng","Poly[[<i>cis</i>-diaqua(2,2'-bipyridine)copper(II)]-μ-3-carboxylato-4-hydroxybenzenesulfonato]","Acta Crystallographica Section E","2005","61","3","m509","m511","10.1107/S1600536805004022","","","0.71073","MoKα","","0.0566","0.0518","","","0.11","0.1122","","","","","","1.197","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205254","25.149","0.004","7.976","0.005","5.916","0.004","90","","90","","90","","1186.7","1.1","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","Phenyl p-toluenesulfonate","Phenyl 4-toluenesulfonate","","- C13 H12 O3 S -","- C13 H12 O3 S -","- C52 H48 O12 S4 -","4","1","ER6006","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Anthony Linden","Phenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions","Acta Crystallographica Section E","2005","61","3","o690","o692","10.1107/S1600536805001029","","","0.71069","MoKα","","0.0786","0.0669","","","0.1622","0.1767","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205255","8.418","0.003","11.517","0.005","15.363","0.006","90","","100.25","0.007","90","","1465.7","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Chloro[2-(2,2'-bipyridyl-6-yl)-5-methylphenyl]platinum(II)","","- C17 H13 Cl N2 Pt -","- C17 H13 Cl N2 Pt -","- C68 H52 Cl4 N8 Pt4 -","4","1","ER6007","Qian-Yong Cao; Wen-Fu Fu; Xi-Juan Zhao","Chloro[2-(2,2'-bipyridyl-6-yl)-5-methylphenyl]platinum(II)","Acta Crystallographica Section E","2005","61","3","m427","m429","10.1107/S1600536805002746","","","0.71073","MoKα","","0.0481","0.0324","","","0.074","0.0808","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205256","8.8693","0.001","9.3982","0.001","9.7112","0.001","70.446","0.004","71.335","0.004","81.831","0.008","722.12","0.14","120","","120","","","","","","","","","4","P -1","-P 1","2","α-naphthyl p-toluenesulfonate","1-naphthyl 4-toluenesulfonate","","- C17 H14 O3 S -","- C17 H14 O3 S -","- C34 H28 O6 S2 -","2","1","FL6137","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Frank R. Fronczek","1-Napthyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions","Acta Crystallographica Section E","2005","61","3","o528","o530","10.1107/S160053680500276X","","","0.71073","MoKα","","0.0439","0.0356","","","0.0879","0.0924","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205257","14.51","0.004","11.223","0.004","17.887","0.005","90","","113.53","0.02","90","","2670.6","1.5","100","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","fac-Tricarbonyl(2,9-dimethyl-1,10-phenanthroline)(2,6-dimethylphenyl isocyanide)rhenium(I) hexafluorophosphate","","- C26 H21 F6 N3 O3 P Re -","- C26 H21 F6 N3 O3 P Re -","- C104 H84 F24 N12 O12 P4 Re4 -","4","1","FL6138","John M. Villegas; Stanislav R. Stoyanov; Curtis E. Moore; David M. Eichhorn; D. Paul Rillema","<i>fac</i>-Tricarbonyl(2,9-dimethyl-1,10-phenanthroline)(2,6-dimethylphenyl isocyanide)rhenium(I) hexafluorophosphate","Acta Crystallographica Section E","2005","61","3","m533","m534","10.1107/S1600536805004678","","","0.71073","MoKα","","","0.0211","","","","0.0514","","","","","","1.089","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2205258","9.7378","0.001","10.579","0.0009","15.2761","0.0015","90","","90","","90","","1573.7","0.3","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","mepivacaine hydrochloride","(2R)-2-(2,6-dimethylphenylaminocarbonyl)-1-methylpiperidinium chloride","","- C15 H23 Cl N2 O -","- C15 H23 Cl N2 O -","- C60 H92 Cl4 N8 O4 -","4","1","FL6144","Bambagiotti Alberti, Massimo; Bruni, Bruno; Di Vaira, Massimo; Giannellini, Valerio","(<i>R</i>)-(‒)-Mepivacaine hydrochloride enantiomer: a low-temperature study","Acta Crystallographica Section E","2005","61","3","o585","o586","10.1107/S1600536805003363","","","1.5418","CuKα","","0.0243","0.0224","","","0.0465","0.0468","","","","","","0.956","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205259","19.382","0.008","5.303","0.002","8.492","0.003","90","","93.126","0.006","90","","871.5","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(R,S)-1,4-bis(benzylsulfinyl)butane","","- C18 H22 O2 S2 -","- C18 H22 O2 S2 -","- C36 H44 O4 S4 -","2","0.5","FL6145","Jian-Rong Li; Ruo-Hua Zhang; Xian-He Bu","(<i>R</i>,<i>S</i>)-1,4-Bis(benzylsulfinyl)butane","Acta Crystallographica Section E","2005","61","3","o581","o582","10.1107/S1600536805003351","","","0.71073","MoKα","","0.1232","0.0685","","","0.1481","0.1652","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205260","11.5181","0.0018","13.8876","0.0015","13.9889","0.001","93.532","0.007","95.868","0.009","109.014","0.009","2093.7","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Poly[[bis(triphenylphosphine)mercury(II)]-μ-thiocyanato-cadmium(II)- tri-μ-thiocyanato]","","- C40 H30 Cd Hg N4 P2 S4 -","- C40 H30 Cd Hg N4 P2 S4 -","- C80 H60 Cd2 Hg2 N8 P4 S8 -","2","1","FL6146","Wang, Xin Qiang; Yu, Wen Tao; Xu, Dong; Sun, Hai Qing","Poly[[bis(triphenylphosphine)mercury(II)]-μ-thiocyanato-cadmium(II)-tri-μ-thiocyanato]","Acta Crystallographica Section E","2005","61","3","m548","m550","10.1107/S160053680500468X","","","0.71073","MoKα","","0.0454","0.0343","","","0.0747","0.0791","","","","","","1.051","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205261","17.041","0.004","4.8657","0.001","11.656","0.003","90","","130.91","0.003","90","","730.4","0.3","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","threo-3,4-dihydroxyhexane-2,5-dione","","- C6 H10 O4 -","- C6 H10 O4 -","- C24 H40 O16 -","4","0.5","FL6147","Fang Sheng; Chao-Hong He; Xian-Hui Liang; Wei-Ke Su","<i>threo</i>-3,4-Dihydroxyhexane-2,5-dione","Acta Crystallographica Section E","2005","61","3","o788","o789","10.1107/S1600536805005556","","","0.71073","MoKα","","0.0535","0.0479","","","0.123","0.1284","","","","","","1.047","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205262","10.0955","0.0007","9.85","0.0006","13.3756","0.0008","90","","111.226","0.005","90","","1239.85","0.14","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Methyl-N'-(1-methylethylidene)imidazo[2,1-b][1,3]thiazole-5-carbohydrazide monohydrate","","- C10 H14 N4 O2 S -","- C10 H14 N4 O2 S -","- C40 H56 N16 O8 S4 -","4","1","FL6148","Mehmet Akkurt; Sema Öztürk Yıldırım; Fusun Ur; Zafer Cesur; Nesrin Cesur; Orhan Büyükgüngör","6-Methyl-<i>N</i>'-(1-methylethylidene)imidazo[2,1-<i>b</i>][1,3]thiazole-5-carbohydrazide monohydrate","Acta Crystallographica Section E","2005","61","3","o718","o720","10.1107/S160053680500509X","","","0.71073","MoKα","","0.0524","0.0391","","","0.0999","0.1074","","","","","","1.046","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205263","10.8447","0.0006","8.3527","0.0005","17.443","0.001","90","","96.257","0.001","90","","1570.62","0.16","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2,3,4-Tri-O-acetyl-β-L-fucopyranosyl azide","","- C12 H17 N3 O7 -","- C12 H17 N3 O7 -","- C48 H68 N12 O28 -","4","2","FL6149","Norris, Peter; Zeller, Matthias","2,3,4-Tri-<i>O</i>-acetyl-β-<small>L</small>-fucopyranosyl azide","Acta Crystallographica Section E","2005","61","3","o729","o730","10.1107/S1600536805005106","","","0.71073","MoKα","","0.0407","0.0386","","","0.1075","0.1096","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205264","24.541","0.005","11.537","0.002","14.897","0.003","90","","119.05","0.03","90","","3687.2","1.6","105","2","105","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Pentazocine HCl","2-Hydroxy-5,9-dimethyl-2-(3-methylbuten-2-yl)-6,7-benzomorphanium chloride","","- C19 H28 Cl N O -","- C19 H28 Cl N O -","- C152 H224 Cl8 N8 O8 -","8","1","GH6013","Arvid Mostad.","A second polymorphic form of pentazocine hydrochloride at 105K","Acta Crystallographica Section E","2005","61","3","o726","o728","10.1107/S1600536805004903","","","0.71073","MoKα","","0.0401","0.0356","","","0.0973","0.1023","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205265","6.143","0.001","25.34","0.005","7.483","0.001","90","","97.58","0.03","90","","1154.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Catena-poly [aqua dicinnamate cadmium-u-1,4-diazabicyclo[2.2.2]octane]","","- C24 H28 Cd N2 O5 -","- C24 H28 Cd N2 O5 -","- C48 H56 Cd2 N4 O10 -","2","0.5","HB6110","Qu, Yang; Liu, Zhao-Di; Zhu, Hai-Liang; Tan, Min-Yu","<i>catena</i>-Poly[[aquadicinnamatocadmium]-μ-1,4-diazabicyclo[2.2.2]octane]","Acta Crystallographica Section E","2005","61","3","m420","m422","10.1107/S1600536804034282","","","0.71073","MoKα","","0.0481","0.0436","","","0.1129","0.1158","","","","","","1.098","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205266","29.654","0.018","8.53","0.005","13.801","0.008","90","","95.829","0.01","90","","3473","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tris(pyridine-2-carboxylato-κ^2^0,N)cobalt(III) monohydrate","","- C18 H14 Co N3 O7 -","- C18 H14 Co N3 O7 -","- C144 H112 Co8 N24 O56 -","8","1","HB6144","Fu, Ai-Yun; Wang, Da-Qi","Tris(pyridine-2-carboxylato-κ^2^<i>O</i>,<i>N</i>)cobalt(III) monohydrate","Acta Crystallographica Section E","2005","61","3","m481","m482","10.1107/S160053680500317X","","","0.71073","MoKα","","0.0967","0.0501","","","0.0597","0.0656","","","","","","0.954","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205267","8.0529","0.0003","10.1125","0.0004","10.3508","0.0004","88.706","0.002","77.492","0.002","89.568","0.002","822.7","0.06","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","(4-tert-butylphenyl)phospha[1]ferrocenophane","","- C20 H21 Fe P -","- C20 H21 Fe P -","- C40 H42 Fe2 P2 -","2","1","HB6147","Cyr, Paul w.; Lough, Alan J.; Manners, Ian","(4-<i>tert</i>-Butylphenyl)phospha[1]ferrocenophane","Acta Crystallographica Section E","2005","61","3","m457","m459","10.1107/S1600536805003089","","","0.71073","MoKα","","0.0737","0.0626","","","0.1595","0.1654","","","","","","1.115","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205268","21.027","0.005","6.3196","0.0017","13.382","0.004","90","","102.354","0.016","90","","1737.1","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-poly[[aqua(nitrato-κ^2^O,O')copper(II)]-μ-pyrazine-2-carboxylato- κ^3^N^1^,O:N^4^]","","- C5 H5 Cu N3 O6 -","- C5 H5 Cu N3 O6 -","- C40 H40 Cu8 N24 O48 -","8","1","HB6148","Bo Zheng; Gang Liu; Lei Gou; Dao-Yong Wang; Huai-Ming Hu","A one-dimensional coordination polymer of copper(II) with 2-pyrazinecarboxylate","Acta Crystallographica Section E","2005","61","3","m499","m501","10.1107/S1600536805003788","","","0.71073","MoKα","","0.1006","0.0473","","","0.0957","0.1106","","","","","","0.813","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205269","21.645","0.008","14.15","0.01","16.48","0.01","90","","97.51","0.03","90","","5004","5","296","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","μ-Oxo-κ^2^O:O-bis[bis(1,10-phenanthroline-κ^2^N,N')(sulfato-κO)iron(III)] octahydrate","","- C48 H48 Fe2 N8 O17 S2 -","- C48 H48 Fe2 N8 O17 S2 -","- C192 H192 Fe8 N32 O68 S8 -","4","0.5","HB6149","Odoko, Mamiko; Okabe, Nobuo","μ-Oxo-κ^2^<i>O</i>:<i>O</i>-bis[bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ<i>O</i>)iron(III)] octahydrate","Acta Crystallographica Section E","2005","61","3","m587","m589","10.1107/S1600536805005660","","","0.7107","MoKα","","","0.0374","","","","0.1156","","","","","","1.119","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205270","9.3183","0.0007","10.073","0.0009","12.4423","0.0009","90","","90","","90","","1167.87","0.16","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Trirubidium cobalt tetrachloride nitrate(V), Rb~3~CoCl~4~NO~3~","","- Cl4 Co N O3 Rb3 -","- Cl4 Co N O3 Rb3 -","- Cl16 Co4 N4 O12 Rb12 -","4","0.5","HB6150","Ouarsal, Rachid; Lachkar, Mohammed; Bolte, Michael; El Bali, Brahim","Trirubidium cobalt tetrachloride nitrate(V), Rb~3~CoCl~4~NO~3~","Acta Crystallographica Section E","2005","61","3","i44","i45","10.1107/S1600536805004289","","","0.71073","MoKα","","0.0248","0.02","","","0.0416","0.0428","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205271","9.5936","0.0005","11.3569","0.0005","13.9792","0.0007","90","","108.023","0.001","90","","1448.35","0.12","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[N-methylpiperazinium(2+) [[bis(oxalato-κ^2^-O,O')zirconate(IV)]-μ~2~-oxalato-κ^4^O,O':O'',O''']]","","- C11 H14 N2 O12 Zr -","- C11 H14 N2 O12 Zr -","- C44 H56 N8 O48 Zr4 -","4","1","HB6152","Fu, Yun-Long; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[<i>N</i>-methylpiperazinium(2+) [[bis(oxalato-κ^2^<i>O</i>,<i>O</i>')zirconate(IV)]-μ~2~-oxalato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']]","Acta Crystallographica Section E","2005","61","3","m491","m493","10.1107/S1600536805003806","","","0.71073","MoKα","","0.021","0.019","","","0.053","0.054","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205272","9.58","0.002","13.416","0.002","10.743","0.002","90","","90","","90","","1380.7","0.4","295","","295","","","","","","","","","7","I b a m","-I 2 2c","72","","catena-poly[[[bis(ethylenediamine)platinum(II)]-μ-chloro- [bis(ethylenediamine)platinum(IV)]-μ-chloro] tetrakis(tetrafluoroborate)]","","- C8 H32 B4 Cl2 F16 N8 Pt2 -","- C8 H32 B4 Cl2 F16 N8 Pt2 -","- C16 H64 B8 Cl4 F32 N16 Pt4 -","2","0.125","HB6153","Matsushita, Nobuyuki","A one-dimensional Cl-bridged Pt^II^/Pt^IV^ mixed-valence complex, <i>catena</i>-poly[[[bis(ethylenediamine)platinum(II)]-μ-chloro-[bis(ethylenediamine)platinum(IV)]-μ-chloro] tetrakis(tetrafluoroborate)]","Acta Crystallographica Section E","2005","61","3","m514","m516","10.1107/S1600536805004113","","","0.71069","MoKα","","0.0474","0.0263","","","0.0609","0.0678","","","","","","1.068","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205273","8.975","0.0001","20.4196","0.0003","21.9152","0.0004","90","","90","","90","","4016.31","0.1","105","2","105","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Disodium cytidine-5'-monophosphate 6.07-hydrate methanol 0.27-solvate","","- C9.25 H22 N3 Na2 O14.38 P -","- C9.273 H21.8958 N3 Na2 O14.3799 P -","- C74.184 H175.166 N24 Na16 O115.039 P8 -","8","2","HB6154","Gonzalez, Susana Villa; Larsen, Kristofer; Nelson, William H.; Sagstuen, Einar; Görbitz, Carl Henrik","Disodium cytidine-5'-monophosphate 6.07-hydrate methanol 0.27-solvate","Acta Crystallographica Section E","2005","61","3","m554","m556","10.1107/S160053680500471X","","","0.71073","MoKα","","0.0369","0.0343","","","0.091","0.0924","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205274","8.824","0.002","8.824","0.002","27.733","0.01","90","","90","","90","","2159.4","1","293","2","293","2","","","","","","","","3","P 43","P 4cw","78","avicennin B","3,4-Dihydro-8-hydroxy-3,5-dimethyl-7-methoxyisocoumarin","","- C12 H14 O4 -","- C12 H14 O4 -","- C96 H112 O32 -","8","2","HG6126","Jun, Wang; Hua-Rong Huang; Xiao-Long Feng; Yong-Cheng Lin; Shi-Ning Zhou","3,4-Dihydro-8-hydroxy-3,5-dimethyl-7-methoxyisocoumarin (avicennin B)","Acta Crystallographica Section E","2005","61","3","o784","o785","10.1107/S1600536805002771","","","0.71073","MoKα","","0.0487","0.0381","","","0.1038","0.1107","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205275","14.1367","0.0012","7.9021","0.0008","16.8034","0.0016","90","","104.907","0.003","90","","1813.9","0.3","180","2","180","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","N,N-bis(2-pyridiniomethyl)glycine diperchlorate","","- C14 H17 Cl2 N3 O10 -","- C14 H17 Cl2 N3 O10 -","- C56 H68 Cl8 N12 O40 -","4","1","HG6129","Nielsen, Anne; Bond, Andrew D.; McKenzie, Christine J.","<i>N,N</i>-Bis(2-pyridiniomethyl)glycine diperchlorate","Acta Crystallographica Section E","2005","61","3","o516","o517","10.1107/S1600536805002503","","","0.71073","MoKα","","0.0854","0.0531","","","0.1267","0.143","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205276","7.836","0.001","8.228","0.001","14.046","0.002","90","","94.106","0.002","90","","903.3","0.2","158","2","158","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-bromo-2-chloroindan-1-one","","- C9 H6 Br Cl O -","- C9 H6 Br Cl O -","- C36 H24 Br4 Cl4 O4 -","4","1","HG6134","Yu, Pen-Shao; Thomas, Gareth D.; Blackman, Allan G.; Tan, Eng Wui","<i>trans</i>-3-Bromo-2-chloroindan-1-one","Acta Crystallographica Section E","2005","61","3","o651","o652","10.1107/S1600536805004150","","","0.71069","MoKα","","0.0378","0.0349","","","0.0918","0.0937","","","","","","1.132","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205277","11.1168","0.0003","14.2464","0.0003","11.8709","0.0003","90","","92.113","0.001","90","","1878.77","0.08","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H26 N3 O -","- C22 H26 N3 O -","- C88 H104 N12 O4 -","4","2","HG6137","Qing Yuan; Shan-Zhong Jian; Yan-Guang Wang","4-(9-Acridin-9-ylamino)-2,2,6,6-tetramethylpiperidine <i>N</i>-oxide","Acta Crystallographica Section E","2005","61","3","o565","o566","10.1107/S1600536805003375","","","0.71073","MoKα","","","0.0443","","","","0.1197","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205278","13.119","0.002","13.314","0.002","14.918","0.003","98.917","0.004","90.842","0.004","110.201","0.004","2409.3","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","ttt-(PPh3)2Cl2(CNbz)2Ru(II)","trans-trans-trans-(Dibenzylisocyanide-κC)dichlorobis(triphenylphosphine- κP)ruthenium(II) dichloromethane hemisolvate","","- C53 H46 Cl4 N2 P2 Ru -","- C53 H46 Cl4 N2 P2 Ru -","- C106 H92 Cl8 N4 P4 Ru2 -","2","1","HG6141","Look, Jennifer L.; Horwood, Owen P. M.; Levendis, Demetrius C.; Coville, Neil J.","<i>trans</i>-<i>trans</i>-<i>trans</i>-Bis(benzyl isocyanide-κ<i>C</i>)dichlorobis(triphenylphosphine-κ<i>P</i>)ruthenium(II) dichloromethane solvate","Acta Crystallographica Section E","2005","61","3","m606","m608","10.1107/S1600536805005052","","","0.71073","MoKα","","0.1004","0.0502","","","0.1121","0.1318","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205279","11.398","0.004","18.283","0.006","11.659","0.004","90","","115.69","0.005","90","","2189.5","1.3","190","2","190","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[lithium(I)-μ-1-tert-butyl-3-(3-pyridyl)-N,N'-bis(trimethylsilyl) propane-1,3-diiminato]","","- C18 H32 Li N3 Si2 -","- C18 H32 Li N3 Si2 -","- C72 H128 Li4 N12 Si8 -","4","1","HG6142","Xia Chen; Li Wang; Jian-Ping Guo; Shu-Ping Huang; Dian-Sheng Liu","<i>catena</i>-Poly[lithium(I)-μ-1-<i>tert</i>-butyl-3-(3-pyridyl)-<i>N</i>,<i>N</i>'-bis(trimethylsilyl)propane-1,3-diiminato]","Acta Crystallographica Section E","2005","61","3","m574","m576","10.1107/S1600536805005210","","","0.71073","MoKα","","0.118","0.0545","","","0.0593","0.0654","","","","","","0.838","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205280","10.05","0.003","16.492","0.005","10.737","0.005","90","","101.94","0.02","90","","1741.1","1.1","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 2-methyl-5-oxo-4-(2-thienyl)-1,5,7,8,9,10-hexahydro-4H- pyrido[2',3':3,4]pyrrolo[1,2-a][1,3]diazepine-3-carboxylate","","- C18 H19 N3 O3 S -","- C18 H19 N3 O3 S -","- C72 H76 N12 O12 S4 -","4","1","HG6144","Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Svoboda, Ingrid","Methyl 2-methyl-5-oxo-4-(2-thienyl)-1,5,7,8,9,10-hexahydro-4<i>H</i>-pyrido[2',3':3,4]pyrrolo[1,2-<i>a</i>][1,3]diazepine-3-carboxylate","Acta Crystallographica Section E","2005","61","3","o733","o735","10.1107/S1600536805005209","","","0.71069","MoKα","","0.0849","0.058","","","0.167","0.1905","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205281","5.3155","0.0014","8.108","0.002","11.737","0.003","90","","90.196","0.01","90","","505.8","0.2","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","meso-1,2-bis(pyridin-2-yl)-ethane-1,2-diol","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C24 H24 N4 O4 -","2","0.5","HG6145","Bjernemose, Jens K.; Bond, Andrew D.","<i>meso</i>-1,2-Bis(pyridin-2-yl)ethane-1,2-diol","Acta Crystallographica Section E","2005","61","3","o741","o742","10.1107/S1600536805005222","","","0.71073","MoKα","","0.0724","0.0588","","","0.1381","0.1473","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205282","7.321","0.002","8.234","0.002","8.354","0.002","62.05","0.03","65.34","0.03","74.04","0.03","402.3","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","3-Ammonio-4-methoxybenzenesulfonate","","- C7 H9 N O4 S -","- C7 H9 N O4 S -","- C14 H18 N2 O8 S2 -","2","1","IS6043","Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","3-Ammonio-4-methoxybenzenesulfonate","Acta Crystallographica Section E","2005","61","3","o539","o540","10.1107/S160053680500293X","","","0.71073","MoKα","","0.03","0.028","","","0.083","0.084","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205283","20.792","0.003","8.247","0.001","15.097","0.002","90","","111.778","0.002","90","","2403.9","0.6","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-[(4-Hydroxy-3-methoxyphenyl)methylene]-2,4-pentanedione","","- C13 H14 O4 -","- C13 H14 O4 -","- C104 H112 O32 -","8","1","IS6044","Pei, Li-Xia; Bu, Xian-Zhang; Gu, Lian-Quan; Ng, Seik Weng","3-[(4-Hydroxy-3-methoxyphenyl)methylene]-2,4-pentanedione","Acta Crystallographica Section E","2005","61","3","o541","o543","10.1107/S1600536805002941","","","0.71073","MoKα","","0.052","0.041","","","0.126","0.137","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205284","25.342","0.005","44.671","0.005","5.7889","0.0009","90","","90","","90","","6553.3","1.8","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","tetrakis[(4-bromobenzyloxy)methyl]methane","","- C33 H32 Br4 O4 -","- C33 H32 Br4 O4 -","- C264 H256 Br32 O32 -","8","0.5","IS6045","Laliberté, Dominic; Raymond, Nathalie; Maris, Thierry; Wuest, James D.","Pentaerythrityl tetrakis(4-bromobenzyl ether)","Acta Crystallographica Section E","2005","61","3","o601","o603","10.1107/S160053680500351X","","","1.54178","CuKα","","0.0569","0.0547","","","0.1631","0.1653","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205285","8.9105","0.0007","9.0601","0.0007","10.5488","0.0008","66.158","0.001","68.752","0.001","88.391","0.001","718.94","0.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[tetrapyridinecopper(II)]-μ~2~-naphthalene-1,5-disulfonato]","","- C30 H26 Cu N4 O6 S2 -","- C30 H26 Cu N4 O6 S2 -","- C30 H26 Cu N4 O6 S2 -","1","0.5","IS6047","Gao, Shan; Huo, Li-Hua; Zhu, Zhi-Bao; Ng, Seik Weng","<i>catena</i>-Poly[[tetrapyridinecopper(II)]-μ~2~-naphthalene-1,5-disulfonato]","Acta Crystallographica Section E","2005","61","3","m476","m477","10.1107/S1600536805003156","","","0.71073","MoKα","","0.055","0.047","","","0.128","0.133","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205286","12.2223","0.0018","15.017","0.002","11.3182","0.0016","90","","92.026","0.003","90","","2076.1","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2,2'-bipyridine)nickel(II)]-μ-4,4'-oxydibenzoato]","","- C24 H16 N2 Ni O5 -","- C24 H16 N2 Ni O5 -","- C96 H64 N8 Ni4 O20 -","4","1","IS6048","Hong-Ping Xiao; Ya-Qian Cheng; Xin-Hua Li","<i>catena</i>-Poly[[(2,2'-bipyridine)nickel(II)]-μ-4,4'-oxydibenzoato]","Acta Crystallographica Section E","2005","61","3","m469","m470","10.1107/S1600536805003405","","","0.71073","MoKα","","0.061","0.0463","","","0.0921","0.0976","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205287","12.3571","0.0011","12.6397","0.0012","15.3369","0.0012","67.286","0.003","89.668","0.003","75.133","0.002","2124","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Tris(phenanthroline-κ^2^N,N')nickel(II) dibromosuccinate pentahydrate","","- C40 H40 Br2 N6 Ni O11 -","- C40 H40 Br2 N6 Ni O11 -","- C80 H80 Br4 N12 Ni2 O22 -","2","1","IS6049","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","Tris(phenanthroline-κ^2^<i>N,N</i>')nickel(II) dibromosuccinate heptahydrate","Acta Crystallographica Section E","2005","61","3","m471","m473","10.1107/S1600536805003399","","","0.71073","MoKα","","0.079","0.052","","","0.12","0.133","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205288","8.1208","0.0017","11.307","0.004","13.022","0.003","83.58","0.02","82.954","0.019","79.53","0.02","1162","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Azido(2,2'-bipyridine)(η^5^-pentamethylcyclopentadienyl)iridium(III) hexafluorophosphate","","- C20 H23 F6 Ir N5 P -","- C20 H23 F6 Ir N5 P -","- C40 H46 F12 Ir2 N10 P2 -","2","1","IS6050","Suzuki, Takayoshi","Azido(2,2'-bipyridine)(η^5^-pentamethylcyclopentadienyl)iridium(III) hexafluorophosphate","Acta Crystallographica Section E","2005","61","3","m488","m490","10.1107/S1600536805003727","","","0.71069","MoKα","","0.0674","0.0493","","","0.1263","0.1381","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205289","10.0156","0.0002","12.0767","0.0002","20.6483","0.0005","90","","90","","90","","2497.52","0.09","260","2","260","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","3,5-dinitrobenzoic acid DMSO solvate","3,5-dinitrobenzoic acid‒dimethyl sulfoxide (1/1)","","- C9 H10 N2 O7 S -","- C9 H10 N2 O7 S -","- C72 H80 N16 O56 S8 -","8","1","JH6000","Abthorpe, M.; Trask, A. V.; Jones, W.","3,5-Dinitrobenzoic acid‒dimethyl sulfoxide (1/1)","Acta Crystallographica Section E","2005","61","3","o609","o611","10.1107/S1600536805003818","","","0.71073","MoKα","","0.0666","0.0454","","","0.1201","0.134","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205290","12.6986","0.0008","12.5724","0.0006","18.9151","0.001","90","","95.635","0.004","90","","3005.2","0.3","150","","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","4-Chloro-3-(2,3,5-trimethylphenoxy)phthalonitrile","","- C17 H13 Cl N2 O -","- C17 H13 Cl N2 O -","- C136 H104 Cl8 N16 O8 -","8","2","KP6035","Yazıcı, Serap; Akdemir, Nesuhi; Ağar, Erbil; Kantar, Cihan; Şenel, İsmet","4-Chloro-3-(2,3,5-trimethylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","3","o782","o783","10.1107/S1600536805003193","","","0.71073","MoKα","","0.053","0.0416","","","0.1128","0.1163","","","","","","1.051","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205291","11.784","0.002","14.838","0.003","29.143","0.006","90","","93.26","0.03","90","","5087.4","1.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Heptaammonium disodium decatungstolanthanate hexadecahydrate","","- H60 La N7 Na2 O52 W10 -","- La N7 Na2 O52 W10 -","- La4 N28 Na8 O208 W40 -","4","0.5","KP6036","Almeida Paz, Filipe A.; Balula, Maria Salete S.; Cavaleiro, Ana M. V.; Klinowski, Jacek; Nogueira, Helena I. S.","A lanthanum(III) complex with a lacunary polyoxotungstate: Na~2~(NH~4~)~7~[La(W~5~O~18~)~2~]·16H~2~O","Acta Crystallographica Section E","2005","61","3","i28","i31","10.1107/S1600536805003557","","","0.71073","MoKα","","0.0367","0.031","","","0.0781","0.0812","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205292","9.0002","0.0005","15.0542","0.0007","27.4541","0.0014","90","","90","","90","","3719.8","0.3","105","2","105","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-Asparaginyl-L-valine","","- C9 H19.67 N3 O5.33 -","- C9 H19.6667 N3 O5.33333 -","- C108 H236 N36 O64 -","12","3","KP6037","Hanne Therese Bonge; Marianne Lenes Rosenberg; Marit Riktor; Görbitz, Carl Henrik","<small>L</small>-Asparaginyl-<small>L</small>-valine 1.33-hydrate","Acta Crystallographica Section E","2005","61","3","o524","o527","10.1107/S1600536805001868","","","0.71073","MoKα","","0.0406","0.0317","","","0.0816","0.0862","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205293","9.537","0.001","9.95","0.001","11.363","0.001","94.156","0.002","107.839","0.002","113.535","0.002","917.31","0.16","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[[(2,2'-bipyridine)copper(II)]-hemi(μ~2~-2-nitroterephthalato)hemi(μ~4~- 2-nitroterephthalato)] monohydrate]","","- C18 H13 Cu N3 O7 -","- C18 H13 Cu N3 O7 -","- C36 H26 Cu2 N6 O14 -","2","1","KP6038","Ma, Ai-Qing; Zhu, Long-Guan; Ng, Seik Weng","Poly[[[(2,2'-bipyridine)copper(II)]-hemi-μ~2~-2-nitroterephthalato-hemi-μ~4~-2-nitroterephthalato] monohydrate]","Acta Crystallographica Section E","2005","61","3","m483","m484","10.1107/S1600536805003466","","","0.71073","MoKα","","0.0802","0.0518","","","0.0995","0.1083","","","","","","0.905","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205294","9.2495","0.0009","10.0013","0.001","17.2359","0.0016","90","","90","","90","","1594.4","0.3","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Methyl 4-O-benzyl-6-deoxy-2,3-O-isopropylidene-α-L-talopyranoside","","- C17 H24 O5 -","- C17 H24 O5 -","- C68 H96 O20 -","4","1","KP6039","Maust, Mathew T.; Norris, Peter; Zeller, Matthias","Methyl 4-<i>O</i>-benzyl-6-deoxy-2,3-<i>O</i>-isopropylidene-α-<small>L</small>-talopyranoside","Acta Crystallographica Section E","2005","61","3","o643","o644","10.1107/S1600536805003600","","","0.71073","MoKα","","0.0398","0.039","","","0.0979","0.0987","","","","","","1.15","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205295","6.808","0.002","18.77","0.009","8.256","0.003","90","","105.84","0.03","90","","1014.9","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5,6,7,8-tetrahydro-4aH-thieno[3,2-b]quinolizin-4(10H)-one","","- C11 H13 N O S -","- C11 H13 N O S -","- C44 H52 N4 O4 S4 -","4","1","KP6040","Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Žák, Zdirad","5,6,7,8-Tetrahydro-4a<i>H</i>-thieno[3,2-<i>b</i>]quinolizin-4(10<i>H</i>)-one","Acta Crystallographica Section E","2005","61","3","o573","o574","10.1107/S1600536805003454","","","0.71073","MoKα","","0.0524","0.0374","","","0.1026","0.1137","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205296","10.259","0.002","8.775","0.002","21.813","0.004","90","","101.93","0.03","90","","1921.3","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[[triaquabarium(II)]-di-μ~3~-3-carboxybenzenesulfonato]","","- C14 H16 Ba O13 S2 -","- C14 H16 Ba O13 S2 -","- C56 H64 Ba4 O52 S8 -","4","1","KP6042","Gao, Shan; Zhu, Zhi-Biao; Huo, Li-Hua; Ng, Seik Weng","Polymeric triaquabis(μ~3~-3-carboxybenzenesulfonato)barium(II)","Acta Crystallographica Section E","2005","61","3","m517","m518","10.1107/S1600536805004265","","","0.71073","MoKα","","0.019","0.017","","","0.046","0.046","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205297","22.274","0.004","5.715","0.001","10.443","0.002","90","","92.56","0.03","90","","1328","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","poly[[diaquabarium(II)]-μ~6~-1,5-naphthalenedisulfonato]","","- C10 H10 Ba O8 S2 -","- C10 H10 Ba O8 S2 -","- C40 H40 Ba4 O32 S8 -","4","0.5","KP6043","Gao, Shan; Zhu, Zhi-Biao; Huo, Li-Hua; Ng, Seik Weng","Polymeric diaqua(μ~6~-1,5-naphthalenedisulfonato)barium(II)","Acta Crystallographica Section E","2005","61","3","m528","m530","10.1107/S1600536805004514","","","0.71073","MoKα","","0.027","0.027","","","0.065","0.065","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205298","6.5692","0.0014","12.365","0.003","13.878","0.003","67.312","0.004","80.447","0.004","86.74","0.004","1025.6","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]- 5-[(4-dimethylaminobenzylidene)amino]-1H-pyrazole-3-carbonitrile","","- C20 H14 Cl2 F3 N5 -","- C20 H14 Cl2 F3 N5 -","- C40 H28 Cl4 F6 N10 -","2","1","KP6044","Chen, Dimei; Yang, Zhiping; Zhong, Ping; Hu, Maolin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-dimethylaminobenzylidene)amino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","3","o702","o703","10.1107/S1600536805004654","","","0.71073","MoKα","","0.0774","0.0659","","","0.176","0.1858","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205299","8.5222","0.0008","10.6245","0.0007","12.3742","0.0012","90","","93.697","0.011","90","","1118.08","0.17","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","tris(1,2-dimethoxyethane-κ^2^O,O')diiodostrontium(II)","","- C12 H30 I2 O6 Sr -","- C12 H30 I2 O6 Sr -","- C24 H60 I4 O12 Sr2 -","2","1","LH6326","Weber, Frank; Wolmershäuser, Gotthelf; Sitzmann, Helmut","The tris(dimethoxyethane) adduct of strontium iodide","Acta Crystallographica Section E","2005","61","3","m512","m513","10.1107/S1600536804031617","","","0.71073","MoKα","","0.0436","0.0374","","","0.0888","0.0917","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205300","8.901","0.001","10.506","0.0012","14.5942","0.0015","92.522","0.009","104.923","0.008","106.33","0.008","1255.5","0.3","296","","296","","","","","","","","","4","P -1","-P 1","2","","5-(4-Methoxybenzoyl)-4-(4-methoxyphenyl)-1-[1-(4- methoxyphenyl)ethylideneamino]pyrimidin-2(1H)-one","","- C28 H25 N3 O5 -","- C28 H25 N3 O5 -","- C56 H50 N6 O10 -","2","1","LH6345","Özçelik, Suzan; Dinçer, Muharrem; Sarıpınar, Emin; Yılmaz, Çiğdem","5-(4-Methoxybenzoyl)-4-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)ethylideneamino]pyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","3","o622","o624","10.1107/S1600536805003703","","","0.71073","MoKα","","0.0851","0.0405","","","0.0798","0.0889","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205301","16.097","0.002","3.7144","0.0005","21.725","0.002","90","","110.758","0.007","90","","1214.6","0.3","93.2","","","","","","","","","","","4","P 1 2/a 1","-P 2ya","13","","","","- C16 H10 N4 O2 -","- C16 H10 N4 O2 -","- C64 H40 N16 O8 -","4","1","LH6350","Imoda, Tomohiko; Hirota, Tsuyoshi; Takahashi, Hiroo; Mizuguchi, Jin","3,6-Di-2-pyridylpyrrolo[3,4-<i>c</i>]pyrrole-1,4(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","3","o616","o618","10.1107/S1600536805002126","","","1.5418","CuKα","","","0.0913","","","","0.3457","","","","","","1.905","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205302","28.723","0.015","7.269","0.005","26.824","0.009","90","","123.61","0.03","90","","4664","5","225","2","225","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Tetrakis(4-carboxyphenyl)methane‒dimethyl sulfoxide‒toluene (1/4/1)","4,4',4'',4'''-methanetetrayltetracarboxylic acid‒dimethyl sulfoxide‒toluene (1/4/1)","","- C44 H52 O12 S4 -","- C44 H52 O12 S4 -","- C176 H208 O48 S16 -","4","0.5","LH6355","Nadia Malek; Thierry Maris; Michel Simard; James D. Wuest","Tetrakis(4-carboxyphenyl)methane‒dimethyl sulfoxide‒toluene (1/4/1)","Acta Crystallographica Section E","2005","61","3","o518","o520","10.1107/S1600536805002485","","","1.54178","CuKα","","0.079","0.0657","","","0.182","0.1903","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205303","8.111","0.003","12.999","0.007","16.256","0.005","90","","100.76","0.03","90","","1683.8","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1RS,2SR,7RS,8RS)-N-Benzoyltricyclo[6.2.2.0^2,7^]dodeca-9,11-diene-1,10- dicarboximide","","- C21 H19 N O3 -","- C21 H19 N O3 -","- C84 H76 N4 O12 -","4","1","LH6356","McSweeney, Nigel; Pratt, Albert C.; Long, Conor; Howie, R. Alan","(1<i>RS</i>,2<i>S</i><i>R</i>,7<i>RS</i>,8<i>RS</i>)-<i>N</i>-Benzoyltricyclo[6.2.2.0^2,7^]dodeca-9,11-diene-1,10-dicarboximide","Acta Crystallographica Section E","2005","61","3","o547","o549","10.1107/S1600536805002758","","","0.71073","MoKα","","0.1699","0.0876","","","0.1637","0.1922","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205304","18.725","0.004","19.623","0.004","15.647","0.003","90","","113.82","0.01","90","","5259.6","1.9","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Aqua{2-[(E)-(3,5-dibromo-2-oxidophenyl)methyleneamino]ethanesulfonato- κ^3^O,N,O'}(1,10-phenanthroline-κ^2^N,N')nickel(II) ethanol solvate","","- C23 H23 Br2 N3 Ni O6 S -","- C23 H23 Br2 N3 Ni O6 S -","- C184 H184 Br16 N24 Ni8 O48 S8 -","8","1","LH6357","Shu-Hua Zhang; Yi-Min Jiang; L. Zheng; Kai-Bei Yu","Aqua{2-[(<i>E</i>)-(3,5-dibromo-2-oxidophenyl)methyleneamino]ethanesulfonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II) ethanol solvate","Acta Crystallographica Section E","2005","61","3","m446","m448","10.1107/S1600536805003119","","","0.71073","MoKα","","0.114","0.0442","","","0.0838","0.0933","","","","","","0.801","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205305","8.453","0.0015","8.656","0.0012","10.7923","0.0012","105.221","0.01","98.919","0.012","116.4","0.013","647.9","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","(3-Mesyl-4-methoxyphenyl)glyoxylic acid methyl ester","Methyl [4-methoxy-3-(methylsulfonyloxy)benzoyl]formate","","- C11 H12 O7 S -","- C11 H12 O7 S -","- C22 H24 O14 S2 -","2","1","LH6359","Schollmeyer, Dieter; Christian Peifer; Gerd Dannhardt","Methyl [4-methoxy-3-(methylsulfonyloxy)benzoyl]formate","Acta Crystallographica Section E","2005","61","3","o583","o584","10.1107/S1600536805003478","","","1.54178","CuKα","","0.0461","0.0442","","","0.1226","0.1244","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205306","14.0827","0.0017","17.674","0.003","7.2238","0.0004","90","","90","","90","","1798","0.4","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4-(3-hydroxy-4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-2,5-dihydro- 1H-pyrrole-2,5-dione","","- C20 H19 N O7 -","- C20 H19 N O7 -","- C80 H76 N4 O28 -","4","1","LH6360","Schollmeyer, Dieter; Christian Peifer; Gerd Dannhardt","4-(3-Hydroxy-4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1<i>H</i>-pyrrole-2,5-dione","Acta Crystallographica Section E","2005","61","3","o604","o606","10.1107/S1600536805003685","","","1.54178","CuKα","","0.0624","0.0513","","","0.1352","0.1452","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205307","18.8196","0.0007","18.4938","0.0008","13.5023","0.0006","90","","90","","90","","4699.4","0.3","180","2","180","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","Acetato(methanol)[N-phenyl-N,N-bis(2-pyridylmethyl)amine]copper(II) hexafluorophosphate","","- C21 H24 Cu F6 N3 O3 P -","- C21 H24 Cu F6 N3 O3 P -","- C168 H192 Cu8 F48 N24 O24 P8 -","8","1","LH6362","Nielsen, Anne; Bond, Andrew D.; McKenzie, Christine J.","Acetato(methanol)[<i>N</i>-phenyl-<i>N,N</i>-bis(2-pyridylmethyl)amine]copper(II) hexafluorophosphate","Acta Crystallographica Section E","2005","61","3","m478","m480","10.1107/S160053680500348X","","","0.71073","MoKα","","0.0565","0.04","","","0.1132","0.1196","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205308","7.259","0.0006","25.872","0.003","7.425","0.0015","90","","90","","90","","1394.5","0.3","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","Terpyridine Dioxide Dihydrate","2,2':6',2''-Terpyridine 1,1''-dioxide dihydrate","","- C15 H15 N3 O4 -","- C15 H15 N3 O4 -","- C60 H60 N12 O16 -","4","0.5","LH6363","Wheeler, Kraig A.; McKay, Scott E.; Lashlee III, Robert W.","2,2':6',2''-Terpyridine 1,1''-dioxide dihydrate","Acta Crystallographica Section E","2005","61","3","o645","o647","10.1107/S1600536805003855","","","0.71073","MoKα","","0.0856","0.052","","","0.1335","0.1559","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205309","14.059","0.003","16.336","0.002","7.356","0.003","90","","90","","90","","1689.4","0.8","295","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Methyl (2,3,4-tetra-O-acetyl-β-D-glucopyranosyl azide)uronate","Methyl 2,3,4-tetra-O-acetyl-1-azido-1-deoxy-β-D-glucopyranuronate","","- C13 H17 N3 O9 -","- C13 H17 N3 O9 -","- C52 H68 N12 O36 -","4","1","LH6365","Brendon L. Wilkinson; Laurent F. Bornaghi; Todd A. Houston; Sally-Ann Poulsen; Peter C. Healy","Methyl 2,3,4-tri-<i>O</i>-acetyl-1-azido-1-deoxy-β-<small>D</small>-glucopyranuronate at room temperature","Acta Crystallographica Section E","2005","61","3","o738","o740","10.1107/S1600536805004381","","","0.7107","MoKα","","0.1009","0.0405","","","0.1021","0.1239","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205310","11.6984","0.0002","13.0662","0.0002","13.941","0.0003","111.507","0.0009","90.647","0.0009","115.49","0.0009","1752.94","0.06","160","1","160","1","","","","","","","","6","P -1","-P 1","2","","Chloro{μ-2-[(E)-1-(2-oxido-3- methylphenyl)ethylideneamino]acetato}pentaphenylditin(IV)","","- C41 H36 Cl N O3 Sn2 -","- C41 H36 Cl N O3 Sn2 -","- C82 H72 Cl2 N2 O6 Sn4 -","2","1","LH6366","Linden, Anthony; Basu Baul, Tushar S.; Masharing, Cheerfulman","Chloro{μ-2-[(<i>E</i>)-1-(2-oxido-3-methylphenyl)ethylideneamino]acetato}pentaphenylditin(IV)","Acta Crystallographica Section E","2005","61","3","m557","m559","10.1107/S1600536805004666","","","0.71073","MoKα","","0.062","0.0445","","","0.1074","0.1132","","","","","","1.199","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205311","16.4538","0.0019","5.3346","0.0005","17.952","0.002","90","","114.709","0.009","90","","1431.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[2-(5-Ethylpyridin-2-yl)ethoxy]benzaldehyde oxime","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C64 H72 N8 O8 -","4","1","LH6368","Gaonkar, Santhosh L.; Yathirajan, Hemmige S.; Lokanatharai, Kuriya M.; Nagaraj, Basavegowda; Bolte, Michael","4-[2-(5-Ethylpyridin-2-yl)ethoxy]benzaldehyde oxime","Acta Crystallographica Section E","2005","61","3","o751","o752","10.1107/S1600536805005192","","","0.71073","MoKα","","0.0651","0.0491","","","0.1203","0.1287","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205312","18.0117","0.0005","20.208","0.0006","12.8156","0.0005","90","","90","","90","","4664.6","0.3","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Bis(1,1,1,5,5,5-hexafluoroacetylacetonato-κ^2^O,O')bis(tetrahydrofuran- κN)iron(II)","","- C18 H18 F12 Fe O6 -","- C18 H18 F12 Fe O6 -","- C144 H144 F96 Fe8 O48 -","8","2","LH6396","Preuss, Kathryn E.; Wu, Jian; Jennings, Michael, C.","Bis(1,1,1,5,5,5-hexafluoroacetylacetonato-κ^2^<i>O,O</i>')bis(tetrahydrofuran-κ<i>N</i>)iron(II)","Acta Crystallographica Section E","2005","61","3","m430","m432","10.1107/S1600536805002734","","","0.71073","MoKα","","0.0656","0.0435","","","0.1014","0.1125","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205313","8.6677","0.001","18.5082","0.0018","8.9746","0.001","90","","111.95","0.009","90","","1335.4","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(2-Bromo-4,5-dimethoxybenzyl)thiazolidine-2,4-dione","","- C12 H12 Br N O4 S -","- C12 H12 Br N O4 S -","- C48 H48 Br4 N4 O16 S4 -","4","1","NC6020","Yathirajan, Hemmige S.; Gaonkar, Santhosh L.; Lokanatha Rai, Kuriya M.; Bolte, Michael","3-(2-Bromo-4,5-dimethoxybenzyl)thiazolidine-2,4-dione","Acta Crystallographica Section E","2005","61","3","o655","o656","10.1107/S1600536805004137","","","0.71073","MoKα","","0.037","0.0319","","","0.0759","0.0776","","","","","","1.158","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205314","10.4244","0.001","15.9819","0.0016","6.0919","0.0007","90","","90","","90","","1014.92","0.18","173","2","173","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Di-tert-butylphosphine oxide","","- C8 H19 O P -","- C8 H19 O P -","- C32 H76 O4 P4 -","4","0.5","NC6021","Dornhaus, Franz; Lerner, Hans-Wolfram; Bolte, Michael","Di-<i>tert</i>-butylphosphine oxide","Acta Crystallographica Section E","2005","61","3","o657","o658","10.1107/S1600536805004332","","","0.71073","MoKα","","0.0429","0.0386","","","0.1102","0.114","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205315","7.6974","0.0006","7.8682","0.0006","19.1907","0.0016","79.823","0.006","84.248","0.007","64.22","0.006","1029.77","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","4'-[2-Butyl-4-chloro-5-(hydroxyiminomethyl)-1H-imidazol-3-ylmethyl]biphenyl- 2-carbonitrile","","- C22 H21 Cl N4 O -","- C22 H21 Cl N4 O -","- C44 H42 Cl2 N8 O2 -","2","1","NC6022","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Narasegowda, Rajenahally S.; Bolte, Michael","4'-[2-Butyl-4-chloro-5-(hydroxyiminomethyl)-1<i>H</i>-imidazol-3-ylmethyl]biphenyl-2-carbonitrile","Acta Crystallographica Section E","2005","61","3","o714","o715","10.1107/S1600536805004988","","","0.71073","MoKα","","0.047","0.0429","","","0.1024","0.1052","","","","","","1.118","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205316","7.2545","0.001","7.2018","0.0009","7.7886","0.0013","90","","97.819","0.012","90","","403.14","0.1","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","Nipecotic acid hydrochloride","3-carboxypiperidinium chloride","","- C6 H12 Cl N O2 -","- C6 H12 Cl N O2 -","- C12 H24 Cl2 N2 O4 -","2","1","NC6023","Narasegowda, Rajenahally S.; Yathirajan, Hemmige S.; Bolte, Michael","Nipecotic acid hydrochloride","Acta Crystallographica Section E","2005","61","3","o763","o764","10.1107/S1600536805005337","","","0.71073","MoKα","","0.0225","0.0221","","","0.057","0.0573","","","","","","1.103","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205317","10.615","0.0006","14.914","0.0005","17.3961","0.0009","90","","102.263","0.004","90","","2691.2","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-[4'-(Bromomethyl)biphenyl-2-yl]-2-trityl-2H-tetrazole","","- C33 H25 Br N4 -","- C33 H25 Br N4 -","- C132 H100 Br4 N16 -","4","1","NC6024","Nagaraj, Basavegowda; Narasegowda, Rajenahally S.; Yathirajan, Hemmige S.; Gaonkar, Santhosh L.; Bolte, Michael","5-[4'-(Bromomethyl)biphenyl-2-yl]-2-trityl-2<i>H</i>-tetrazole","Acta Crystallographica Section E","2005","61","3","o767","o768","10.1107/S1600536805005490","","","0.71073","MoKα","","0.0543","0.0443","","","0.0979","0.1023","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205318","9.2861","0.0011","9.5829","0.0012","18.438","0.003","90","","90.75","0.004","90","","1640.6","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Nitrato-κO)(1,10-phenanthroline-κ^2^N,N')(picolinato N-oxide- κ^2^O,O')copper(II)","","- C18 H12 Cu N4 O6 -","- C18 H12 Cu N4 O6 -","- C72 H48 Cu4 N16 O24 -","4","1","NG6094","Lei Gou; Xiong-Wei Qu; Bo Zheng; Dao-Yong Wang; Huai-Ming Hu","(Nitrato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N,N</i>')(picolinato <i>N</i>-oxide-κ^2^<i>O,O</i>')copper(II)","Acta Crystallographica Section E","2005","61","3","m441","m442","10.1107/S1600536805002515","","","0.71073","MoKα","","0.0499","0.0339","","","0.0756","0.0786","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205319","13.237","0.003","6.6598","0.0013","9.6849","0.0019","90","","92.27","0.03","90","","853.1","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquazinc(II) naphthalene-1,5-disulfonate'","","- C10 H18 O12 S2 Zn -","- C10 H18 O12 S2 Zn -","- C20 H36 O24 S4 Zn2 -","2","0.5","NG6100","Huo, Li-Hua; Gao, Shan; Xu, Shixiao; Zhao, Hui","Hexaaquazinc(II) naphthalene-1,5-disulfonate","Acta Crystallographica Section E","2005","61","3","m449","m450","10.1107/S1600536805003120","","","0.71073","MoKα","","0.0238","0.0222","","","0.0605","0.0615","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205320","10.58","0.003","11.356","0.003","11.492","0.003","116.06","0.02","100.32","0.02","104.936","0.014","1128.4","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[bis(1H-benzimidazole-κN^3^)zinc(II)]-μ-3-carboxyphenoxyacetato- κ^2^O:O']","","- C23 H18 N4 O5 Zn -","- C23 H18 N4 O5 Zn -","- C46 H36 N8 O10 Zn2 -","2","1","NG6101","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Gu, Chang-Sheng","<i>catena</i>-Poly[[bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)zinc(II)]-μ-3-carboxyphenoxyacetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","3","m494","m495","10.1107/S1600536805003661","","","0.71073","MoKα","","0.1082","0.0604","","","0.1321","0.1512","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205321","9.5043","0.0019","9.812","0.002","11.584","0.002","70.73","0.03","67.49","0.03","83.26","0.03","942","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[aqua(1,10-phenanthroline-κ^2^N,N')cobalt(II)]-μ-4- carboxyphenoxyacetato-κ^3^O,O':O'']","","- C21 H16 Co N2 O6 -","- C21 H16 Co N2 O6 -","- C42 H32 Co2 N4 O12 -","2","1","NG6102","Gao, Shan; Huo, Li-Hua; Gu, Chang-Sheng; Liu, Ji-Wei; Zhao, Jing-Gui","<i>catena</i>-Poly[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ-4-carboxyphenoxyacetato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>'']","Acta Crystallographica Section E","2005","61","3","m496","m498","10.1107/S1600536805003673","","","0.71073","MoKα","","0.0612","0.0514","","","0.1297","0.136","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205322","7.8331","0.0013","8.2205","0.0014","12.894","0.002","88.237","0.004","83.013","0.004","79.382","0.003","810","0.2","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","Bis(pyridinium) tetrabromocobaltate(II)","","- C10 H12 Br4 Co N2 -","- C10 H12 Br4 Co N2 -","- C20 H24 Br8 Co2 N4 -","2","1","NG6109","Zhang, Hui; Fang, Liang; Yuan, Runzhang","Bis(pyridinium) tetrabromocobaltate(II)","Acta Crystallographica Section E","2005","61","3","m609","m610","10.1107/S1600536805005714","","","0.71073","MoKα","","0.1284","0.0609","","","0.1218","0.1574","","","","","","0.993","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205323","9.9141","0.0002","43.1674","0.0008","15.7682","0.0003","90","","104.67","0.0005","90","","6528.3","0.2","473.2","","200","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C60.5 H57 Cl Ir4 Mo4 O16 S -","- C60.5 H57 Cl Ir4 Mo4 O16 S -","- C242 H228 Cl4 Ir16 Mo16 O64 S4 -","4","1","OB6455","Lucas, Nigel T.; Humphrey, Mark G.; Willis, Anthony C.","[μ~8~-η^4^-2,5-Bis(oct-1-ynyl)thiophene]bis[octacarbonylbis(η^5^-methylcyclopentadienyl)-<i>tetrahedro</i>-diiridiumdimolybdenum] dichloromethane hemisolvate","Acta Crystallographica Section E","2005","61","3","m463","m464","10.1107/S160053680500214X","","","0.7107","MoKα","","0.0378","0.0263","","0.0365","","0.0337","","","0.97","","","1","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205324","23.26","0.002","13.872","0.002","15.182","0.003","90","","93.79","0.04","90","","4888","1.3","298","2","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C44 H44 Mn2 N8 Ni O6 -","- C44 H40 Mn2 N8 Ni O6 -","- C176 H160 Mn8 N32 Ni4 O24 -","4","2","OB6463","Akitsu, Takashiro; Takeuchi, Yuiri; Einaga, Yasuaki","(<i>SP</i>-4-1)-Bis{aqua[(1<i>R</i>,2<i>R</i>)-<i>N</i>,<i>N</i>'-bis(salicylidene)cyclohexane-1,2-diamine-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']manganese(III)}-di-μ-cyano-κ^4^<i>N</i>:<i>C</i>-[dicyanonickel(II)]","Acta Crystallographica Section E","2005","61","3","m502","m505","10.1107/S160053680500379X","","","0.7107","MoKα","","","0.0913","","","","0.2896","","","","","","1.065","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205325","8.1127","0.0007","10.9405","0.0009","13.9263","0.0011","77.147","0.007","83.542","0.007","76.749","0.007","1170.54","0.17","296","","296","","","","","","","","","4","P -1","-P 1","2","","5-(4-Methoxybenzoyl)-4-(4-methoxyphenyl)1-[1-(4- methoxyphenyl)ethylidenenamino]pyrimidin-2(1H)-one","","- C27 H23 N3 O5 -","- C27 H23 N3 O5 -","- C54 H46 N6 O10 -","2","1","OB6471","Özçelik, Suzan; Dinçer, Muharrem; Sarıpınar, Emin; Yılmaz, Çiğdem","5-(4-Methoxybenzoyl)-4-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)ethylidenenamino]pyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","3","o637","o638","10.1107/S1600536805004149","","","0.71073","MoKα","","0.0843","0.051","","","0.1283","0.1431","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205326","32.394","0.004","21.167","0.003","13.013","0.0015","90","","93.467","0.002","90","","8906","2","288","2","288","2","","","","","","","","6","C 1 c 1","C -2yc","9","","Tris{trans-4-[p-(N,N-diethylamino)styryl]-N-methylpyridinium} dodecatungstophosphate","","- C54 H69 N6 O40 P W12 -","- C54 H69 N6 O40 P W12 -","- C216 H276 N24 O160 P4 W48 -","4","1","OB6472","Xuejie Tan; Sixiu Sun; Shu-Lian Liu; Jian-Ping Ma; Dian-Xiang Xing","Tris{<i>trans</i>-4-[<i>p</i>-(<i>N</i>,<i>N</i>-diethylamino)styryl]-<i>N</i>-methylpyridinium} dodecatungstophosphate","Acta Crystallographica Section E","2005","61","3","m437","m440","10.1107/S1600536805002928","","","0.71073","MoKα","","0.102","0.0779","","","0.194","0.2137","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205327","8.711","0.002","18.005","0.003","12.5175","0.0018","90","","107.66","0.02","90","","1870.7","0.6","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-{3-[(E)-(3,4-Dimethoxyphenyl)ethenyl]-5,5-dimethylcyclohex-2- enylidene}malononitrile","","- C21 H22 N2 O2 -","- C21 H22 N2 O2 -","- C84 H88 N8 O8 -","4","1","OB6473","Tsonko Kolev; Denitsa Yancheva; Boris Shivachev; Rosica Petrova; Michael Spiteller","2-{3-[(<i>E</i>)-(3,4-Dimethoxyphenyl)ethenyl]-5,5-dimethylcyclohex-2-enylidene}malononitrile","Acta Crystallographica Section E","2005","61","3","o550","o552","10.1107/S1600536805003016","","","0.71073","MoKα","","0.1885","0.0579","","","0.0945","0.1242","","","","","","0.964","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205328","9.986","0.003","11.682","0.003","12.222","0.004","117.17","0.02","103.69","0.02","92.56","0.02","1213","0.7","93.2","","","","","","","","","","","3","P -1","-P 1","2","","1,4:8,11:15,18:22,25-Tetraethano-29H,31H-tetrabenzo[b,g,l,q]porphine toluene trisolvate","","- C65 H62 N4 -","- C65 H62 N4 -","- C65 H62 N4 -","1","0.5","OB6474","Aramaki, Shinji; Sakai, Yoshimasa; Yanagisawa, Hiroyuki; Mizuguchi, Jin","1,4:8,11:15,18:22,25-Tetraethano-29<i>H</i>,31<i>H</i>-tetrabenzo[<i>b</i>,<i>g</i>,<i>l</i>,<i>q</i>]porphine toluene trisolvate","Acta Crystallographica Section E","2005","61","3","o659","o661","10.1107/S1600536805004228","","","1.5418","CuKα","","","0.0734","","","","0.1974","","","","","","1.259","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205329","7.8042","0.0011","7.3159","0.0011","21.753","0.003","90","","90","","90","","1242","0.3","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","1,3-Bis(pyrimidin-2-ylsulfanyl)propan-2-one","","- C11 H10 N4 O S2 -","- C11 H10 N4 O S2 -","- C44 H40 N16 O4 S8 -","4","0.5","OB6475","Wu, Ben-Lai; Lou, Ben-Yong; Han, Lei; Hong, Mao-Chun","1,3-Bis(pyrimidin-2-ylsulfanyl)propan-2-one","Acta Crystallographica Section E","2005","61","3","o594","o595","10.1107/S1600536805003715","","","0.71073","MoKα","","0.0944","0.0615","","","0.0949","0.1062","","","","","","1.151","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2205330","4.903","0.006","29.26","0.04","13.96","0.02","90","","97.65","0.06","90","","1985","5","93.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H40 N4 O6 -","- C52 H40 N4 O6 -","- C104 H80 N8 O12 -","2","0.5","OB6476","Hino, Kazuyuki; Mizuguchi, Jin","<i>N</i>,<i>N</i>'-Bis[2-(4-pyridyl)ethyl]perylene-3,4:9,10-bis(dicarboximide) <i>m</i>-cresol disolvate","Acta Crystallographica Section E","2005","61","3","o672","o674","10.1107/S1600536805004447","","","1.5419","CuKα","","","0.1003","","","","0.1183","","","","","","0.995","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205331","42.071","0.001","8.6042","0.0001","19.9088","0.0001","90","","96.096","0.002","90","","7165.98","0.19","296.2","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Chloro(4,7-diphenyl-1,10-phenanthroline)(2,2':6',2''-terpyridine)ruthenium(II) hexafluorophosphate","","- C39 H27 Cl F6 N5 P Ru -","- C39 H27 Cl F6 N5 P Ru -","- C312 H216 Cl8 F48 N40 P8 Ru8 -","8","1","OB6477","Naokazu Yoshikawa; Nobuko Kanehisa; Yasushi Kai; Hiroshi Takashima; Keiichi Tsukahara","Chloro(4,7-diphenyl-1,10-phenanthroline)(2,2':6',2''-terpyridine)ruthenium(II) hexafluorophosphate","Acta Crystallographica Section E","2005","61","3","m545","m547","10.1107/S1600536805004691","","","0.7107","MoKα","","","0.083","","","","0.2008","","","","","","1.738","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205332","6.6461","0.0005","14.2172","0.001","14.9057","0.001","90","","100.261","0.001","90","","1385.9","0.17","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-[(2-Chloro-5-phenyl-3-pyridinyl)(hydroxy)methyl]acrylonitrile","","- C15 H11 Cl N2 O -","- C15 H11 Cl N2 O -","- C60 H44 Cl4 N8 O4 -","4","1","OB6479","G. Y. S. K. Swamy; K. Ravikumar; P. Narender; V. Jayathirtha Rao","2-[(2-Chloro-5-phenyl-3-pyridinyl)(hydroxy)methyl]acrylonitrile","Acta Crystallographica Section E","2005","61","3","o706","o707","10.1107/S1600536805004551","","","0.71073","MoKα","","0.0454","0.0404","","","0.1144","0.1189","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205333","12.5354","0.0007","12.6028","0.0007","14.312","0.0008","90","","90","","90","","2261","0.2","273","2","273","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","2-[(2-Chloro-5-ethyl-3-pyridinyl)(hydroxy)methyl]acrylonitrile","","- C11 H11 Cl N2 O -","- C11 H11 Cl N2 O -","- C88 H88 Cl8 N16 O8 -","8","1","OB6480","G. Y. S. K. Swamy; K. Ravikumar; P. Narender; V. Jayathirtha Rao","2-[(2-Chloro-5-ethyl-3-pyridinyl)(hydroxy)methyl]acrylonitrile","Acta Crystallographica Section E","2005","61","3","o708","o709","10.1107/S1600536805004563","","","0.71073","MoKα","","0.0464","0.0409","","","0.1219","0.1271","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205334","6.513","0.002","12.182","0.002","12.2","0.002","89.36","0.01","81.11","0.01","76.81","0.02","930.8","0.4","93.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C50 H36 N4 O6 -","- C50 H36 N4 O6 -","- C50 H36 N4 O6 -","1","0.5","OB6481","Mizuguchi, Jin; Hino, Kazuyuki","<i>N,N</i>'-Bis[2-(4-pyridyl)ethyl]perylene-3,4:9,10-bis(dicarboximide) phenol disolvate","Acta Crystallographica Section E","2005","61","3","o669","o671","10.1107/S1600536805004459","","","1.5418","CuKα","","","0.0389","","","","0.0984","","","","","","0.782","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205335","10.282","0.002","17.433","0.003","11.664","0.002","90","","106.51","0.01","90","","2004.5","0.6","93.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H40 Cl6 N4 -","- C46 H40 Cl6 N4 -","- C92 H80 Cl12 N8 -","2","0.5","OB6482","Aramaki, Shinji; Sakai, Yoshimasa; Yanagisawa, Hiroyuki; Senju, Takatoshi; Mizuguchi, Jin","(1<i>RS</i>,4<i>S</i><i>R</i>,8<i>S</i><i>R</i>,11<i>RS</i>,15<i>S</i><i>R</i>,18<i>RS</i>,22<i>RS</i>,25<i>S</i><i>R</i>)-1,4:8,11:15,18:22,25-Tetraethano-29<i>H</i>,31<i>H</i>-tetrabenzo[<i>b,g,l,q</i>]porphine chloroform disolvate","Acta Crystallographica Section E","2005","61","3","o675","o677","10.1107/S1600536805004435","","","1.5418","CuKα","","","0.125","","","","0.311","","","","","","1.324","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205336","13.436","0.004","8.811","0.002","13.924","0.004","90","","102.03","0.004","90","","1612.2","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","mer-Bis(diethylenetriamine)zinc(II) dichloride monohydrate","","- C8 H28 Cl2 N6 O Zn -","- C8 H28 Cl2 N6 O Zn -","- C32 H112 Cl8 N24 O4 Zn4 -","4","1","OB6483","Liu, Bing; Huo, Fang-Jun; Jiang, Xiao-Ming; Yang, Bing-Sheng","<i>mer</i>-Bis(diethylenetriamine)zinc(II) dichloride monohydrate","Acta Crystallographica Section E","2005","61","3","m598","m600","10.1107/S160053680500560X","","","0.71073","MoKα","","0.0598","0.0412","","","0.0764","0.0812","","","","","","0.954","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205337","14.425","0.001","7.6138","0.0005","18.129","0.001","90","","111.776","0.001","90","","1849","0.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[cis-diaqua(2,2'-bipyridine)cobalt(II)]-μ-3-carboxylato-4- hydroxybenzenesulfonato]","","- C17 H16 Co N2 O8 S -","- C17 H16 Co N2 O8 S -","- C68 H64 Co4 N8 O32 S4 -","4","1","OM6227","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping; Ng, Seik Weng","<i>catena</i>-Poly[[<i>cis</i>-diaqua(2,2'-bipyridine)cobalt(II)]-μ-3-carboxylato-4-hydroxybenzenesulfonato]","Acta Crystallographica Section E","2005","61","3","m435","m436","10.1107/S1600536805002904","","","0.71073","MoKα","","0.074","0.072","","","0.167","0.168","","","","","","1.34","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205338","12.008","0.003","25.192","0.006","7.0192","0.0012","90","","90","","90","","2123.3","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","16β-Bromo-17α-hydroxypregn-4-ene-3,20-dione methanol solvate","","- C22 H33 Br O4 -","- C22 H33 Br O4 -","- C88 H132 Br4 O16 -","4","1","RN6036","Shi Wang; Yongli Wang; Qiang Nie; Aishuang Xiang; Lina Zhou","16β-Bromo-17α-hydroxypregn-4-ene-3,20-dione methanol solvate","Acta Crystallographica Section E","2005","61","3","o563","o564","10.1107/S1600536805002813","","","0.71073","MoKα","","0.0905","0.0662","","","0.1754","0.1922","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205339","6.893","0.001","7.078","0.001","24.754","0.005","96.41","0.03","90.83","0.03","108.49","0.03","1136.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[]tetraaqua(3-carboxy-4-hydroxybenzenesulfonato)strontium(II)]- μ~3~-3-carboxy-4-hydroxybenzenesulfonato] dihydrate]","","- C14 H22 O18 S2 Sr -","- C14 H22 O18 S2 Sr -","- C28 H44 O36 S4 Sr2 -","2","1","RN6039","Dao-Li An; Shan Gao; Li-Hua Huo; Jian-Rong Li","<i>catena</i>-Poly[[[tetraaqua(3-carboxy-4-hydroxybenzenesulfonato)strontium(II)]-μ~3~-3-carboxy-4-hydroxybenzenesulfonato] dihydrate]","Acta Crystallographica Section E","2005","61","3","m417","m419","10.1107/S1600536805002801","","","0.71073","MoKα","","0.0358","0.0275","","","0.0595","0.0619","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205340","8.1951","0.0019","8.762","0.002","10.619","0.003","82.472","0.003","77.181","0.003","79.873","0.003","728.5","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(2,5-di-3-pyridyl-1,3,4-oxadiazole)dithiocyanatomanganese(II)","","- C26 H20 Mn N10 O6 S2 -","- C26 H20 Mn N10 O4 S2 -","- C26 H20 Mn N10 O4 S2 -","1","0.5","RN6041","Miao Du; Xiu-Juan Jiang; Xiao-Jun Zhao","Diaquabis(2,5-di-3-pyridyl-1,3,4-oxadiazole)dithiocyanatomanganese(II): a three-dimensional supramolecular network formed through O—H···N and C—H···S interactions","Acta Crystallographica Section E","2005","61","3","m485","m487","10.1107/S1600536805003764","","","0.71073","MoKα","","0.0462","0.0346","","","0.0925","0.099","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205341","6.1468","0.0013","11.261","0.002","12.9983","0.0007","114.775","0.01","92.134","0.011","100.408","0.01","797","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","tert-Butyl 4-[2-(methoxycarbonyl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate","","- C15 H23 N O4 -","- C15 H23 N O4 -","- C30 H46 N2 O8 -","2","1","RN6042","Ramos Silva, Manuela; Matos Beja, Ana; Paixao, Jose Antonio; Lopes, Susana H.; Cabral, Ana M. T. D. P. V.; Rocha Gonsalves, A. M. d'A.; Sobral, Abilio J. F. N.","<i>tert</i>-Butyl 4-[2-(methoxycarbonyl)ethyl]-3,5-dimethyl-1<i>H</i>-pyrrole-2-carboxylate","Acta Crystallographica Section E","2005","61","3","o575","o577","10.1107/S1600536805003533","","","0.71073","MoKα","","0.0519","0.043","","","0.1199","0.1295","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205342","6.106","0.002","9.293","0.003","11.58","0.004","101.875","0.008","97.89","0.006","98.59","0.008","626.2","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Tetramethylpyrazine‒endo-norbornene-cis-5,6-dicarboxylic acid (1/2)","","- C13 H16 N O4 -","- C13 H16 N O4 -","- C26 H32 N2 O8 -","2","1","RN6043","Mao-Lin Hu; Zhi-Min Jin; Ya-Juan Zhao; Di-Mei Chen; Shun Wang; Xiao-Qing Cai","Tetramethylpyrazine‒<i>endo</i>-norbornene-<i>cis</i>-5,6-dicarboxylic acid (1/2)","Acta Crystallographica Section E","2005","61","3","o731","o732","10.1107/S1600536805005283","","","0.71073","MoKα","","0.1489","0.0962","","","0.2598","0.3261","","","","","","1.217","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205343","12.838","0.007","16.25","0.009","17.221","0.009","90","","102.376","0.011","90","","3509","3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C38 H54 O5 -","- C38 H54 O5 -","- C152 H216 O20 -","4","1","RZ6032","Zhi-Yun Du; Yu-Fang Wang; Xue-Pu Mao; Jiang-Ke Qin; Wei Qiao; Lin Ma; Lian-Quan Gu","(2<i>E</i>,6<i>E</i>)-2,6-Bis(3,5-di-<i>tert</i>-butyl-4-hydroxybenzylidene)cyclohexanone acetic acid solvate","Acta Crystallographica Section E","2005","61","3","o587","o588","10.1107/S1600536804034208","","","0.71073","MoKα","","0.0743","0.0509","","","0.136","0.1553","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205344","5.9991","0.0015","10.052","0.003","12.161","0.003","81.391","0.004","76.933","0.004","81.214","0.004","700.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-(2-Benzoyl-4-chlorophenyl)-2-chloroacetamide","","- C15 H11 Cl2 N O2 -","- C15 H11 Cl2 N O2 -","- C30 H22 Cl4 N2 O4 -","2","1","RZ6038","Malathy Sony, S. M.; Charles, P.; Ponnuswamy, M. N.; Nethaji, M.","<i>N</i>-(2-Benzoyl-4-chlorophenyl)-2-chloroacetamide","Acta Crystallographica Section E","2005","61","3","o632","o634","10.1107/S1600536805002291","","","0.71073","MoKα","","0.0884","0.0633","","","0.147","0.16","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205345","17.16","0.009","11.68","0.006","18.274","0.01","90","","90","","90","","3663","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-Benzyl-2-methyl-1-phenylsulfonyl-1H-indole","","- C22 H19 N O2 S -","- C22 H19 N O2 S -","- C176 H152 N8 O16 S8 -","8","1","RZ6040","S. M. Malathy Sony; K. Palani; P. Charles; M. N. Ponnuswamy; N. Sureshbabu; P. C. Srinivasan; M. Nethaji","3-Benzyl-2-methyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","3","o521","o523","10.1107/S1600536805002825","","","0.71073","MoKα","","0.0542","0.0448","","","0.1332","0.1426","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205346","13.669","0.007","11.392","0.006","18.315","0.009","90","","92.697","0.007","90","","2849","3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl 4-(4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C14 H16 N2 O4 -","- C14 H16 N2 O4 -","- C112 H128 N16 O32 -","8","1","RZ6041","Ming Li; Wei-Si Guo; Li-Rong Wen; Wen-Ying Qi","Ethyl 4-(4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2005","61","3","o531","o533","10.1107/S1600536805002837","","","0.71073","MoKα","","0.058","0.0426","","","0.1233","0.1336","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205347","8.425","0.0017","12.577","0.003","13.945","0.003","90","","90","","90","","1477.6","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Diisothiocyanatobis(2-methyl-1H-imidazole)cobalt(II)","","- C10 H12 Co N6 S2 -","- C10 H12 Co N6 S2 -","- C40 H48 Co4 N24 S8 -","4","0.5","RZ6042","Faqian Liu; Fangfang Jian; Lude Lu; Xujie Yang; Xin Wang; Hailian Xiao","Diisothiocyanatobis(2-methyl-1<i>H</i>-imidazole)cobalt(II)","Acta Crystallographica Section E","2005","61","3","m425","m426","10.1107/S1600536805002849","","","0.71073","MoKα","","0.042","0.0356","","","0.0988","0.1027","","","","","","1.093","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205348","13.3031","0.0006","8.9874","0.0004","17.7551","0.0009","90","","106.408","0.001","90","","2036.35","0.17","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chloro[N,N'-dimethyl-N,N'-bis(2-pyridylmethyl)ethane-1,2-diamine] oxovanadium(IV) perchlorate","","- C16 H22 Cl2 N4 O5 V -","- C16 H22 Cl2 N4 O5 V -","- C64 H88 Cl8 N16 O20 V4 -","4","1","RZ6044","Egdal, Rune Kirk; Bond, Andrew D.; McKenzie, Christine J.","Chloro[<i>N</i>,<i>N</i>'-dimethyl-<i>N</i>,<i>N</i>'-bis(2-pyridylmethyl)ethane-1,2-diamine]oxovanadium(IV) perchlorate","Acta Crystallographica Section E","2005","61","3","m412","m413","10.1107/S1600536805002692","","","0.71073","MoKα","","0.0578","0.0398","","","0.0975","0.1018","","","","","","0.936","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205349","18.1505","0.001","17.3369","0.001","14.5209","0.0008","90","","95.054","0.001","90","","4551.6","0.4","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","scandenin","4-hydroxy-3-(4-hydroxyphenyl)-5-methoxy-8,8-dimethyl-6-(3-methyl-2-butenyl)- 2H,8H-pyrano[2,3f]chromen-2-one","","- C26 H26 O6 -","- C26 H26 O6 -","- C208 H208 O48 -","8","2","RZ6045","K. Ravikumar; B. Sridhar; A. Sridhar Rao; J. Madhusudana Rao","Scandenin","Acta Crystallographica Section E","2005","61","3","o596","o598","10.1107/S1600536805003594","","","0.71073","MoKα","","0.0617","0.0468","","","0.1263","0.1385","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205350","16.151","0.002","11.9923","0.0014","18.094","0.002","90","","109.261","0.002","90","","3308.4","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(4-Methylbenzoyl)-N-phenyl-2-(1H-1,2,4-triazol-1-yl)ethanethioamide","","- C18 H16 N4 O S -","- C18 H16 N4 O S -","- C144 H128 N32 O8 S8 -","8","2","RZ6046","Liang-Zhong Xu; Guo-Dong Si; Zai-Feng Li; Guan-Ping Yu; Yong-Wei Huang","2-(4-Methylbenzoyl)-<i>N</i>-phenyl-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanethioamide","Acta Crystallographica Section E","2005","61","3","o571","o572","10.1107/S1600536805003417","","","0.71073","MoKα","","0.1085","0.0485","","","0.1133","0.1336","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205351","15.277","0.003","11.81","0.002","8.636","0.0017","90","","121.79","0.03","90","","1324.4","0.6","295","2","295","2","","","","","","","","4","C 1 c 1","C -2yc","9","","3-Benzyl-4-phenyl-1H-1,2,4-triazole-5(4H)-thione","","- C15 H13 N3 S -","- C15 H13 N3 S -","- C60 H52 N12 S4 -","4","1","RZ6047","Fangfang Jian; Zhengshuai Bai; Hailian Xiao; Kai Li","3-Benzyl-4-phenyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","3","o557","o558","10.1107/S1600536805003223","","","0.71073","MoKα","","0.0425","0.0391","","","0.1057","0.1091","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205352","11.751","0.0014","5.51","0.0011","18.277","0.0017","90","","96.14","0.02","90","","1176.6","0.3","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaquacadmium(II)]-μ-benzene-1,4-dioxyacetato-κ^4^O,O':O'',O''']","","- C10 H12 Cd O8 -","- C10 H12 Cd O8 -","- C40 H48 Cd4 O32 -","4","0.5","RZ6049","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","<i>catena</i>-Poly[[diaquacadmium(II)]-μ-benzene-1,4-dioxyacetato-κ^4^<i>O,O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2005","61","3","m451","m453","10.1107/S1600536805003211","","","0.71073","MoKα","","0.0529","0.0459","","","0.1279","0.1502","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205353","6.0641","0.0005","10.6966","0.0009","11.7335","0.001","90","","90","","90","","761.1","0.11","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Iodolevoglucosan","1,6-Anhydro-2-iodo-2-deoxy-β-D-glucopyranose","","- C6 H9 I O4 -","- C6 H9 I O4 -","- C24 H36 I4 O16 -","4","1","RZ6050","Gehle, Dietmar; Flörke, Ulrich; Krohn, Karsten","1,6-Anhydro-2-iodo-2-deoxy-β-<small>D</small>-glucopyranose (Iodolevoglucosan)","Acta Crystallographica Section E","2005","61","3","o664","o666","10.1107/S1600536805004526","","","0.71073","MoKα","","0.0216","0.0201","","","0.0487","0.0495","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205354","8.867","0.0012","9.7248","0.0013","11.227","0.0015","101.006","0.002","105.841","0.002","93.966","0.002","906.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(3-Benzyloxy-4-methoxyphenyl)-5-phenyl-1,3,4-oxadiazole","","- C22 H18 N2 O3 -","- C22 H18 N2 O3 -","- C44 H36 N4 O6 -","2","1","RZ6051","Shang, Zhen-Hua; Li, Wei; Wang, Song-Qing","2-(3-Benzyloxy-4-methoxyphenyl)-5-phenyl-1,3,4-oxadiazole","Acta Crystallographica Section E","2005","61","3","o704","o705","10.1107/S1600536805004861","","","0.71073","MoKα","","0.046","0.0346","","","","0.1038","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205355","8.0127","0.0009","22.524","0.003","9.733","0.001","90","","113.42","0.001","90","","1611.9","0.3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua(1,10-phenanthroline)(thiodiglycolato)cobalt(II)","","- C16 H14 Co N2 O5 S -","- C16 H14 Co N2 O5 S -","- C64 H56 Co4 N8 O20 S4 -","4","1","RZ6052","Wu, Jian-Yi; Xie, Lin-Ming; He, Hong-Yin; Zhou, Xia; Zhu, Long-Guan","Aqua(1,10-phenanthroline)(thiodiglycolato)cobalt(II)","Acta Crystallographica Section E","2005","61","3","m568","m570","10.1107/S1600536805005076","","","0.71073","MoKα","","0.051","0.0375","","","0.0852","0.0913","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205356","7.1404","0.0006","11.9642","0.0011","13.6188","0.0016","90","","90","","90","","1163.4","0.2","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2-Chloropyridin-3-yl)(4-nitrobenzylidene)amine","","- C12 H8 Cl N3 O2 -","- C12 H8 Cl N3 O2 -","- C48 H32 Cl4 N12 O8 -","4","1","RZ6053","Mehmet Akkurt; Selvi Karaca; Ali Asghar Jarrahpour; Maaroof Zarei; Orhan Büyükgüngör","(2-Chloropyridin-3-yl)(4-nitrobenzylidene)amine","Acta Crystallographica Section E","2005","61","3","o776","o778","10.1107/S1600536805005611","","","0.71073","MoKα","","0.0534","0.0395","","","0.0741","0.0789","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205357","5.3172","0.0004","24.8494","0.0019","9.3896","0.0007","90","","102.938","0.001","90","","1209.14","0.16","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis(2-pyridylmethyl)amine‒borane","","- C12 H16 B N3 -","- C12 H16 B N3 -","- C48 H64 B4 N12 -","4","1","SJ6040","Ballester Sanchez, Noelia; Barreira Fontecha, Julia; Wikaira, Jan; McKee, Vickie","Bis(2-pyridylmethyl)amine‒borane","Acta Crystallographica Section E","2005","61","3","o567","o568","10.1107/S1600536805001728","","","0.71073","MoKα","","0.0622","0.0431","","","0.1041","0.1163","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205358","4.8629","0.0014","18.29","0.005","18.403","0.006","90","","94.642","0.006","90","","1631.4","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Z)-3-[(2,4-Dinitrophenyl)hydrazono]-4,4,4-trifluoro-1-(2-thienyl)butan-1-one","","- C14 H9 F3 N4 O5 S -","- C14 H9 F3 N4 O5 S -","- C56 H36 F12 N16 O20 S4 -","4","1","SJ6044","Zuo-Liang Jing; Ming Yu; Xin Chen; Chun-Hua Diao; Qi-Liang Deng; Zhi Fan","(<i>Z</i>)-3-[(2,4-Dinitrophenyl)hydrazono]-4,4,4-trifluoro-1-(2-thienyl)butan-1-one","Acta Crystallographica Section E","2005","61","3","o534","o535","10.1107/S1600536805002308","","","0.71073","MoKα","","0.1104","0.0488","","","0.1012","0.1209","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205359","11.2958","0.0006","12.748","0.0008","17.5607","0.0008","90","","90","","90","","2528.7","0.2","296","","296","","","","","","","","","4","P b c n","-P 2n 2ab","60","","4-Phenyl-3-(pyridin-4-yl)-1H-1,2,4-triazole-5(4H)-thione","","- C13 H10 N4 S -","- C13 H10 N4 S -","- C104 H80 N32 S8 -","8","1","SJ6046","Sema Öztürk Yıldırım; Mehmet Akkurt; Ahmet Çetin; Ahmet Cansız; Memet Şekerci; Canan Kazak","4-Phenyl-3-(pyridin-4-yl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","3","o619","o621","10.1107/S1600536805003983","","","0.71073","MoKα","","0.056","0.031","","","0.071","0.076","","","","","","0.9","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205360","7.3872","0.0004","27.5675","0.0016","7.6687","0.0004","90","","117.344","0.001","90","","1387.21","0.13","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquabis(biuretato-κ^2^O,O')nickel(II) dichloride","","- C4 H14 Cl2 N6 Ni O6 -","- C4 H14 Cl2 N6 Ni O6 -","- C16 H56 Cl8 N24 Ni4 O24 -","4","1","SJ6047","Lawson, Jeffrey; Harrison, William T. A.","Diaquabis(biuretato-κ^2^<i>O</i>,<i>O</i>')nickel(II) dichloride","Acta Crystallographica Section E","2005","61","3","m525","m527","10.1107/S1600536805004393","","","0.71073","MoKα","","0.0987","0.0471","","","0.0896","0.1011","","","","","","0.964","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205361","18.303","0.006","13.212","0.002","20.023","0.004","90","","109.67","0.02","90","","4559","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","bis[1,3-bis(diphenylphosphino)propane]nickel(0)","","- C54 H52 Ni P4 -","- C54 H52 Ni P4 -","- C216 H208 Ni4 P16 -","4","0.5","SJ6048","Davies, Sian C.; Duff, Samantha E.; Evans, David J.","Bis[1,3-bis(diphenylphosphino)propane-κ^2^<i>P</i>,<i>P</i>']nickel(0)","Acta Crystallographica Section E","2005","61","3","m571","m573","10.1107/S1600536805005064","","","0.71069","Mo_Kα","","0.0604","0.0357","","","0.0783","0.0924","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205362","13.861","0.003","5.834","0.001","14.903","0.003","90","","110.65","0.03","90","","1127.7","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-4(Chlorophenyl)-2H-benz[b][1,4]oxazine","","- C14 H10 Cl N O -","- C14 H10 Cl N O -","- C56 H40 Cl4 N4 O4 -","4","1","SJ6049","Vencato, Ivo; Ferri, Pedro H.; Faria, Lourival C.; Santos, Suzana C.; Lariucci, Carlito","3-(4-Chlorophenyl)-2<i>H</i>-benz[<i>b</i>][1,4]oxazine","Acta Crystallographica Section E","2005","61","3","o769","o771","10.1107/S160053680500543X","","","0.71073","MoKα","","0.061","0.043","","","0.114","0.132","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205363","6.746","0.001","12.605","0.004","18.32","0.003","90","","90","","90","","1557.8","0.6","296","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H18 O3 -","- C19 H18 O3 -","- C76 H72 O12 -","4","1","SU6164","Binita Suthar; Anthony Fowler; Daniel S. Jones; Craig A. Ogle","1-(3,4,5-Trimethoxyphenyl)naphthalene","Acta Crystallographica Section E","2005","61","3","o607","o608","10.1107/S1600536805003776","","","1.54178","CuKα","","","0.0375","","","","0.0978","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205364","6.9577","0.0014","9.3611","0.0019","10.724","0.002","70.64","0.03","83.96","0.03","82.27","0.03","651.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","2,3,5-Trichloro-6-(4-methylpiperidin-1-yl)-1,4-benzoquinone","","- C12 H12 Cl3 N O2 -","- C12 H12 Cl3 N O2 -","- C24 H24 Cl6 N2 O4 -","2","1","SU6166","Bowes, Katharine F.; Cole, Jacqueline M.; Szablewski, Marek","2,3,5-Trichloro-6-(4-methylpiperidin-1-yl)-1,4-benzoquinone: a synchrotron study","Acta Crystallographica Section E","2005","61","3","o696","o698","10.1107/S1600536805004010","","","0.6928","synchrotron","","0.034","0.0327","","","0.091","0.0923","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205365","5.0708","0.0003","9.6094","0.0006","11.9258","0.0008","66.348","0.001","86.081","0.001","80.935","0.002","525.64","0.06","296","1","296","1","","","","","","","","3","P -1","-P 1","2","1,4,11,12-Tetrahydro-9,10-anthraquinone","1,4,11,12-Tetrahydro-9,10-anthraquinone","","- C14 H12 O2 -","- C14 H12 O2 -","- C28 H24 O4 -","2","1","SU6167","Andreas Decken; S. M. Mattar; A. Emwas","1,4,11,12-Tetrahydro-9,10-anthraquinone","Acta Crystallographica Section E","2005","61","3","o641","o642","10.1107/S1600536805004198","","","0.71073","MoKα","","0.0653","0.0478","","","0.1322","0.1384","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205366","13.196","0.002","19.853","0.003","11.985","0.0019","90","","107.47","0.003","90","","2995","0.8","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,7-Bis(4-methoxyphenyl)-1,3,7,triphenyl-2,3,5,6,7,7a-hexahydro-1H- pyrrolo[2,3-d]pyrimidine-2,5,6-trione","","- C38 H29 N3 O5 -","- C38 H29 N3 O5 -","- C152 H116 N12 O20 -","4","1","SU6168","Adams, Harry; Mustafa Saçmaci; Şevket Hakan Üngören; Yunus Akçamur","4,7-Bis(4-methoxyphenyl)-1,3,7-triphenyl-2,3,5,6,7,7a-hexahydro-1<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidine-2,5,6-trione","Acta Crystallographica Section E","2005","61","3","o635","o636","10.1107/S1600536805003995","","","0.71073","MoKα","","0.1324","0.0577","","","0.1138","0.1391","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205367","8.5925","0.001","10.6129","0.0013","7.7558","0.0009","90","","114.315","0.002","90","","644.52","0.13","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1,2,2-Tetrachloro-1,2-diphenylethane","","- C14 H10 Cl4 -","- C14 H10 Cl4 -","- C28 H20 Cl8 -","2","0.5","SU6170","Adriana Garcia-Sanchez; Itzia I. Padilla-Martínez; Francisco J. Martínez-Martínez; Herbert Höpfl; Efrén V. García-Báez","1,1,2,2-Tetrachloro-1,2-diphenylethane","Acta Crystallographica Section E","2005","61","3","o678","o680","10.1107/S1600536805004472","","","0.71073","MoKα","","0.0258","0.0256","","","0.0664","0.0666","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205368","5.4596","0.0001","15.9758","0.0003","17.5111","0.0003","90","","90","","90","","1527.34","0.05","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6-O-Cyanomethyl-1,2:3,4-di-O-isopropylidene-α-D-galactopyranose","","- C14 H21 N O6 -","- C14 H21 N O6 -","- C56 H84 N4 O24 -","4","1","SU6172","Vratislav Langer; Bohumil Steiner; Ju̇lia Mic̆ová; Miroslav Koós̆","6-<i>O</i>-Cyanomethyl-1,2:3,4-di-<i>O</i>-isopropylidene-α-<small>D</small>-galactopyranose","Acta Crystallographica Section E","2005","61","3","o779","o781","10.1107/S1600536805005544","","","0.71073","MoKα","","0.0566","0.0379","","","0.0833","0.0922","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205369","7.6036","0.0005","8.854","0.0005","8.924","0.0005","70.985","0.001","82.297","0.001","86.86","0.001","562.84","0.06","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Dichlorobis(phenothiazine-κS)palladium(II)","","- C24 H18 Cl2 N2 Pd S2 -","- C24 H18 Cl2 N2 Pd S2 -","- C24 H18 Cl2 N2 Pd S2 -","1","0.5","SU6173","Zhang, Xuanjun; Li, Dan; Zhou, Xiao-Ping; Ng, Seik Weng","Dichlorobis(phenothiazine-κ<i>S</i>)palladium(II)","Acta Crystallographica Section E","2005","61","3","m603","m605","10.1107/S1600536805005799","","","0.71073","MoKα","","0.025","0.024","","","0.064","0.065","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205370","7.333","0.003","13.737","0.003","15.381","0.006","113.04","0.02","94.93","0.04","105.23","0.03","1344.3","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","DL-phenylalanine DL-phenylalaninium picrate","DL-Phenylalanine DL-phenylalaninium picrate","","- C24 H25 N5 O11 -","- C24 H25 N5 O11 -","- C48 H50 N10 O22 -","2","1","TK6206","K. Anitha; R. K. Rajaram","<small>DL</small>-Phenylalanine <small>DL</small>-phenylalaninium picrate","Acta Crystallographica Section E","2005","61","3","o589","o591","10.1107/S1600536805003491","","","0.71073","MoKα","","0.208","0.062","","","0.139","0.188","","","","","","0.93","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205371","22.368","0.003","8.4961","0.0011","7.4726","0.001","90","","90","","90","","1420.1","0.3","120","2","120","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","1-Chloromethyl-4-aza-1-azoniabicyclo[2.2.2]octane tetrafluoroborate deuterochloroform solvate","","- C8 H14 B Cl4 D F4 N2 -","- C8 H14 B Cl4 D F4 N2 -","- C32 H56 B4 Cl16 D4 F16 N8 -","4","0.5","TK6209","Batsanov, Andrei S.; Trmcic, Jelena; Sandford, Graham","1-Chloromethyl-4-aza-1-azoniabicyclo[2.2.2]octane tetrafluoroborate deuterochloroform solvate","Acta Crystallographica Section E","2005","61","3","o681","o682","10.1107/S1600536805004411","","","0.71073","MoKα","","0.048","0.04","","","0.093","0.095","","","","","","1.21","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205372","7.3201","0.0008","13.9189","0.0014","15.8356","0.0016","90","","90","","90","","1613.5","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 2,3,4-tetra-O-acetyl-1-azido-1-deoxy-β-D-glucopyranuronate","","- C13 H17 N3 O9 -","- C13 H17 N3 O9 -","- C52 H68 N12 O36 -","4","1","TK6210","Smith, Craig R.; Norris, Peter; Zeller, Matthias","Methyl 2,3,4-tri-<i>O</i>-acetyl-1-azido-1-deoxy-β-<small>D</small>-glucopyranuronate at 100K","Acta Crystallographica Section E","2005","61","3","o736","o737","10.1107/S1600536805004423","","","0.71073","MoKα","","0.031","0.031","","","0.079","0.08","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205373","9.464","0.0002","12.358","0.0002","9.775","0.0002","90","","117.767","0.0013","90","","1011.6","0.04","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquabis(1,1,4-trimethylthiosemicarbazide)nickel(II) dinitrate","","- C8 H26 N8 Ni O8 S2 -","- C8 H26 N8 Ni O8 S2 -","- C16 H52 N16 Ni2 O16 S4 -","2","0.5","WK6043","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.","Diaquabis(1,1,4-trimethylthiosemicarbazide)nickel(II) dinitrate","Acta Crystallographica Section E","2005","61","3","m551","m553","10.1107/S1600536805002965","","","0.7107","MoKα","","0.0238","0.0222","","","0.0547","0.0557","","","","","","1.064","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2205374","7.2877","0.0002","11.9265","0.0003","8.1586","0.0002","90","","107.396","0.001","90","","676.68","0.03","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(hydroxymethyl)-3,5-dimethylpyrazole","","- C6 H10 N2 O -","- C6 H10 N2 O -","- C24 H40 N8 O4 -","4","1","WK6045","Radosavljević Evans, Ivana; Mészáros Szécsényi, Katalin; Leovac, Vukadin, M.","1-(Hydroxymethyl)-3,5-dimethylpyrazole","Acta Crystallographica Section E","2005","61","3","o625","o626","10.1107/S1600536805003971","","","0.71073","MoKα","","0.047","0.0401","","0.104","0.0999","0.0999","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205375","13.6193","0.0007","17.7307","0.0013","15.8077","0.0009","90","","108.356","0.006","90","","3623","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tetrapotassium tetratantalum tetraphosphorus tetracosasulfide","","- K2 P2 S12 Ta2 -","- K2 P2 S12 Ta2 -","- K16 P16 S96 Ta16 -","8","2","WM6048","Gutzmann, Andreas; Näther, Christian; Bensch, Wolfgang","K~4~Ta~4~P~4~S~24~","Acta Crystallographica Section E","2005","61","3","i20","i22","10.1107/S1600536805001959","","","0.71073","MoKα","","0.0408","0.0266","","","0.0522","0.055","","","","","","0.968","","","","has coordinates,has Fobs","184482","2020-10-21","18:00:00",""
"2205376","6.3397","0.0003","6.3397","0.0003","3.756","0.0002","90","","90","","90","","150.96","0.013","150","2","150","2","","","","","","","","4","P -4 21 m","P -4 2ab","113","ammonium chlorite","ammonium chlorate(III)","","- Cl H4 N O2 -","- Cl H4 N O2 -","- Cl2 H8 N2 O4 -","2","0.25","WM6052","Smolentsev, Anton I.; Naumov, Dmitry Yu.","Ammonium chlorite, NH~4~ClO~2~, at 150K","Acta Crystallographica Section E","2005","61","3","i38","i40","10.1107/S1600536805005088","","","0.71073","MoKα","","0.0165","0.0162","","","0.0401","0.0402","","","","","","1.262","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205377","10.685","0.0016","10.685","0.0016","10.685","0.0016","90","","90","","90","","1219.9","0.3","273","2","273","2","","","","","","","","6","P -4 3 m","P -4 2 3","215","","Hexapotassium dihydrogen monotitanoundecatungstocobaltate(II) tridecahydrate","","- Co H28 K6 O53 Ti W11 -","- Co K6 O53 Ti0.99996 W10.9999 -","- Co K6 O53 Ti0.99996 W10.9999 -","1","0.0416667","WM6053","Werner Kraus; Holger Stephan; Anita Röllich; Zdenek Matĕjka; Günter Reck","K~6~H~2~[TiW~11~CoO~40~].13H~2~O, with a monotitanoundecatungstocobaltate(II) anion","Acta Crystallographica, Section E","2005","61","3","i35","i37","10.1107/S1600536805005180","","","0.71073","MoKα","","0.0668","0.0386","","","0.0899","0.097","","","","","","0.977","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205378","11.0324","0.0001","23.9623","0.0003","11.2437","0.0001","90","","102.934","0.0008","90","","2896.99","0.05","190","","190","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chloro{1-[(dimethylamino)methyl-κN]-1H-indole-κC^2^}(triphenylphosphine- κP)palladium(II)","","- C30 H30 Cl3 N2 P Pd -","- C30 H30 Cl3 N2 P Pd -","- C120 H120 Cl12 N8 P4 Pd4 -","4","1","WN6315","Cooper, Richard I.; Cowley, Andrew R.; Capito, Elena; Brown, John M.; Ricci, Alfredo","Chloro{1-[(dimethylamino)methyl-κ<i>N</i>]-1<i>H</i>-indolyl-κ<i>C</i>^2^}(triphenylphosphine-κ<i>P</i>)palladium(II) dichloromethane solvate","Acta Crystallographica Section E","2005","61","3","m585","m586","10.1107/S1600536804033227","","","0.71073","MoKα","","0.0308","0.0249","","0.0587","0.0571","0.0587","","","","","","0.9977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205379","10.3125","0.0002","10.9019","0.0002","16.4409","0.0005","71.7446","0.0009","75.0748","0.0009","62.033","0.001","1536.81","0.06","150","","150","","","","","","","","","7","P -1","-P 1","2","","Acetato[1-(oxazolin-2-ylmethyl-κN)indol-2-yl](triphenylphosphine)palladium(II) dichloromethane solvate","","- C33 H31 Cl2 N2 O3 P Pd -","- C33 H31 Cl2 N2 O3 P Pd -","- C66 H62 Cl4 N4 O6 P2 Pd2 -","2","1","WN6316","Cowley, Andrew R.; Cooper, Richard I.; Capito, Elena; Brown, John M; Ricci, Alfredo","Acetato[1-(oxazolin-2-ylmethyl-κ<i>N</i>)-1<i>H</i>-indolyl-κ<i>C</i>^2^](triphenylphosphine)palladium(II) dichloromethane solvate","Acta Crystallographica Section E","2005","61","3","m582","m584","10.1107/S1600536804032891","","","0.71073","MoKα","","0.0605","0.0357","","0.0599","0.0396","0.0396","","","","","","1.1005","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205380","9.535","0.003","9.539","0.003","10.093","0.003","103.89","0.02","92.05","0.03","113.5","0.02","808.3","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2,2-Dimethyl-6-(4-nitrophenyl)-4-phenyl-1,3-diazabicyclo[3.1.0]hex-3-ene","","- C18 H17 N3 O2 -","- C18 H17 N3 O2 -","- C36 H34 N6 O4 -","2","1","WN6323","Dyakonenko, Viktoria V.; Shishkin, Oleg V.; Zbruev, Alexandr V.; Desenko, Sergey M.","2,2-Dimethyl-6-(4-nitrophenyl)-4-phenyl-1,3-diazabicyclo[3.1.0]hex-3-ene","Acta Crystallographica Section E","2005","61","3","o667","o668","10.1107/S1600536805004484","","","0.71073","MoKα","","0.0723","0.0666","","","0.1895","0.1984","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205381","9.908","0.001","10.442","0.001","16.603","0.002","90","","90","","90","","1717.7","0.3","100","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H23 N S2 -","- C18 H23 N S2 -","- C72 H92 N4 S8 -","4","1","WN6325","Kırılmış, Cumhur; Koca, Murat; Arıcı, Cengiz; W. Heinemann, Frank; Ahmedzade, Misir","3-Butyl-4-(3-methyl-3-phenylcyclobut-1-yl)-1,3-thiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","3","o555","o556","10.1107/S1600536805003168","","","0.71073","MoKα","","0.0492","0.0348","","","0.0664","0.0701","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205382","4.015","0.003","15.41","0.01","25.73","0.005","90","","91.22","0.07","90","","1591.6","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Bromo-2,6-dichloroaniline","","- C6 H4 Br Cl2 N -","- C6 H4 Br Cl2 N -","- C48 H32 Br8 Cl16 N8 -","8","2","WN6327","M. Arun Prasad; Babu Varghese; M. V. Sangaranarayanan","4-Bromo-2,6-dichloroaniline","Acta Crystallographica Section E","2005","61","3","o758","o759","10.1107/S1600536805003521","","","0.71073","MoKα","","0.1656","0.0585","","","0.1513","0.1975","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205383","8.589","0.003","8.686","0.003","11.375","0.004","90","","90","","90","","848.6","0.5","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Methyl-6,7-dihydropyrrolo[2,3-c]azepine-4,8(1H,5H)-dione","","- C9 H10 N2 O2 -","- C9 H10 N2 O2 -","- C36 H40 N8 O8 -","4","1","WN6329","Xiang-Chao Zeng; Shi-Hai Xu; Jian Gu; Dong-Sheng Deng","1-Methyl-6,7-dihydropyrrolo[2,3-<i>c</i>]azepine-4,8(1<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","3","o795","o796","10.1107/S1600536805005532","","","0.71073","MoKα","","0.0356","0.0316","","","0.0845","0.0883","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205384","5.6459","0.0009","13.973","0.002","16.875","0.003","88.517","0.003","85.574","0.003","81.742","0.003","1313.4","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3-(3-Hydroxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one","","- C16 H14 O3 -","- C16 H14 O3 -","- C64 H56 O12 -","4","2","WN6330","S. Sathiya Moorthi; K. Chinnakali; S. Nanjundan; P. Selvam; Hoong-Kun Fun; Xiao-Lan Yu","3-(3-Hydroxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","3","o743","o745","10.1107/S1600536805004915","","","0.71073","MoKα","","0.0675","0.0551","","","0.1573","0.1694","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205385","8.3045","0.0007","10.5134","0.001","11.8019","0.0011","76.106","0.001","87.116","0.002","72.072","0.002","951.38","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-methylbenzylidene)amino]- 1H-pyrazole-3-carbonitrile","","- C19 H11 Cl2 F3 N4 -","- C19 H11 Cl2 F3 N4 -","- C38 H22 Cl4 F6 N8 -","2","1","WW6349","Zhong, Ping; Yang, Zhiping; Shi, Qian; Li, Shuyan; Tang, Riyuan","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-methylbenzylidene)amino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","3","o559","o560","10.1107/S1600536805003028","","","0.71073","MoKα","","0.0809","0.0724","","","0.2045","0.2147","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205386","13.122","0.002","12.943","0.002","15.893","0.003","90","","104.517","0.003","90","","2613.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(3-tert-buyl-N,5-dimethylsalicylaldiminato)cobalt(II)","","- C26 H36 Co N2 O2 -","- C26 H36 Co N2 O2 -","- C104 H144 Co4 N8 O8 -","4","1","WW6350","Li, Xiaoyan; Huang, Liye; Dong, Shuli; Li, Mu; Sun, Hongjian","Bis(3-tert-buyl-N,5-dimethylsalicylaldiminato)cobalt(II)","Acta Crystallographica, Section E","2005","61","3","o465","o466","10.1107/S1600536805003132","","","0.71073","MoKα","","0.0822","0.0431","","","0.1137","0.142","","","","","","1.064","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205387","10.184","0.002","12.182","0.002","18.987","0.003","90","","90","","90","","2355.6","0.7","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","mer-(2-Formylatocyclohexen-1-olato-κ^2^C^2^,O^1^)iodotris(trimethylphosphine- κP)cobalt(III)","","- C16 H35 Co I O2 P3 -","- C16 H35 Co I O2 P3 -","- C64 H140 Co4 I4 O8 P12 -","4","1","WW6351","Yu, Fengli; Dong, Shuli; Zhou, Jin; Wang, Aichen; Sun, Hongjian; Li, Xiaoyan","<i>mer</i>-(2-Formylatocyclohexen-1-olato-κ^2^<i>C</i>^2^,<i>O</i>^1^)iodotris(trimethylphosphine-κ<i>P</i>)cobalt(III)","Acta Crystallographica Section E","2005","61","3","m467","m468","10.1107/S1600536805003144","","","0.71073","MoKα","","0.0892","0.0526","","","0.1336","0.1517","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205388","5.843","0.0003","12.8501","0.0008","17.5767","0.0011","90","","97.449","0.005","90","","1308.58","0.13","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2-exo,7-exo,9-endo,10-endo)-11-Oxatricyclo[6.2.1.0^2,7^]undec-4-ene-9,10-diyl diacetate","","- C14 H18 O5 -","- C14 H18 O5 -","- C56 H72 O20 -","4","1","WW6356","Mehmet Akkurt; Sema Öztürk Yıldırım; Arif Baran; Hasan Seçen; Orhan Büyükgüngör","(2-<i>exo</i>,7-<i>exo</i>,9-<i>endo</i>,10-<i>endo</i>)-11-Oxatricyclo[6.2.1.0^2,7^]undec-4-ene-9,10-diyl diacetate","Acta Crystallographica Section E","2005","61","3","o760","o762","10.1107/S1600536805005234","","","0.71073","MoKα","","0.037","0.0317","","","0.0813","0.0839","","","","","","1.033","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205389","10.0639","0.0006","12.2445","0.0007","13.9291","0.0008","96.985","0.001","101.406","0.001","98.851","0.001","1641.9","0.17","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","cis-Diaquabis(1,10-phenanthroline)manganese(II) 3-carboxylato-4-hydroxybenzenesulfonate tetrahydrate","","- C31 H32 Mn N4 O12 S -","- C31 H32 Mn N4 O12 S -","- C62 H64 Mn2 N8 O24 S2 -","2","1","WW6357","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping; Ng, Seik Weng","<i>cis</i>-Diaquabis(1,10-phenanthroline)manganese(II) 3-carboxylato-4-hydroxybenzenesulfonate tetrahydrate","Acta Crystallographica Section E","2005","61","3","m563","m565","10.1107/S1600536805004927","","","0.71073","MoKα","","0.0736","0.0654","","","0.1439","0.1483","","","","","","1.2","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205390","5.469","0.002","7.786","0.003","8.463","0.003","108.604","0.005","92.357","0.006","107.546","0.005","321.9","0.2","288","2","288","2","","","","","","","","4","P -1","-P 1","2","","1,4-Dimethylpyridinium triiodide","","- C7 H10 I3 N -","- C6.64 H10 I3 N1.36 -","- C6.64 H10 I3 N1.36 -","1","0.5","WW6360","Tan, Xue-Jie; Sun, Si-Xiu; Liu, Shu-Lian; Ma, Jian-Ping; Xing, Dian-Xiang","1,4-Dimethylpyridinium triiodide","Acta Crystallographica Section E","2005","61","3","o756","o757","10.1107/S1600536805005301","","","0.71073","MoKα","","0.0634","0.0437","","","0.0947","0.105","","","","","","0.929","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205391","11.0122","0.0007","11.0122","0.0007","18.8285","0.0014","90","","90","","120","","1977.4","0.2","295","2","295","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","2,2'-Diamino-4,4'-bi-1,3-thiazolium (2R,3R)-tartrate","","- C10 H12 N4 O6 S2 -","- C10 H12 N4 O6 S2 -","- C60 H72 N24 O36 S12 -","6","1","WW6361","Liu, Bing-Xin; Xu, Duan-Jun","2,2'-Diamino-4,4'-bi-1,3-thiazolium (2<i>R</i>,3<i>R</i>)-tartrate","Acta Crystallographica Section E","2005","61","3","o753","o755","10.1107/S1600536805005313","","","0.71073","MoKα","","0.032","0.03","","","0.075","0.076","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205392","6.738","0.003","12.028","0.003","12.063","0.003","70.02","0.03","86.88","0.03","76.45","0.03","892.9","0.5","295","1","295","1","","","","","","","","5","P -1","-P 1","2","","Bis(adamantylamine-κN)bis(1-phenylbutane-1,3-dionato-κO,O')nickel(II)","","- C40 H52 N2 Ni O4 -","- C40 H52 N2 Ni O4 -","- C40 H52 N2 Ni O4 -","1","0.5","YA6237","Ernest Meštrović; Dejan-Krešimir Bučar","Bis(adamantylamine-κ<i>N</i>)bis(1-phenylbutane-1,3-dionato-κ^2^<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section E","2005","61","3","m522","m524","10.1107/S1600536805004216","","","0.71073","MoKα","","0.055","0.041","","","0.095","0.103","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205393","10.801","0.0017","14.279","0.004","18.074","0.003","90","","103.23","0.013","90","","2713.5","1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,6-Diphenyl-1,4-bis(tolyl-4-sulfonyl)-1,4-dihydro-1,2,4,5-tetrazine","","- C28 H24 N4 O4 S2 -","- C28 H24 N4 O4 S2 -","- C112 H96 N16 O16 S8 -","4","1","AC6157","Luping Lv; Weixiao Hu; Hai-Bo Shi; Guo-Wu Rao","3,6-Diphenyl-1,4-bis(<i>p</i>-tolylsulfonyl)-1,4-dihydro-1,2,4,5-tetrazine","Acta Crystallographica Section E","2005","61","4","o1026","o1027","10.1107/S1600536805007622","","","0.71065","MoKα","","0.0881","0.0374","","","0.0979","0.1182","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205394","17.559","0.007","8.959","0.004","19.566","0.008","90","","97.591","0.009","90","","3051","2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-[3-(Hydroxymethyl)phenyl]-N'-(4-methoxybenzoyl)thiourea","","- C16 H16 N2 O3 S -","- C16 H16 N2 O3 S -","- C128 H128 N16 O24 S8 -","8","1","AC6161","Ngah, Nurziana; Mohd Fauzi, Noor Fazlina; Yamin, Bohari M.","<i>N</i>-[3-(Hydroxymethyl)phenyl]-<i>N</i>'-(4-methoxybenzoyl)thiourea","Acta Crystallographica Section E","2005","61","4","o1018","o1019","10.1107/S1600536805007853","","","0.71073","MoKα","","0.0616","0.0537","","","0.1233","0.1278","","","","","","1.189","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205395","8.048","0.003","10.039","0.002","7.298","0.002","90","","100.58","0.03","90","","579.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-bis(bromoacetoxy)butane","butane-1,4-diyl bis(bromoacetate)","","- C8 H12 Br2 O4 -","- C8 H12 Br2 O4 -","- C16 H24 Br4 O8 -","2","0.5","AC6162","Martínez-Palau, Meritxell; Puiggalí, Jordi; Solans, Xavier; Urpí, Lourdes","Butane-1,4-diyl bis(bromoacetate)","Acta Crystallographica Section E","2005","61","4","o1028","o1031","10.1107/S1600536805007609","","","0.71073","MoKα","","0.1739","0.065","","","0.1416","0.1798","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205396","9.6263","0.0003","12.0153","0.0003","15.6375","0.0004","86.334","0.002","79.479","0.002","83.175","0.002","1764.02","0.08","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Bis(tert-butylimido)[2-(dimethylaminomethyl)pyrrol-1-yl]tungsten(VI)-μ-oxo- bis(tert-butylimido)(η^2^-N,O-tert-butylnitroso)tungsten(VI)","","- C27 H57 N7 O2 W2 -","- C27 H57 N7 O2 W2 -","- C54 H114 N14 O4 W4 -","2","1","AC6163","Uno, Chia-Liang; Kuo, Pei-Cheng; Lee, Hon Man; Huang, Jui-Hsien","Bis(<i>tert</i>-butylimido)[2-(dimethylaminomethyl)pyrrol-1-yl]tungsten(VI)-μ-oxo-bis(<i>tert</i>-butylimido)(η^2^-<i>N,O</i>-<i>tert</i>-butylnitroso)tungsten(VI)","Acta Crystallographica Section E","2005","61","4","m697","m698","10.1107/S1600536805007610","","","0.71073","MoKα","","0.0353","0.0262","","","0.0602","0.063","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205397","8.693","0.0002","8.8976","0.0002","13.1057","0.0003","73.852","0.001","86.15","0.001","83.062","0.001","965.96","0.04","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","erythro-2-(2,6-Dimethoxy-4-methylphenoxy)-1-(4-hydroxy-3,5- dimethoxyphenyl)propane-1,3-diol","","- C20 H26 O8 -","- C20 H26 O8 -","- C40 H52 O16 -","2","1","AC6164","Langer, Vratislav; Lundquist, Knut; Miksche, Gerhard E.","<i>erythro</i>-2-(2,6-Dimethoxy-4-methylphenoxy)-1-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,3-diol","Acta Crystallographica Section E","2005","61","4","o1001","o1003","10.1107/S1600536805007865","","","0.71073","MoKα","","0.0877","0.0493","","","0.1043","0.1205","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205398","18.515","0.003","9.927","0.002","20.948","0.003","90","","94.659","0.003","90","","3837.5","1.1","295","2","295","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","Poly[[[(1,10-phenanthroline)manganese(II)]-μ~3~-2-nitrobenzene-1,4- dicarboxylato] monohydrate]","","- C20 H13 Mn N3 O7 -","- C20 H13 Mn N3 O7 -","- C160 H104 Mn8 N24 O56 -","8","1","AC6166","Zhu, Long-Guan; Xiao, Hong-Ping","Poly[[[(1,10-phenanthroline)manganese(II)]-μ~3~-2-nitrobenzene-1,4-dicarboxylato] monohydrate]","Acta Crystallographica Section E","2005","61","4","m769","m771","10.1107/S1600536805009086","","","0.71073","MoKα","","0.1044","0.0628","","","0.1149","0.1421","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205399","9.4853","0.0003","10.2904","0.0002","12.2872","0.0004","90","","90","","90","","1199.32","0.06","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6,6,8a-Trimethyl-3a,6,7,8a-tetrahydrobenzo[b]furo[3,2-d]furan-2,4(3H,5H)-dione","","- C13 H16 O4 -","- C13 H16 O4 -","- C52 H64 O16 -","4","1","AT6000","Basavegowda Nagaraj; Hemmige S. Yathirajan; Padmarajaiah Nagaraja; Daniel E. Lynch","6,6,8a-Trimethyl-3a,6,7,8a-tetrahydrobenzo[<i>b</i>]furo[3,2-<i>d</i>]furan-2,4(3<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","4","o1041","o1042","10.1107/S1600536805008093","","","0.71073","MoKα","","0.0288","0.0267","","","0.0659","0.0676","","","","","","1.04","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205400","9.9686","0.0008","12.2843","0.0008","14.7707","0.0003","90","","90","","90","","1808.78","0.19","100","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-Cyclohexyl-4-(3-methyl-3-phenylcyclobutyl)-1,3-thiazole-2(3H)-thione","","- C20 H25 N S2 -","- C20 H25 N S2 -","- C80 H100 N4 S8 -","4","1","AT6001","Kırılmış, Cumhur; Koca, Murat; Arıcı, Cengiz; W. Heinemann, Frank","3-Cyclohexyl-4-(3-methyl-3-phenylcyclobutyl)-1,3-thiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","4","o1176","o1177","10.1107/S160053680500930X","","","0.71073","MoKα","","0.0399","0.0314","","","0.067","0.0702","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205401","11.536","0.002","6.427","0.001","13.898","0.003","90","","105.95","0.03","90","","990.8","0.3","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","potassium selenate tellurate","","- H6 K2 O10 Se Te -","- H6 K2 O10 Se Te -","- H24 K8 O40 Se4 Te4 -","4","0.5","BR6184","Dammak, Mohamed; Cousson, Alain; Nierlich, Martine","Dipotassium selenate tellurate","Acta Crystallographica Section E","2005","61","4","i55","i57","10.1107/S1600536805008329","","","0.71073","MoKα","","","0.0185","","","","0.0208","","","","","","1.0363","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205402","16.0504","0.001","16.4302","0.001","26.5331","0.0016","90","","90","","90","","6997.1","0.7","130","2","130","2","","","","","","","","5","I b c a","-I 2b 2c","73","dichlorobis[4-(dimethylamino)phenyl]tellurium","dichlorobis[4-(dimethylamino)phenyl]tellurium","","- C16 H20 Cl2 N2 Te -","- C16 H20 Cl2 N2 Te -","- C256 H320 Cl32 N32 Te16 -","16","1","BR6185","Beckmann, Jens; Dakternieks, Dainis; Duthie, Andrew; Mitchell, Cassandra","An orthorhombic polymorph of dichlorobis[4-(dimethylamino)phenyl]tellurium","Acta Crystallographica Section E","2005","61","4","o986","o987","10.1107/S1600536805007336","","","0.71073","MoKα","","0.024","0.0216","","","0.0554","0.0568","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205403","22.172","0.004","10.5547","0.0016","7.7884","0.0012","90","","106.909","0.005","90","","1743.8","0.5","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","cis-Diaquabis(4-formyl-2-methoxyphenolato)zinc(II)","","- C16 H18 O8 Zn -","- C16 H18 O8 Zn -","- C64 H72 O32 Zn4 -","4","0.5","BR6187","Lin, Zhi-Dong; Lu, Jin-Yu","<i>cis</i>-Diaquabis(4-formyl-2-methoxyphenolato)zinc(II)","Acta Crystallographica Section E","2005","61","4","m743","m745","10.1107/S1600536805008561","","","0.71073","MoKα","","0.048","0.0434","","","0.1226","0.1257","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205404","12.11","0.002","8.1753","0.0015","12.566","0.002","90","","111.963","0.017","90","","1153.8","0.4","100","1","100","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","caesium chloride 2-(N-morpholinio)ethanesulfonate","","- C6 H13 Cl Cs N O4 S -","- C6 H13 Cl Cs N O4 S -","- C24 H52 Cl4 Cs4 N4 O16 S4 -","4","1","BR6188","Milić, Dalibor; Renić, Marija; Matković-C̆alogović, Dubravka","Caesium chloride 2-(<i>N</i>-morpholinio)ethanesulfonate","Acta Crystallographica Section E","2005","61","4","m757","m758","10.1107/S1600536805009037","","","0.71073","MoKα","","0.064","0.0464","","","0.111","0.1196","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205405","7.6817","0.0004","10.6398","0.0006","13.4992","0.0008","108.529","0.004","92.712","0.004","97.109","0.004","1033.67","0.1","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","2-[Bis(4-methoxyphenyl)methyl]benzyl chloroacetate","","- C24 H23 Cl O4 -","- C24 H23 Cl O4 -","- C48 H46 Cl2 O8 -","2","1","BT6609","Jones, Peter G.; Kuś, Piotr; Łapok, Łukasz","2-[Bis(4-methoxyphenyl)methyl]benzyl chloroacetate","Acta Crystallographica Section E","2005","61","4","o827","o828","10.1107/S1600536805005374","","","0.71073","MoKα","","0.0557","0.0412","","","0.1056","0.1155","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205406","25.824","0.009","18.944","0.008","4.001","0.001","90","","90","","90","","1957.3","1.2","173","2","173","2","","","","","","","","2","P n a 21","P 2c -2n","33","","9-Methylene-10,10-bis(phenylethynyl)fluorene","","- C30 H18 -","- C30 H18 -","- C120 H72 -","4","1","BT6610","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Berger, Harald","9-Methylene-10,10-bis(phenylethynyl)fluorene","Acta Crystallographica Section E","2005","61","4","o829","o830","10.1107/S1600536805005623","","","0.71073","MoKα","","0.0965","0.0445","","","0.0963","0.1265","","","","","","1.098","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205407","9.8155","0.0006","11.723","0.0009","14.0699","0.0012","85.964","0.006","76.178","0.006","80.879","0.006","1551.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Nonaaquaneodymium(III) trichloride bis(1,3,5,7-tetraazatricyclo[3.3.1.1^3,7^]decane tetrahydrate","","- C12 H50 Cl3 N8 Nd O13 -","- C12 H48 Cl3 N8 Nd O13 -","- C24 H96 Cl6 N16 Nd2 O26 -","2","1","BT6611","Trzesowska, Agata; Kruszynski, Rafal; Bartczak, Tadeusz Jan; Zalewicz, Malgorzata","Nonaaquaneodymium(III) trichloride bis(1,3,5,7-tetraazatricyclo[3.3.1.1^3,7^]decane tetrahydrate","Acta Crystallographica Section E","2005","61","4","m625","m628","10.1107/S160053680500615X","","","0.71073","MoKα","","0.0271","0.0254","","","0.0681","0.0692","","","","","","1.087","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205408","10.3572","0.0005","11.6812","0.0005","15.5784","0.0007","90","","90","","90","","1884.75","0.15","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","methyl 6α-hydroxy-3,13-clerodadien-15,16-olid-18-oate","","- C21 H30 O5 -","- C21 H30 O5 -","- C84 H120 O20 -","4","1","BT6612","K. Ravikumar; B. Sridhar; Biswanath Das; K. Venkateswarlu","A clerodane diterpenoid from <i>Pulicaria wightiana</i>","Acta Crystallographica Section E","2005","61","4","o854","o856","10.1107/S1600536805005994","","","0.71073","MoKα","","0.0457","0.0433","","","0.1171","0.1204","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205409","10.9984","0.0008","6.3486","0.0004","13.2439","0.0012","90","","99.768","0.004","90","","911.34","0.12","133","2","133","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","(3-Iodo-1-pyridinio)acetate‒iodide‒1-carboxymethyl-3-iodo-1-pyridinium‒ (1:1:1)","","- C14 H13 I3 N2 O4 -","- C14 H13 I3 N2 O4 -","- C28 H26 I6 N4 O8 -","2","0.5","BT6613","Jones, Peter G.; Cots, Berta; Zerbe, Eva-Maria","1-Carboxymethyl-3-iodo-1-pyridinium‒iodide‒(3-iodo-1-pyridinio)acetate (1/1/1)","Acta Crystallographica Section E","2005","61","4","o895","o897","10.1107/S1600536805006045","","","0.71073","MoKα","","0.0451","0.0285","","","0.0492","0.0524","","","","","","0.945","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205410","5.289","0.002","8.678","0.002","13.178","0.005","90","","96.748","0.012","90","","600.7","0.4","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","(3S,6R)-3-benzyloxymethyl-6-methyl-1,4-dioxane-2,5-dione","","- C13 H14 O5 -","- C13 H14 O5 -","- C26 H28 O10 -","2","1","BT6614","Kooijman, Huub; Leemhuis, Mark; Nostrum, Cornelus F. van; Hennink, Wim E.; Spek, Anthony L.","(3<i>S</i>,6<i>R</i>)-3-Benzyloxymethyl-6-methyl-1,4-dioxane-2,5-dione","Acta Crystallographica Section E","2005","61","4","o898","o900","10.1107/S1600536805006902","","","0.71073","MoKα","","0.0378","0.0309","","","0.0732","0.076","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205411","8.944","0.002","5.94","0.001","12.559","0.003","90","","107.905","0.012","90","","634.9","0.2","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","(3S,6S)-3-benzyloxymethyl-6-methyl-1,4-dioxane-2,5-dione","","- C13 H14 O5 -","- C13 H14 O5 -","- C26 H28 O10 -","2","1","BT6615","Kooijman, Huub; Leemhuis, Mark; Nostrum, Cornelus F. van; Hennink, Wim E.; Spek, Anthony L.","(3<i>S</i>,6<i>S</i>)-3-Benzyloxymethyl-6-methyl-1,4-dioxane-2,5-dione","Acta Crystallographica Section E","2005","61","4","o901","o903","10.1107/S1600536805006914","","","0.71073","MoKα","","0.0431","0.0355","","","0.0903","0.0948","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205412","6.4024","0.0004","31.441","0.002","7.366","0.0005","90","","98.33","0.001","90","","1467.12","0.16","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Methoxysalicylaldehyde 3-methoxybenzoylhydrazone","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C64 H64 N8 O16 -","4","1","BT6616","Ali, Hapipah M.; Puvaneswary, Subramaniam; Basirun, Wan Jefri; Ng, Seik Weng","5-Methoxysalicylaldehyde 3-methoxybenzoylhydrazone","Acta Crystallographica Section E","2005","61","4","o947","o948","10.1107/S1600536805007154","","","0.71073","MoKα","","0.062","0.041","","","0.11","0.124","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205413","8.938","0.002","10.52","0.003","12.548","0.003","67.726","0.018","89.769","0.018","77.689","0.018","1062.9","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Hydroxy-6-[(2-hydroxyphenylamino)methylene]cyclohexa-2,4-dienone","","- C13 H11 N O3 -","- C13 H11 N O3 -","- C52 H44 N4 O12 -","4","2","BT6617","Koşar, Başak; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","2-Hydroxy-6-[(2-hydroxyphenylamino)methylene]cyclohexa-2,4-dienone","Acta Crystallographica Section E","2005","61","4","o1097","o1099","10.1107/S160053680500807X","","","0.71073","MoKα","","0.2375","0.0976","","","0.2215","0.2955","","","","","","0.892","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205414","9.589","0.005","9.617","0.005","21.952","0.012","80.81","0.03","80.64","0.04","62.5","0.04","1763.4","1.7","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","9-Methylene-10,10-bis(phenylethynyl)fluorene‒tetracyano-para-quinodimethane (2/3)","","- C96 H48 N12 -","- C96 H48 N12 -","- C96 H48 N12 -","1","0.5","BT6618","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Berger, Harald","9-Methylene-10,10-bis(phenylethynyl)fluorene‒tetracyano-<i>para</i>-quinodimethane (2/3)","Acta Crystallographica Section E","2005","61","4","o957","o959","10.1107/S1600536805007142","","","0.71073","MoKα","","0.1621","0.0483","","","0.1042","0.1567","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205415","10.8604","0.0005","6.6081","0.0003","16.6771","0.0008","90","","108.553","0.001","90","","1134.66","0.09","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Hexobarbitone","5-(1-Cyclohex-en-1-yl)-1,5-dimethylbarbituric acid","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C48 H64 N8 O12 -","4","1","BT6620","Nichol, Gary S.; Clegg, William","5-(1-Cyclohexen-1-yl)-1,5-dimethylbarbituric acid (hexobarbitone): a low-temperature redetermination","Acta Crystallographica Section E","2005","61","4","o1004","o1006","10.1107/S1600536805007531","","","0.71073","MoKα","","0.0402","0.0355","","","0.0946","0.099","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205416","8.574","0.002","11.467","0.002","18.374","0.003","90","","101.88","0.03","90","","1767.8","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[diaqua(imidazole)cadmium(II)]-μ-3-carboxylatophenoxyacetato] trihydrate]","","- C12 H20 Cd N2 O10 -","- C12 H20 Cd N2 O10 -","- C48 H80 Cd4 N8 O40 -","4","1","BT6621","Gao, Shan; Huo, Li-Hua; Deng, Zhao-Peng; Ng, Seik Weng","<i>catena</i>-Poly[[[diaqua(imidazole)cadmium(II)]-μ-3-carboxylatophenoxyacetato] trihydrate]","Acta Crystallographica Section E","2005","61","4","m685","m687","10.1107/S1600536805007518","","","0.71073","MoKα","","0.029","0.024","","","0.062","0.063","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205417","11.3457","0.0007","10.0117","0.0007","14.82","0.001","90","","91.372","0.001","90","","1682.92","0.19","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[[cobalt(II)-di-μ~3~-formato] dimethylformamide 0.33-solvate","","- C3 H4.33 Co N0.33 O4.33 -","- C3 H4.33333 Co N0.333333 O4.33333 -","- C36 H52 Co12 N4 O52 -","12","3","BT6622","Fu, Yun-Long; Ji, Min; Shen, Xiu-Li; Ng, Seik Weng","Polymeric cobalt(II) diformate dimethylformamide 0.33-solvate","Acta Crystallographica Section E","2005","61","4","m688","m690","10.1107/S1600536805007786","","","0.71073","MoKα","","0.042","0.033","","","0.075","0.079","","","","","","0.97","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205418","8.0912","0.0006","9.6445","0.0007","11.3013","0.0008","105.477","0.001","106.119","0.001","99.227","0.001","789.9","0.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(3-bromo-1-oxidoanthraquinone-κO^1^,O^9^)bis(pyridine-κN)zinc(II)","","- C38 H22 Br2 N2 O6 Zn -","- C38 H22 Br2 N2 O6 Zn -","- C38 H22 Br2 N2 O6 Zn -","1","0.5","BT6623","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Koushik, Saha; Hj. Lajis, Nordin; Basirun, Wan Jefri; Ng, Seik Weng","Bis(3-bromo-1-oxidoanthraquinone-κ^2^<i>O</i>^1^,<i>O</i>^9^)bis(pyridine-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2005","61","4","m691","m692","10.1107/S1600536805007592","","","0.71073","MoKα","","0.061","0.044","","","0.118","0.131","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205419","10.603","0.0006","9.778","0.0006","25.203","0.002","90","","90","","90","","2612.9","0.3","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-Hydroxysalicylaldehyde benzoylhydrazone","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C112 H96 N16 O24 -","8","1","BT6624","Ali, Hapipah M.; Puvaneswary, Subramaniam; Basirun, Wan Jefri; Ng, Seik Weng","3-Hydroxysalicylaldehyde benzoylhydrazone","Acta Crystallographica Section E","2005","61","4","o1013","o1014","10.1107/S1600536805007555","","","0.71073","MoKα","","0.0825","0.04","","","0.1021","0.1243","","","","","","0.992","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205420","7.5025","0.0005","22.508","0.0015","11.196","0.0007","90","","101.639","0.001","90","","1851.8","0.2","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-[2-hydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)prop- 2-en-1-one","","- C21 H22 O4 -","- C21 H22 O4 -","- C84 H88 O16 -","4","1","BT6625","K. Ravikumar; B. Sridhar; P. Aparna; J. Madhusudana Rao","A polymorph of bavachalcone","Acta Crystallographica Section E","2005","61","4","o1020","o1022","10.1107/S1600536805007713","","","0.71073","MoKα","","0.0682","0.0527","","","0.1457","0.1584","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205421","11.2143","0.0008","9.373","0.0007","11.4149","0.0009","90","","109.12","0.001","90","","1133.65","0.15","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Hydroxysalicylaldehyde 2-furoylhydrazone","","- C12 H10 N2 O4 -","- C12 H10 N2 O4 -","- C48 H40 N8 O16 -","4","1","BT6627","Ali, Hapipah M.; Puvaneswary, Subramaniam; Basirun, Wan Jefri; Ng, Seik Weng","3-Hydroxysalicylaldehyde 2-furoylhydrazone","Acta Crystallographica Section E","2005","61","4","o1079","o1080","10.1107/S1600536805008391","","","0.71073","MoKα","","0.063","0.041","","","0.11","0.127","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205422","6.7936","0.0009","16.988","0.002","21.515","0.003","90","","90","","90","","2483","0.6","295","2","295","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(5,6-Dihydroxy-2-methyl-1-benzofuran-3-yl) phenyl ketone","","- C16 H12 O4 -","- C16 H12 O4 -","- C128 H96 O32 -","8","1","BT6628","Pei, Li-Xi; Bu, Xian-Zhang; Gu, Lian-Quan; Ng, Seik Weng","(5,6-Dihydroxy-2-methyl-1-benzofuran-3-yl) phenyl ketone","Acta Crystallographica Section E","2005","61","4","o1081","o1082","10.1107/S1600536805008408","","","0.71073","MoKα","","0.049","0.037","","","0.103","0.114","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205423","8.265","0.001","10.51","0.001","10.841","0.001","113.855","0.002","98.767","0.002","98.39","0.002","828.45","0.15","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","N-(2-Fluorobenzylidene)-2,6-diisopropylbenzenamine","","- C19 H22 F N -","- C19 H22 F N -","- C38 H44 F2 N2 -","2","1","BT6629","Gao, Hai-Yang; Lü, Xing-Qiang; Bao, Feng; Wu, Qing; Ng, Seik Weng","<i>N</i>-(2-Fluorobenzylidene)-2,6-diisopropylaniline","Acta Crystallographica Section E","2005","61","4","o1068","o1069","10.1107/S1600536805008263","","","0.71073","MoKα","","0.078","0.055","","","0.172","0.195","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205424","9.815","0.001","23.404","0.003","18.777","0.002","90","","92.002","0.002","90","","4310.6","0.8","295","2","295","2","","","","","","","","4","C 1 c 1","C -2yc","9","","2-(2,6-Diisopropylphenylamino)cyclohex-1-enyl phenyl ketone","","- C25 H31 N O -","- C25 H31 N O -","- C200 H248 N8 O8 -","8","2","BT6630","Gui, Guo-Qiu; Bao, Feng; Lü, Xing-Qiang; Wu, Qing; Ng, Seik Weng","2-(2,6-Diisopropylphenylamino)cyclohex-1-enyl phenyl ketone","Acta Crystallographica Section E","2005","61","4","o1070","o1071","10.1107/S1600536805008135","","","0.71073","MoKα","","0.051","0.043","","","0.122","0.13","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205425","12.852","0.003","12.924","0.003","7.236","0.002","90","","91.49","0.02","90","","1201.5","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Phenylpyridinium betaine of squaric acid","4-phenylpyridinium-3-squarate","","- C15 H9 N O3 -","- C15 H9 N O3 -","- C60 H36 N4 O12 -","4","1","BT6631","Kolev, Tonsko; Wortmann, Rüdiger; Spiteller, Michael; Sheldrick, William Steven; Mayer-Figge, Heike","4-Phenylpyridinium betaine of squaric acid","Acta Crystallographica Section E","2005","61","4","o1090","o1092","10.1107/S1600536805008457","","","0.71073","MoKα","","0.0686","0.0427","","","0.1013","0.1117","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205426","7.994","0.001","11.99","0.002","24.787","0.004","90","","90","","90","","2375.8","0.6","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-Hydroxysalicylaldehyde 2-thienoylhydrazone","","- C12 H10 N2 O3 S -","- C12 H10 N2 O3 S -","- C96 H80 N16 O24 S8 -","8","2","BT6632","Ali, Hapipah M.; Puvaneswary, Subramaniam; Basirun, Wan Jefri; Ng, Seik Weng","3-Hydroxysalicylaldehyde 2-thienoylhydrazone","Acta Crystallographica Section E","2005","61","4","o1083","o1084","10.1107/S160053680500841X","","","0.71073","MoKα","","0.082","0.045","","","0.104","0.121","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205427","16.9182","0.0007","29.388","0.001","10.6777","0.0004","90","","107.174","0.001","90","","5072.2","0.3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tridecaaquadinitratohexasodium(I) bis[(trans-cyclohexane-1,2-diyldinitrilotetraacetato)nickellate(II)]","","- C14 H31 N3 Na3 Ni O17.5 -","- C14 H31 N3 Na3 Ni O17.5 -","- C112 H248 N24 Na24 Ni8 O140 -","8","1","BT6635","Long, Yu-Xiang; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Tridecaaquadinitratohexasodium(I) bis[(<i>trans</i>-cyclohexane-1,2-diyldinitrilotetraacetato)nickelate(II)]","Acta Crystallographica Section E","2005","61","4","m790","m792","10.1107/S1600536805009359","","","0.71073","MoKα","","0.0712","0.0644","","","0.1773","0.1818","","","","","","1.095","","","","has coordinates,has Fobs","197043","2020-10-21","18:00:00",""
"2205428","24.1025","0.0004","11.0675","0.0005","19.0716","0.0002","90","","90","","90","","5087.4","0.3","295","1","","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C30 H32 N2 O4 -","- C30 H32 N2 O4 -","- C240 H256 N16 O32 -","8","1","BV6011","Shan-Zhong Jian; Jian-Ming Gu; Yan-Guang Wang","3-[(2<i>R</i>*,3<i>S</i>*)-3-(2-Methoxyanilino)-2-methyl-3-phenylpropionyl]spiro[2<i>H</i>-1,3-benzoxazine-2,1'-cyclohexan]-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o990","o991","10.1107/S1600536805007361","","","0.7107","MoKα","","","0.031","","","","0.063","","","","","","1.028","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205429","9.833","0.003","25.403","0.004","5.1578","0.0019","90","","90","","90","","1288.4","0.6","298","2","298","2","","","","","","","","4","P b a 2","P 2 -2ab","32","","di-n-butyldicinnamatotin(IV)","","- C26 H32 O4 Sn -","- C26 H32 O4 Sn -","- C52 H64 O8 Sn2 -","2","0.5","BV6014","Min Hong; Handong Yin; Daqi Wang","Di-<i>n</i>-butyldicinnamatotin(IV)","Acta Crystallographica Section E","2005","61","4","m746","m747","10.1107/S160053680500735X","","","0.71073","MoKα","","0.0703","0.0442","","","0.117","0.1375","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205430","19.6113","0.0019","6.8168","0.0007","14.2923","0.0014","90","","113.551","0.002","90","","1751.5","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Cu(H~2~biim)~2~(H~2~O)](NO~3~)~2~","Aquabis(2,2'-biimidazole)copper(II) dinitrate","","- C12 H14 Cu N10 O7 -","- C12 H14 Cu N10 O7 -","- C48 H56 Cu4 N40 O28 -","4","0.5","BV6015","Sang, Ruili; Xu, Li","Aquabis(2,2'-biimidazole)copper(II) dinitrate","Acta Crystallographica Section E","2005","61","4","m793","m795","10.1107/S1600536805008378","","","0.71073","MoKα","","0.0465","0.0391","","","0.1212","0.1361","","","","","","1.006","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205431","9.5153","0.0003","9.5153","0.0003","6.8933","0.0002","90","","90","","90","","624.13","0.03","185","","185","","","","","","","","","3","P 42/m b c","-P 4c 2ab","135","","","","- C5 H10 O2 -","- C5 H10 O2 -","- C20 H40 O8 -","4","0.25","CF6408","Howard A. Shallard-Brown; David J. Watkin; Andrew R. Cowley","Ethyl propionate at 185K","Acta Crystallographica Section E","2005","61","4","o1118","o1120","10.1107/S1600536805005271","","","0.71073","MoKα","","0.0618","0.0618","","0.0996","0.0996","0.0996","","","","","","0.9034","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205432","15.4548","0.0004","9.0111","0.0002","16.4767","0.0005","90","","102.787","0.001","90","","2237.72","0.1","190","","190","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H56 N4 O7 Si2 -","- C45 H56 N4 O7 Si2 -","- C90 H112 N8 O14 Si4 -","2","1","CF6411","Humphreys, Steven; Watkin, David J.; Sanjayan, Gangadharar J.; Tranter, George E.; Edwards, Alison A.; Fleet, George W. J.","Isopropyl 2,5-anhydro-4-(2,5-anhydro-4-azido-3-<i>O</i>-<i>tert</i>-butyldiphenylsilyl-4-deoxy-<small>L</small>-ribonylamino)-3-<i>O</i>-<i>tert</i>-butyldiphenylsilyl-4-deoxy-<small>L</small>-ribonate","Acta Crystallographica Section E","2005","61","4","o918","o919","10.1107/S1600536805006689","","","0.71073","MoKα","","0.0848","0.0848","","0.1191","0.1191","0.1191","","","","","","0.9886","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205433","6.8912","0.0003","7.3504","0.0003","13.6824","0.0006","90","","90.822","0.002","90","","692.98","0.05","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","2-Acetamido-N-benzyl-1,4-imino-1,2,4-trideoxy-L-ribitol","","- C14 H20 N2 O3 -","- C14 H20 N2 O3 -","- C28 H40 N4 O6 -","2","1","CF6412","Christopher C. Harding; David J. Watkin; J. S. Shane Rountree; Terry D. Butters; Mark R. Wormald; Raymond A. Dwek; George W. J. Fleet","2-Acetamido-<i>N</i>-benzyl-1,4-imino-1,2,4-trideoxy-<small>L</small>-ribitol","Acta Crystallographica Section E","2005","61","4","o930","o932","10.1107/S1600536805006926","","","0.71073","MoKα","","0.0394","0.0336","","0.0858","0.0776","0.0858","","","","","","0.8861","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205434","7.59","0.002","12.098","0.003","22.228","0.004","90","","90","","90","","2041.1","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","21-Acetoxy-17α-4-pregnene-3,20-dione","","- C23 H32 O4 -","- C23 H32 O4 -","- C92 H128 O16 -","4","1","CF6413","Raja Dey; S. Chanda; A. Pal; S. Roychowdhury","21-Acetoxy-17α-4-pregnene-3,20-dione","Acta Crystallographica Section E","2005","61","4","o980","o982","10.1107/S1600536805007415","","","1.5418","CuKα","","0.0554","0.0541","","","0.1545","0.1549","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205435","10.8823","0.0002","5.469","0.0001","15.3816","0.0002","90","","103.882","0.0011","90","","888.7","0.03","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Amino-N,N-dibenzyl-1,6-dideoxy-β-L-fructofuranose","","- C20 H25 N O4 -","- C20 H25 N O4 -","- C40 H50 N2 O8 -","2","1","CF6414","Christopher C. Harding; David J. Watkin; David J. Hotchkiss; Joseph M.D. Cook; George W. J. Fleet","1-Amino-<i>N</i>,<i>N</i>-dibenzyl-1,6-dideoxy-β-<small>L</small>-fructofuranose","Acta Crystallographica Section E","2005","61","4","o995","o997","10.1107/S1600536805007324","","","0.71073","MoKα","","0.0424","0.0345","","0.0784","0.0744","0.0784","","","","","","0.9916","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205436","11.3352","0.0001","20.4411","0.0001","13.9594","0.0001","90","","108.303","0.001","90","","3070.81","0.04","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Bis(diphenylphosphino)ethane)dichloro(oxo)methoxorhenium(V)","","- C28 H29 Cl4 O2 P2 Re -","- C27 H27 Cl2 O2 P2 Re -","- C108 H108 Cl8 O8 P8 Re4 -","4","1","CF6416","André L. Beauchamp; Sigouin, Olivier","[1,2-Bis(diphenylphosphino)ethane]dichloro(methoxo)oxorhenium(V) dichloromethane solvate","Acta Crystallographica Section E","2005","61","4","m736","m737","10.1107/S1600536805008718","","","1.54178","CuKα","","0.052","0.0466","","","0.1198","0.122","","","","","","1.107","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205437","8.7819","0.0008","10.2641","0.0007","10.4074","0.0012","112.034","0.008","98.297","0.008","94.009","0.007","852.58","0.15","293","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H12 Cl N O4 S -","- C20 H12 Cl N O4 S -","- C40 H24 Cl2 N2 O8 S2 -","2","1","CI6509","Özgen, Özen; Ceylan‒Ünlüsoy, Meltem; Bozdag̃‒Dündar, Oya; Ertan, Rahmiye; Kendi, Engin","3-(4-Chlorobenzyl)-5-(4-oxo-4<i>H</i>-chromen-3-ylmethylene)-1,3-thiazolidine-2,4-dione","Acta Crystallographica Section E","2005","61","4","o870","o872","10.1107/S1600536805006252","","","1.5418","CuKα","","","0.0482","","","","0.1254","","","","","","1.2","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205438","6.2877","0.0006","21.724","0.002","10.9742","0.0011","90","","90.39","0.002","90","","1499","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2'-(3,4-Dimethoxybenzylidene)-2-hydroxybenzohydrazide","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C64 H64 N8 O16 -","4","1","CI6520","Jian-Guo Yang; Fu-You Pan","2'-(3,4-Dimethoxybenzylidene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2005","61","4","o831","o832","10.1107/S1600536805002497","","","0.71073","MoKα","","0.0832","0.0422","","","0.081","0.0927","","","","","","0.866","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205439","21.071","0.006","10.944","0.003","25.569","0.008","90","","114.109","0.005","90","","5382","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triphenyl[(2-oxidobenzylideneamino)acetato]antimony(V) dichloromethane solvate","","- C28 H24 Cl2 N O3 Sb -","- C28 H24 Cl2 N O3 Sb -","- C224 H192 Cl16 N8 O24 Sb8 -","8","2","CI6523","Guo-Cang Wang; Yong-Na Lu; Lin Yu; Hai-Bin Song; Jin-Shan Li","Triphenyl[(2-oxidobenzylideneamino)acetato]antimony(V) dichloromethane solvate","Acta Crystallographica Section E","2005","61","4","m649","m651","10.1107/S1600536805006446","","","0.71073","MoKα","","0.0744","0.0416","","","0.0844","0.097","","","","","","1.079","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205440","30.958","0.007","7.9544","0.0019","14.263","0.006","90","","95.53","0.03","90","","3496","1.9","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Myricetin","5-hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-3,7-dimethoxychromen-4-one","","- C19 H18 O8 -","- C19 H18 O8 -","- C152 H144 O64 -","8","1","CI6530","S. Etti; G. Shanmugam; M. N. Ponnuswamy; K. Balakrishna; Saradha Vasanth","5,3'-Dihydroxy-3,7,4',5'-tetramethoxyflavone","Acta Crystallographica Section E","2005","61","4","o846","o848","10.1107/S1600536805006161","","","0.71073","MoKα","","0.1381","0.0515","","","0.1296","0.1599","","","","","","0.985","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205441","7.667","0.002","22.862","0.006","14.654","0.004","90","","104.478","0.004","90","","2487","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-Bis(2-chlorophenyl)-1,2-bis(3,4-dimethylphenyl)ethane-1,2-diol","","- C30 H28 Cl2 O2 -","- C30 H28 Cl2 O2 -","- C120 H112 Cl8 O8 -","4","0.5","CI6531","N. Sampath; S. Aravindhan; M. N. Ponnuswamy; M. Nethaji","1,2-Bis(2-chlorophenyl)-1,2-bis(3,4-dimethylphenyl)ethane-1,2-diol","Acta Crystallographica Section E","2005","61","4","o886","o888","10.1107/S1600536805006331","","","0.71073","MoKα","","0.105","0.0758","","","0.1626","0.1747","","","","","","1.169","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205442","10.5883","0.0018","11.5887","0.0018","10.014","0.0017","90","","92.904","0.003","90","","1227.2","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2-Methoxy-5-methylphenyl) phenyl ketone","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","CI6533","Malathy Sony, S. M.; Charles, P.; Ponnuswamy, M. N.; Nethaji, M.","2-Methoxy-5-methylphenyl phenyl ketone","Acta Crystallographica Section E","2005","61","4","o801","o803","10.1107/S1600536805005775","","","0.71073","MoKα","","0.1351","0.0726","","","0.1572","0.187","","","","","","1.027","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205443","9.1652","0.0013","14.716","0.002","23.596","0.003","90","","93.918","0.004","90","","3175.1","0.7","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(2-amino-7,7-dimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline- 3-carbonitrile) monohydrate","","- C18 H20 N3 O1.5 -","- C18 H20 N3 O1.5 -","- C144 H160 N24 O12 -","8","2","CI6534","Shujiang Tu; Jinpeng Zhang; Xiaotong Zhu; Jianing Xu; Qian Wang","2-Amino-7,7-dimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile hemihydrate","Acta Crystallographica Section E","2005","61","4","o983","o985","10.1107/S1600536805007403","","","0.7107","MoKα","","0.0866","0.0684","","","0.1352","0.1433","","","","","","1.167","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205444","7.273","0.001","11.298","0.002","30.344","0.005","90","","90","","90","","2493.4","0.7","286","2","286","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","17β-hydroxy-28-norolean-12-ene-3,16-dione","","- C29 H44 O3 -","- C29 H44 O3 -","- C116 H176 O12 -","4","1","CI6536","Bai, Suping; Yang, Li","17β-Hydroxy-28-norolean-12-ene-3,16-dione","Acta Crystallographica Section E","2005","61","4","o967","o968","10.1107/S1600536805007051","","","0.71073","MoKα","","0.0804","0.0419","","","0.0796","0.0889","","","","","","0.863","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205445","10.4974","0.001","10.4974","0.001","4.0967","0.0007","90","","90","","90","","451.44","0.1","150","2","150","2","","","","","","","","3","I 4","I 4","79","metaldehyde","2,4,6,8-tetramethyl-1,3,5,7-tetroxocane","","- C8 H16 O4 -","- C8 H16 O4 -","- C16 H32 O8 -","2","0.25","CI6537","Barnett, Sarah A.; Hulme, Ashley T.; Tocher, Derek A.","A low-temperature redetermination of metaldehyde","Acta Crystallographica Section E","2005","61","4","o857","o859","10.1107/S1600536805006306","","","0.71073","MoKα","","0.0289","0.0288","","","0.0732","0.0732","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205446","15.359","0.003","13.215","0.003","12.969","0.003","90","","99.051","0.003","90","","2599.5","1","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6'-(4-Phenylpiperazin-1-yl)-1,3,3-trimethyl-2,3-dihydrospiro[1H- indole-2,3'-3H-naphth[2,1-b][1,4]oxazine]","","- C32 H32 N4 O -","- C32 H32 N4 O -","- C128 H128 N16 O4 -","4","1","CI6539","Hui Guo; Yong-Bin Gao; Yan-Xia Li; Jie Han; Ji-Ben Meng","1,3,3-Trimethyl-6'-(4-phenylpiperazin-1-yl)-2,3-dihydrospiro[1<i>H</i>-indole-2,3'-3<i>H</i>-naphth[2,1-<i>b</i>][1,4]oxazine]","Acta Crystallographica Section E","2005","61","4","o988","o989","10.1107/S1600536805007063","","","0.71073","MoKα","","0.0757","0.0453","","","0.1199","0.1392","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205447","8.2731","0.0018","25.493","0.006","8.1129","0.0018","90","","101.443","0.003","90","","1677","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Guieranone","(E)-1-(1,3,6,8-Tetramethoxynaphthalen-2-yl)but-2-en-1-one","","- C18 H20 O5 -","- C18 H20 O5 -","- C72 H80 O20 -","4","1","CI6540","M. Iqbal Choudhary; Alain Meli Lannang; Shamsher Ali; Shazia Anjum; Fernande Ngounou Ngninzeko; David Lontsi; Hoong-Kun Fun","(<i>E</i>)-1-(1,3,6,8-Tetramethoxynaphthalen-2-yl)but-2-en-1-one","Acta Crystallographica Section E","2005","61","4","o1015","o1017","10.1107/S1600536805007646","","","0.71073","MoKα","","0.0461","0.042","","","0.1202","0.1257","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205448","12.0488","0.0008","12.1842","0.0008","12.139","0.0008","90","","104.2","0.01","90","","1727.6","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,4-Diazoniabicyclo[2,2,2]octane hexaaquacobalt(II) bis(sulfate)","","- C6 H26 Co N2 O14 S2 -","- C6 H26 Co N2 O14 S2 -","- C24 H104 Co4 N8 O56 S8 -","4","1","CI6541","Ya-Juan Zhao; Xin-Hua Li; Shun Wang","1,4-Diazoniabicyclo[2.2.2]octane hexaaquacobalt(II) bis(sulfate)","Acta Crystallographica Section E","2005","61","4","m671","m672","10.1107/S1600536805007166","","","0.71073","MoKα","","0.0309","0.0293","","","0.0779","0.0792","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205449","7.1123","0.0007","12.1068","0.0012","13.3174","0.0013","80.602","0.002","84.43","0.002","77.227","0.002","1101.12","0.19","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","1,4-Diazoniabicyclo[2,2,2]octane diaquabis(pyrazole-3,5-dicarboxylato)zinc(II) dihydrate","","- C16 H26 N6 O12 Zn -","- C16 H26 N6 O12 Zn -","- C32 H52 N12 O24 Zn2 -","2","1","CI6543","Xin-Hua Li; Xin-Xiang Lei; Yi-Guang Tian; Shun Wang","1,4-Diazoniabicyclo[2.2.2]octane diaquabis(pyrazole-3,5-dicarboxylato)zincate(II) dihydrate","Acta Crystallographica Section E","2005","61","4","m702","m704","10.1107/S1600536805008019","","","0.71073","MoKα","","0.0357","0.0335","","","0.0817","0.0835","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205450","7.194","0.002","19.119","0.002","12.694","0.002","90","","95.846","0.002","90","","1736.9","0.6","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato- κ^3^O,N,N']methoxocobalt(III) perchlorate","","- C14 H13 Br Cl Co N2 O6 -","- C14 H13 Br Cl Co N2 O6 -","- C56 H52 Br4 Cl4 Co4 N8 O24 -","4","1","CI6545","Ma, Jun-Ying; Wu, Tong-Xing; She, Xue-Gong; Pan, Xin-Fu","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato-κ^3^<i>O,N,N</i>']methoxocobalt(III) perchlorate","Acta Crystallographica Section E","2005","61","4","m695","m696","10.1107/S1600536805007737","","","0.71073","MoKα","","0.074","0.0473","","","0.1203","0.134","","","","","","1.035","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205451","7.5304","0.0009","12.5739","0.0016","14.5935","0.0018","65.678","0.009","84.257","0.01","89.335","0.01","1252.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-({4-[3-Methyl-3-(2,4,6-trimethylphenyl)cyclobutyl]-3H-thiazol-2- ylidene}hydrazonomethyl)benzene-1,4-diol ethanol solvate","","- C26 H33 N3 O3 S -","- C26 H33 N3 O3 S -","- C52 H66 N6 O6 S2 -","2","1","CI6546","Çiğdem Yüksektepe; Mustafa Serkan Soylu; Hanife Saraçoğlu; Ibrahim Yılmaz; Alaaddin Çukurovali; Nezihe Çalıs̨kan","2-({4-[3-Methyl-3-(2,4,6-trimethylphenyl)cyclobutyl]-3<i>H</i>-thiazol-2-ylidene}hydrazonomethyl)benzene-1,4-diol ethanol solvate","Acta Crystallographica Section E","2005","61","4","o1158","o1160","10.1107/S1600536805008603","","","0.71073","MoKα","","0.079","0.0353","","","0.0682","0.0748","","","","","","0.8","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205452","13.169","0.002","4.0582","0.0006","17.651","0.003","90","","92.121","0.002","90","","942.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 5-bromosalicylate","","- C9 H9 Br O3 -","- C9 H9 Br O3 -","- C36 H36 Br4 O12 -","4","1","CI6549","Long-Fei Jin; Feng-Ping Xiao","Ethyl 5-bromosalicylate","Acta Crystallographica Section E","2005","61","4","o1105","o1106","10.1107/S1600536805008615","","","0.71073","MoKα","","0.0605","0.041","","","0.1053","0.1165","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205453","6.9648","0.0012","13.162","0.002","18.579","0.003","90","","91.015","0.004","90","","1702.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 5-nitrosalicylate","","- C8 H7 N O5 -","- C8 H7 N O5 -","- C64 H56 N8 O40 -","8","2","CI6550","Long-Fei Jin; Feng-Ping Xiao","Methyl 5-nitrosalicylate","Acta Crystallographica Section E","2005","61","4","o1107","o1108","10.1107/S1600536805008627","","","0.71073","MoKα","","0.1038","0.0541","","","0.1304","0.1517","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205454","4.7424","0.0007","11.3044","0.0017","18.374","0.003","90","","96.618","0.003","90","","978.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 5-nitrosalicylate","","- C9 H9 N O5 -","- C9 H9 N O5 -","- C36 H36 N4 O20 -","4","1","CI6551","Long-Fei Jin; Feng-Ping Xiao","Ethyl 5-nitrosalicylate","Acta Crystallographica Section E","2005","61","4","o1198","o1199","10.1107/S1600536805009293","","","0.71073","MoKα","","0.0922","0.0622","","","0.1899","0.2187","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205455","6.741","0.004","9.119","0.005","20.465","0.011","90","","90","","90","","1258","1.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","7-Methyl-1-(β-D-erythro-pentofuranosyl)-1H-benzimidazol-2(3H)-one","","- C13 H16 N2 O5 -","- C13 H16 N2 O5 -","- C52 H64 N8 O20 -","4","1","CI6552","Qi, Ji; Hui, Guo; Hai-Bin, Song; Fei, Huang; Ji-Ben, Meng","7-Methyl-1-(β-<small>D</small>-<i>erythro</i>-pentofuranosyl)-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o1147","o1149","10.1107/S1600536805009177","","","0.71073","MoKα","","0.0379","0.0306","","","0.0782","0.0804","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205456","6.126","0.002","8.405","0.002","30.985","0.005","90","","92.275","0.003","90","","1594.1","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-[2-(dimethylammonio)ethyliminiomethyl]naphthalen-2-olate perchlorate","","- C15 H19 Cl N2 O5 -","- C15 H19 Cl N2 O5 -","- C60 H76 Cl4 N8 O20 -","4","1","CI6554","Yuan, Chun-Lan","A perchlorate salt of 1-[(2-dimethylaminoethylimino)methyl]naphthalen-2-ol","Acta Crystallographica Section E","2005","61","4","o1182","o1183","10.1107/S1600536805009499","","","0.71073","MoKα","","0.1147","0.0801","","","0.1719","0.1897","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205457","8.6247","0.0008","8.8862","0.0009","12.7604","0.0012","78.81","0.002","89.371","0.002","81.935","0.002","949.75","0.16","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","trans-Bis[4-(4-methoxylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole- κN^1^]dithiocyanatocobalt(II)","","- C40 H30 Co N12 O2 S2 -","- C40 H30 Co N12 O2 S2 -","- C40 H30 Co N12 O2 S2 -","1","0.5","CI6555","Zhang, Shu-Ping; Shao, Si-Chang; Liu, Zhao-Di; Zhu, Hai-Liang","<i>trans</i>-Bis[4-(4-methoxyphenyl)-3,5-di-2-pyridyl-4<i>H</i>-1,2,4-triazole-κ<i>N</i>^1^]dithiocyanatocobalt(II)","Acta Crystallographica Section E","2005","61","4","m799","m800","10.1107/S1600536805009402","","","0.71073","MoKα","","0.0658","0.0569","","","0.1548","0.1864","","","","","","1.212","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205458","11.656","0.003","9.96","0.003","18.796","0.005","90","","97.776","0.005","90","","2162","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-tert-Butyl-2-(4-ethylbenzoyl)-1-(2-mercapto-3,5-dimethylbenzoyl)hydrazine","","- C22 H28 N2 O2 S -","- C22 H28 N2 O2 S -","- C88 H112 N8 O8 S4 -","4","1","CV6453","Shang, Jian; Wang, Qing-Min; Huang, Run-Qiu; Chen, Li; Song, Hai-Bin; Mao, Chun-Hui","1-<i>tert</i>-Butyl-2-(4-ethylbenzoyl)-1-(2-mercapto-3,5-dimethylbenzoyl)hydrazine","Acta Crystallographica Section E","2005","61","4","o1043","o1045","10.1107/S1600536805008123","","","0.71073","MoKα","","0.1437","0.0595","","","0.1418","0.1759","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205459","10.3133","0.0008","22.7193","0.0018","8.5237","0.0007","90","","104.58","0.001","90","","1932.9","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-(2-Chlorobenzamido)-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]- 1H-pyrazole-3-carbonitrile","","- C18 H8 Cl3 F3 N4 O -","- C18 H8 Cl3 F3 N4 O -","- C72 H32 Cl12 F12 N16 O4 -","4","1","CV6454","Xiaohong,Zhang; Ping, Zhong; Zhiping, Yang; Maolin, Hu; Hongping, Xiao","5-(2-Chlorobenzamido)-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","4","o806","o807","10.1107/S1600536805005763","","","0.71073","MoKα","","0.0628","0.0539","","","0.1201","0.1248","","","","","","1.112","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205460","21.077","0.006","9.971","0.003","37.485","0.012","90","","98.121","0.009","90","","7799","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1-[2-(Biphenyl-4-yl)-2-oxoethyl]-4-(N,N-dimethylamino)pyridinium bromide hemihydrate","","- C21 H22 Br N2 O1.5 -","- C21 H22 Br N2 O1.5 -","- C336 H352 Br16 N32 O24 -","16","2","CV6458","Sundar, T. V.; Parthasarathi, V.; Sarkunam, K.; Nallu, M.; Walfort,B.; Lang, H.","1-[2-(Biphenyl-4-yl)-2-oxoethyl]-4-(<i>N,N</i>-dimethylamino)pyridinium bromide hemihydrate","Acta Crystallographica Section E","2005","61","4","o889","o891","10.1107/S1600536805006471","","","0.71073","MoKα","","0.1297","0.0555","","","0.1145","0.1399","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205461","9.7846","0.0017","16.865","0.003","6.8914","0.0012","90","","103.934","0.003","90","","1103.7","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-Methylcorydaldine","6,7-Dimethoxy-2-methyl-3,4-dihydroisoquinolin-1(2H)-one","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C48 H60 N4 O12 -","4","1","CV6461","Said, Ikram M.; Hamid, Norizan. A. A.; Latif, Jalifah; Din, Laily B.; Yamin, Bohari M.","6,7-Dimethoxy-2-methyl-3,4-dihydroisoquinolin-1(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o797","o798","10.1107/S1600536805005787","","","0.71073","MoKα","","0.081","0.058","","","0.133","0.145","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205462","11.734","0.0019","10.3824","0.0017","36.162","0.006","90","","95.382","0.003","90","","4386.1","1.2","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis(pyrimidine-2-thiolato)bis(triphenylphosphine)ruthenium(II) chloroform solvate","","- C45 H37 Cl3 N4 P2 Ru S2 -","- C45 H37 Cl3 N4 P2 Ru S2 -","- C180 H148 Cl12 N16 P8 Ru4 S8 -","4","1","CV6463","Zhengkai Li; Jin Zhao; Lei Liang; Xiangge Zhou","Bis(pyrimidine-2-thiolato)bis(triphenylphosphine)ruthenium(II) chloroform solvate","Acta Crystallographica Section E","2005","61","4","m714","m716","10.1107/S1600536805008214","","","0.71073","MoKα","","0.0697","0.0404","","","0.0762","0.0831","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205463","6.677","0.002","10.794","0.003","22.608","0.007","90","","90","","90","","1629.4","0.8","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Isocrotocaudin","ent-(8S,10R)-15,16-epoxy-19-norcleroda-4,11,13(16),14-tetraene- 18,6(R):20,12-diolactone","","- C19 H18 O5 -","- C19 H18 O5 -","- C76 H72 O20 -","4","1","CV6464","Said, Ikram M.; Noor, Ainal F. A.; Syah, Yana M.; Latif, Jalifah; Ngah, Nurziana; Yamin, Bohari M.","<i>ent</i>-(8<i>S</i>,10<i>R</i>)-15,16-Epoxy-19-norcleroda-4,11,13(16),14-tetraene-18,6(<i>R</i>):20,12-diolactone (isocrotocaudin)","Acta Crystallographica Section E","2005","61","4","o1035","o1037","10.1107/S1600536805007725","","","0.71073","MoKα","","0.068","0.056","","","0.11","0.113","","","","","","1.18","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205464","6.0163","0.0004","29.332","0.003","9.1726","0.0008","90","0.007","90","0.007","90","0.007","1618.7","0.2","122","1","122","1","","","","","","","","4","P n a 21","P 2c -2n","33","2-(4-bromophenyl)-1-methyl-1H-phenanthro[9,10-d]imidazole","2-(4-bromophenyl)-1-methyl-1H-phenanthro[9,10-d]imidazole","","- C22 H15 Br N2 -","- C22 H15 Br N2 -","- C88 H60 Br4 N8 -","4","1","CV6465","Christian B. Nielsen; Michael Pittelkow; Henning O. Sørensen","2-(4-Bromophenyl)-1-methyl-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazole","Acta Crystallographica Section E","2005","61","4","o955","o956","10.1107/S1600536805007002","","","0.71073","MoKα","","0.0287","0.0238","","","0.054","0.0571","","","","","","1.148","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205465","8.1402","0.0016","9.3393","0.0019","11.206","0.002","107.047","0.003","103.066","0.004","106.257","0.003","736.5","0.2","289","2","289","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylate","","- C16 H16 N2 O3 -","- C16 H16 N2 O3 -","- C32 H32 N4 O6 -","2","1","CV6466","Li, Yuling; Wang, Xiangshan; Zeng, Zhaosen; Shi, Daqing; Wei, Xianyong; Zong, Zhimin","Ethyl 6-amino-5-cyano-2-methyl-4-phenyl-4<i>H</i>-pyran-3-carboxylate","Acta Crystallographica Section E","2005","61","4","o1115","o1117","10.1107/S1600536805008858","","","0.71073","MoKα","","0.0616","0.0436","","","0.102","0.1104","","","","","","0.968","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205466","8.625","0.0017","9.639","0.0019","26.273","0.005","90","","91.28","0.03","90","","2183.7","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 3-dimethylamino-2-(2-{2-dimethylamino-1-[3-(3-pyridyl)-1,2,4-oxadiazol- 5-yl]vinyloxy}phenyl)acrylate","","- C23 H25 N5 O4 -","- C23 H25 N5 O4 -","- C92 H100 N20 O16 -","4","1","CV6467","Wang, Hai-Bo; Chen, Jia-Hui; Pu, Yue-Qing; Wang, Jin-Tang","Methyl 3-dimethylamino-2-(2-{2-dimethylamino-1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]vinyloxy}phenyl)acrylate","Acta Crystallographica Section E","2005","61","4","o1010","o1012","10.1107/S160053680500766X","","","0.71073","MoKα","","0.1152","0.0527","","","0.139","0.1823","","","","","","0.926","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205467","4.5421","0.0004","15.3996","0.0015","15.3471","0.0013","90","","96.605","0.007","90","","1066.35","0.17","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(3-Chloropropyl)-2,3-dihydro-1H-isoindole-1,3-dione","","- C11 H10 Cl N O2 -","- C11 H10 Cl N O2 -","- C44 H40 Cl4 N4 O8 -","4","1","CV6468","Nagaraj, Basavegowda; Yathirajan, Hemmige S.; Bolte, Michael","2-(3-Chloropropyl)-2,3-dihydro-1<i>H</i>-isoindole-1,3-dione","Acta Crystallographica Section E","2005","61","4","o928","o929","10.1107/S1600536805006550","","","0.71073","MoKα","","0.0323","0.0289","","","0.0716","0.0736","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205468","7.5953","0.0015","14.582","0.003","10.616","0.002","90","","90.61","0.016","90","","1175.7","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4'-Methylbiphenyl-2-carboxylic acid","","- C14 H12 O2 -","- C14 H12 O2 -","- C56 H48 O8 -","4","1","CV6469","Narasegowda, Rajenahally S.; Yathirajan, Hemmige S.; Bolte, Michael","4'-Methylbiphenyl-2-carboxylic acid","Acta Crystallographica Section E","2005","61","4","o939","o940","10.1107/S1600536805006744","","","0.71073","MoKα","","0.0571","0.0318","","","0.0699","0.0771","","","","","","0.878","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205469","7.768","0.003","8.497","0.003","9.342","0.004","115.572","0.006","99.093","0.006","106.548","0.006","504.2","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-(4-Bromo-1H-pyrrole-2-carboxamido)propanoic acid","","- C8 H9 Br N2 O3 -","- C8 H9 Br N2 O3 -","- C16 H18 Br2 N4 O6 -","2","1","CV6470","Xiang-Chao Zen; Shi-Hai Xu; Po-Run Liu; Jian Gu","3-(4-Bromo-1<i>H</i>-pyrrole-2-carboxamido)propanoic acid","Acta Crystallographica Section E","2005","61","4","o1076","o1078","10.1107/S1600536805008299","","","0.71069","MoKα","","0.0428","0.0384","","","0.1002","0.1036","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205470","5.094","0.0009","5.2911","0.001","30.759","0.006","90","","91.067","0.003","90","","828.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,6-Bis(pyridine-4-carboxamido)hexane","","- C18 H22 N4 O2 -","- C18 H22 N4 O2 -","- C36 H44 N8 O4 -","2","0.5","CV6474","Cai-Feng Ding; Mei Zhu; Xue-Mei Li; Shu-Sheng Zhang; Hong Xu; Ping-Kai Ouyang","1,6-Bis(pyridine-4-carboxamido)hexane","Acta Crystallographica Section E","2005","61","4","o1103","o1104","10.1107/S1600536805008688","","","0.71073","MoKα","","0.0496","0.0413","","","0.1066","0.1131","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205471","10.114","0.015","10.537","0.015","20.92","0.03","90","","95.56","0.03","90","","2219","6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,5'-[(p-phenylenedimethylene)dithio]bis(1-phenyl-1H-1,2,3,4-tetrazole)","","- C22 H18 N8 S2 -","- C22 H18 N8 S2 -","- C88 H72 N32 S8 -","4","1","CV6479","Wei Wang; Bing Zhao; Peng-Wu Zheng; Xue-Min Duan","5,5'-[(<i>p</i>-Phenylenedimethylene)dithio]bis(1-phenyl-1<i>H</i>-1,2,3,4-tetrazole)","Acta Crystallographica Section E","2005","61","4","o1163","o1164","10.1107/S1600536805009001","","","0.71073","MoKα","","0.0698","0.0398","","","0.1068","0.1288","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205472","8.8654","0.0015","21.938","0.004","6.7526","0.0012","90","","94.967","0.002","90","","1308.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4,6-Dimethylpyrimidin-2-ylsulfanyl)-3,3-dimethylbutan-2-one","","- C12 H18 N2 O S -","- C12 H18 N2 O S -","- C48 H72 N8 O4 S4 -","4","1","CV6481","Liang-Zhong Xu; Xi-Liu Ma; Hai-Bin Song; Qi Zhu; Ya-Xun Yang","1-(4,6-Dimethylpyrimidin-2-ylsulfanyl)-3,3-dimethylbutan-2-one","Acta Crystallographica Section E","2005","61","4","o1180","o1181","10.1107/S1600536805009372","","","0.71073","MoKα","","0.0762","0.0437","","","0.1047","0.1215","","","","","","1.03","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205473","11.852","0.002","12.458","0.001","6.3861","0.0006","90","","113.84","0.01","90","","862.5","0.2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","sodium calcium magnesium iron phosphate","","- Ca0.31 Fe2 Mg Na0.38 O12 P3 -","- Ca0.312 Fe2 Mg Na0.376 O12 P3 -","- Ca1.248 Fe8 Mg4 Na1.504 O48 P12 -","4","0.5","DN6200","Zid, Mohamed Faouzi; Driss, Ahmed; Jouini, Tahar","(Na~0.38~,Ca~0.31~)MgFe~2~P~3~O~12~","Acta Crystallographica, Section E","2005","61","4","i46","i48","10.1107/S1600536805006756","","","0.71073","MoKα","","0.041","0.0309","","","0.0829","0.0881","","","","","","1.11","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205474","12.9562","0.0002","10.6502","0.0002","13.3251","0.0002","90","","114.032","0.001","90","","1679.3","0.05","292","2","292","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","piperazinediium hexaaquazinc(II) bis(sulfate)","Piperazinediium hexaaquazinc(II) bis(sulfate)","","- C4 H24 N2 O14 S2 Zn -","- C4 H24 N2 O14 S2 Zn -","- C16 H96 N8 O56 S8 Zn4 -","4","1","DN6201","Rekik, Walid; Naïli, Houcine; Mhiri, Tahar; Bataille, Thierry","Piperazinediium hexaaquazinc(II) bis(sulfate): a structural analogue of Tutton's salts","Acta Crystallographica Section E","2005","61","4","m629","m631","10.1107/S1600536805005982","","","0.71073","MoKα","","0.0699","0.0441","","","0.1105","0.1261","","","","","","1.035","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205475","5.369","0.002","10.456","0.004","11.357","0.005","107.554","0.005","96.246","0.005","94.581","0.006","600","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4,4'-Bipyridinium dipicrate","","- C22 H14 N8 O14 -","- C22 H14 N8 O14 -","- C22 H14 N8 O14 -","1","0.5","DN6203","Lu-Fang Ma; Bang-Tun Zhao; Li-Ya Wang","4,4'-Bipyridinium dipicrate","Acta Crystallographica Section E","2005","61","4","o964","o966","10.1107/S1600536805006999","","","0.71073","MoKα","","0.052","0.0346","","","0.0931","0.0985","","","","","","1.058","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205476","10.263","0.002","10.737","0.002","12.623","0.003","86.48","0.03","86.2","0.03","66.81","0.03","1274.8","0.5","295","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H19 N4 O7 V -","- C27 H19 N4 O7 V -","- C54 H38 N8 O14 V2 -","2","1","DN6204","Gao, Shan; Huo, Li-Hua; Zhang, Xian-Fa; Ng, Seik Weng","(<i>N</i>-Hydroxy-<i>N</i>-phenylbenzamidato-κ^2^<i>O</i>,<i>O</i>')oxo[salicylaldehyde (4-nitrobenzoyl)hydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']vanadium(V)","Acta Crystallographica Section E","2005","61","4","m738","m739","10.1107/S1600536805008846","","","0.71073","MoKα","","0.0559","0.0462","","","0.1359","0.143","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205477","9.975","0.0005","14.6856","0.0007","10.1388","0.0005","90","","116.812","0.002","90","","1325.55","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Z)-3-(4-Methoxybenzylidene)-2-methylisoindolin-1-one","","- C17 H15 N O2 -","- C17 H15 N O2 -","- C68 H60 N4 O8 -","4","1","DN6206","Warzecha, Klaus-Dieter; Neudörfl, Jörg M.; Griesbeck, Axel G.","(<i>Z</i>)-3-(4-Methoxybenzylidene)-2-methylisoindolin-1-one","Acta Crystallographica Section E","2005","61","4","o1074","o1075","10.1107/S1600536805008238","","","0.71073","MoKα","","0.0694","0.0446","","","0.1069","0.1162","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205478","6.5001","0.0008","11.5624","0.0014","12.7093","0.0015","90","","92.179","0.002","90","","954.5","0.2","110","","110","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(±)-1,8,8-Trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","1","DN6207","Kgomo, Ditebogo B.; Levendis, Demetrius C.; Gukasov, Arsen; Cousson, Alain; Schöning, Ludwig F. R.; Venter, Andrew M.","Low-temperature (110K) single-crystal neutron diffraction study of (±)-camphoric anhydride","Acta Crystallographica Section E","2005","61","4","o1141","o1143","10.1107/S1600536805008950","","neutron","0.833","neutron","","0.0844","0.059","","0.0627","0.0566","0.0566","","","","","","1.1006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205479","8.9729","0.0004","22.6232","0.0009","9.9288","0.0005","90","","106.427","0.004","90","","1933.23","0.16","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4'-(2-Butyl-4-chloro-5-formylimidazol-1-ylmethyl)biphenyl-2-carbonitrile","","- C22 H20 Cl N3 O -","- C22 H20 Cl N3 O -","- C88 H80 Cl4 N12 O4 -","4","1","DN6209","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Narasegowda, Rajenahally S.; Nagaraja, Padmarajaiah; Bolte, Michael","4'-(2-Butyl-4-chloro-5-formylimidazol-1-ylmethyl)biphenyl-2-carbonitrile","Acta Crystallographica Section E","2005","61","4","o1193","o1195","10.1107/S1600536805009487","","","0.71073","MoKα","","0.0463","0.0419","","","0.1086","0.1116","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205480","11.9515","0.0009","8.1082","0.0004","15.1665","0.001","90","","95.359","0.006","90","","1463.29","0.16","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(1-Benzofuran-2-yl)ethanone O-(2-chlorobenzoyl)oxime","","- C17 H12 Cl N O3 -","- C17 H12 Cl N O3 -","- C68 H48 Cl4 N4 O12 -","4","1","DN6210","Ocak Ískeleli, Nazan; Kazak, Canan; Kırılmış, Cumhur; Koca, Murat","1-(1-Benzofuran-2-yl)ethanone <i>O</i>-(2-chlorobenzoyl)oxime","Acta Crystallographica Section E","2005","61","4","o1205","o1206","10.1107/S160053680500975X","","","0.71073","MoKα","","0.0492","0.0324","","","0.0728","0.0776","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205481","11.2528","0.0002","14.3549","0.0003","20.7998","0.0005","90","","90","","90","","3359.85","0.12","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3S,4S,5S,10S,13R,14R,17R)-4α,14α-Dimethyl-3β-tosyl-5α-cholest-8-ene- 7,11-dione","","- C36 H52 O5 S -","- C36 H52 O5 S -","- C144 H208 O20 S4 -","4","1","DN6211","Auhmani, A.; Giorgi, M.; Mazoir, N.","(3<i>S</i>,4<i>S</i>,5<i>S</i>,10<i>S</i>,13<i>R</i>,14<i>R</i>,17<i>R</i>)-4α,14α-Dimethyl-3β-tosyl-5α-cholest-8-ene-7,11-dione","Acta Crystallographica Section E","2005","61","4","o1190","o1192","10.1107/S1600536805009761","","","0.71073","MoKα","","0.0683","0.0564","","","0.142","0.1561","","","","","","1.081","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205482","3.9834","0.001","25.373","0.007","7.465","0.002","90","","101.38","0.004","90","","739.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-(methylsulfanyl)nicotinic acid","2-(methylsulfanyl)nicotinic acid","","- C7 H7 N O2 S -","- C7 H7 N O2 S -","- C28 H28 N4 O8 S4 -","4","1","FL6150","Srinivas Basavoju; C. Malla Reddy; Gautam R. Desiraju","2-(Methylsulfanyl)nicotinic acid","Acta Crystallographica Section E","2005","61","4","o822","o823","10.1107/S1600536805005568","","","0.71073","MoKα","","0.0868","0.0706","","","0.1678","0.1767","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205483","9.7553","0.0009","9.7554","0.0009","11.7319","0.0011","68.582","0.001","68.58","0.001","69.34","0.01","936.05","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","5-{[(4-Chlorophenyl)methylene]amino}-1-[2,6-dichloro-4- (trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile","","- C18 H8 Cl3 F3 N4 -","- C18 H8 Cl3 F3 N4 -","- C36 H16 Cl6 F6 N8 -","2","1","FL6153","Yang, Zhiping; Zhong, Ping; Shi, Qian; Tang, Riyuan; Li, Shuyan","5-{[(4-Chlorophenyl)methylene]amino}-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","4","o949","o950","10.1107/S1600536805007075","","","0.71073","MoKα","","0.0616","0.0503","","","0.1267","0.1346","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205484","13.2451","0.0019","21.668","0.004","12.664","0.002","90","","91.69","0.02","90","","3632.9","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-{(E)-3-[(E)-4-chlorophenylimino]-4-hydroxyphenyldiazenyl}benzoic acid hemihydrate","","- C20 H15 Cl N3 O3.5 -","- C20 H15 Cl N3 O3.5 -","- C160 H120 Cl8 N24 O28 -","8","1","GH6012","Butcher, Ray J.; Basu Baul, Tushar S.; Singh, Keisham Surjit; Smith, Frank E.","A quasi-planar polyaromatic compound containing an azo and a Schiff base linkage","Acta Crystallographica Section E","2005","61","4","o1007","o1009","10.1107/S1600536805007373","","","1.54178","CuKα","","0.1404","0.0761","","","0.1585","0.2159","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205485","5.4066","0.0007","10.3363","0.0014","17.434","0.002","90","","90","","90","","974.3","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Diacetyltartaric acid anhydride","","- C8 H8 O7 -","- C8 H8 O7 -","- C32 H32 O28 -","4","1","GH6017","Zhao-Bin Qi; Ming-Jie Zhang; Dong-Yan Yuan; Shan-Shan Ma; Xiang-Qian Wang","(2<i>R</i>,3<i>R</i>)-Diacetyltartaric acid anhydride","Acta Crystallographica Section E","2005","61","4","o1085","o1086","10.1107/S1600536805008469","","","0.71073","MoKα","","0.0454","0.0351","","","0.095","0.0996","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205486","7.2959","0.0007","9.4843","0.0009","16.0204","0.0016","90","","90","","90","","1108.56","0.19","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-2-amino-1-butanol (2R,3R)-tartrate","","- C8 H17 N O7 -","- C8 H17 N O7 -","- C32 H68 N4 O28 -","4","1","GH6018","Bai, Guo-Yi; Chen, Li-Gong; Li, Yang; Yan, Xi-Long; Xing, Peng; Dong, Chuan-Ming; Duan, Xue-Min; Zhang, Yue-Cheng; Ge, Feng-Yan","(<i>S</i>)-2-Ammoniobutan-1-ol (2<i>R</i>,3<i>R</i>)-tartrate","Acta Crystallographica Section E","2005","61","4","o1125","o1126","10.1107/S1600536805008767","","","0.71073","MoKα","","0.0328","0.0303","","","0.0814","0.0828","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205487","7.1361","0.0012","17.251","0.003","19.541","0.003","90","","90","","90","","2405.6","0.7","110","2","110","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Tricarbonyl[η^6^-(S,S)-1-[2-methoxy-3,6-bis(trimethylsilyl)phenyl]-N,N- dimethylethylamine]chromium(0)","","- C20 H33 Cr N O4 Si2 -","- C20 H33 Cr N O4 Si2 -","- C80 H132 Cr4 N4 O16 Si8 -","4","1","HB6159","Braun, Wolfgang; Calmuschi, Beatrice; Totev, Daniel; Salzer, Albrecht","Tricarbonyl{η^6^-(<i>S,S</i>)-1-[2-methoxy-3,6-bis(trimethylsilyl)phenyl]-<i>N,N</i>-dimethylethylamine}chromium(0)","Acta Crystallographica Section E","2005","61","4","m647","m648","10.1107/S1600536805006008","","","0.71073","MoKα","","0.0419","0.0328","","","0.0693","0.0843","","","","","","0.921","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205488","14.011","0.003","13.247","0.002","12.701","0.002","90","","106.834","0.015","90","","2256.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","diaquadi-μ-cyano-dicyanodimethanolbis[N,N'-o-phenylenebis(pyridine-2- carboxamidato)]diiron(III)manganese(II)","","- C42 H40 Fe2 Mn N12 O10 -","- C42 H40 Fe2 Mn N12 O10 -","- C84 H80 Fe4 Mn2 N24 O20 -","2","0.5","HB6160","Ni, Zhong-Hai; Kou, Hui-Zhong; Zhang, Li-Fang; Jiang, Yun-Bo; Cui, Ai-Li","A cyano-bridged trimeric complex [Mn(CH~3~OH)~2~(H~2~O)~2~][Fe(bpb)(CN)~2~]~2~·2H~2~O [bpb^2{-^} is 1,2-bis(pyridine-2-carboxamido)benzenate]","Acta Crystallographica Section E","2005","61","4","m796","m798","10.1107/S1600536805009530","","","0.71073","MoKα","","0.0392","0.034","","","0.1029","0.112","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205489","8.7122","0.0019","10.4","0.002","12.007","0.003","93.292","0.003","107.373","0.002","112.457","0.002","941.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","tetraammonium octamolybdate bis(2-methylbenzimidazole),","","- C16 H32 Mo8 N8 O26 -","- C16 H32 Mo8 N8 O26 -","- C16 H32 Mo8 N8 O26 -","1","0.5","HB6161","Feng, Si-Si; Lu, Li-Ping; Zhang, Hong-Mei; Qin, Shi-Dong; Li, Xue-Mei; Zhu, Miao-Li","A co-crystal of 2-methylbenzimidazole and ammonium octamolybdate","Acta Crystallographica Section E","2005","61","4","m659","m661","10.1107/S1600536805006677","","","0.71073","MoKα","","0.0363","0.0315","","","0.0861","0.0888","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205490","5.4094","0.0005","7.4222","0.0008","9.4238","0.0014","110.151","0.008","105.133","0.011","92.302","0.007","339.33","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Tetraaquabis(hydrogen maleato)cadmium(II)","","- C8 H14 Cd O12 -","- C8 H14 Cd O12 -","- C8 H14 Cd O12 -","1","0.5","HB6162","Liu, Yong","Tetraaquabis(hydrogen maleato)cadmium(II)","Acta Crystallographica Section E","2005","61","4","m669","m670","10.1107/S1600536805007208","","","0.71073","MoKα","","0.0189","0.0189","","","0.0492","0.0492","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205491","26.88","0.004","8.009","0.0011","18.294","0.003","90","","123.836","0.008","90","","3271.3","0.9","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Bis(tetraethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)copper(II)","","- C22 H40 Cu N2 S10 -","- C22 H40 Cu N2 S10 -","- C88 H160 Cu4 N8 S40 -","4","1","HB6163","Wang, Xin-Qiang; Yu, Wen-Tao; Xu, Dong; Wang, Yan-Ling; Li, Ting-Bin; Zhang, Guang-Hui; Sun, Xiang-Bin; Ren, Quan","Bis(tetraethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)cuprate(II)","Acta Crystallographica Section E","2005","61","4","m717","m719","10.1107/S1600536805008159","","","0.71073","MoKα","","0.1071","0.0506","","","0.096","0.1184","","","","","","0.953","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205492","7.686","0.003","13.498","0.005","12.808","0.004","90","","93.138","0.007","90","","1326.8","0.8","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(imidazolium) tetrachlorocobaltate(II)","","- C6 H10 Cl4 Co N4 -","- C6 H10 Cl4 Co N4 -","- C24 H40 Cl16 Co4 N16 -","4","1","HB6164","Zhang, Hui; Fang, Liang; Yuan, Runzhang","Bis(imidazolium) tetrachlorocobaltate(II)","Acta Crystallographica Section E","2005","61","4","m677","m678","10.1107/S1600536805007452","","","0.71073","MoKα","","0.0551","0.0349","","","0.0733","0.0789","","","","","","0.894","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205493","10.128","0.002","15.038","0.003","24.586","0.005","90","","99.7","0.03","90","","3691","1.3","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorobis[2-(2-pyridyl)phenyl-κ^2^N,C^1^](triphenylphosphine- κP)iridium(III)‒dichloromethane (2/3)","","- C41.5 H34 Cl4 Ir N2 P -","- C41.5 H34 Cl4 Ir N2 P -","- C166 H136 Cl16 Ir4 N8 P4 -","4","1","HB6165","Wang, Yuanmin; Teng, Feng; Tang, Aiwei; Wang, Yongsheng; Xu, Xurong","Chlorobis[2-(2-pyridyl)phenyl-κ^2^<i>N,C</i>^1^](triphenylphosphine-κ<i>P</i>)iridium(III) dichloromethane sesquisolvate","Acta Crystallographica Section E","2005","61","4","m778","m780","10.1107/S1600536805008913","","","0.71073","MoKα","","0.0752","0.0506","","","0.1118","0.1198","","","","","","0.958","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205494","7.941","0.002","12.199","0.002","9.804","0.002","90","","118.18","0.03","90","","837.2","0.4","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,2'-Bipyrimidinium hexachlororhenate(IV) dihydrate","","- C8 H12 Cl6 N4 O2 Re -","- C8 H12 Cl6 N4 O2 Re -","- C16 H24 Cl12 N8 O4 Re2 -","2","0.5","HB6166","Andrzej Kochel","2,2'-Bipyrimidinium hexachlororhenate(IV) dihydrate","Acta Crystallographica Section E","2005","61","4","m759","m760","10.1107/S1600536805008937","","","0.71073","MoKα","","0.0469","0.0276","","","0.0536","0.0573","","","","","","1.074","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205495","11.045","0.0011","12.3699","0.0011","13.0539","0.0015","90","","113.148","0.01","90","","1639.9","0.3","153","2","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,5-dimethylpiperazinediium β-octamolybdate","","- C12 H32 Mo8 N4 O26 -","- C12 H32 Mo8 N4 O26 -","- C24 H64 Mo16 N8 O52 -","2","0.5","HB6167","Muller, Eric A.; Narducci Sarjeant, Amy; Norquist, Alexander J.","(C~6~H~16~N~2~)~2~[Mo~8~O~26~]: a new β-octamolybdate salt","Acta Crystallographica Section E","2005","61","4","m730","m732","10.1107/S1600536805008330","","","0.71073","MoKα","","0.0857","0.0429","","0.1104","0.0954","0.0954","","","","","","0.8516","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205496","7.2316","0.0003","10.5151","0.0004","13.4031","0.0005","90.5","0.002","103.127","0.003","100.594","0.0018","974.28","0.07","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","Tetraaquabis(1,4-di-4-pyridyl-2,3-diaza-1,3-butadiene)zinc(II) bis(perchlorate)","","- C24 H28 Cl2 N8 O12 Zn -","- C24 H28 Cl2 N8 O12 Zn -","- C24 H28 Cl2 N8 O12 Zn -","1","0.5","HB6169","Einat Tirosh; Rozi Maman; Israel Goldberg","Tetraaquabis(1,4-di-4-pyridyl-2,3-diaza-1,3-butadiene)zinc(II) bis(perchlorate) and its supramolecular assembly","Acta Crystallographica Section E","2005","61","4","m751","m754","10.1107/S1600536805008962","","","0.71073","MoKα","","0.0775","0.0578","","","0.1425","0.1517","","","","","","1.099","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205497","12.7022","0.0008","11.705","0.001","20.493","0.001","90","","105.049","0.003","90","","2942.4","0.3","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","chlorotriphenyl[3-(piperidinium-1-yl)propionato]tin(V) chloroform solvate","","- C27 H31 Cl4 N O2 Sn -","- C27 H30 Cl4 N O2 Sn -","- C108 H120 Cl16 N4 O8 Sn4 -","4","1","HB6171","Yaw-Kai Yan; Lian Ee Khoo","A 1:1 adduct of 3-(piperidin-1-yl)propionic acid with triphenyltin chloride","Acta Crystallographica Section E","2005","61","4","m781","m783","10.1107/S1600536805009517","","","0.71073","MoKα","","0.07","0.0446","","","0.1093","0.1256","","","","","","0.962","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205498","9.9326","0.0003","11.8986","0.0004","13.1517","0.0004","82.779","0.0011","84.46","0.0015","78.7095","0.0012","1508.01","0.08","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Chlorobis(1,10-phenanthroline-κ^2^N,N')copper(II) nitrate 4-nitrobenzoic acid monohydrate","","- C31 H23 Cl Cu N6 O8 -","- C31 H23 Cl Cu N6 O8 -","- C62 H46 Cl2 Cu2 N12 O16 -","2","1","HB6173","Tu-Gen Xu; Jia-Geng Liu; Duan-Jun Xu","Chlorobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) nitrate 4-nitrobenzoic acid monohydrate","Acta Crystallographica Section E","2005","61","4","m787","m789","10.1107/S1600536805009529","","","0.71073","MoKα","","0.071","0.045","","","0.101","0.11","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205499","8.735","0.002","16.569","0.004","8.764","0.002","90","","113.81","0.04","90","","1160.5","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,4-Dinitro-5,6,7,8,9,10-hexahydro-4H-cyclonona[d]isoxazole","","- C10 H13 N3 O5 -","- C10 H13 N3 O5 -","- C40 H52 N12 O20 -","4","1","HG6133","Jan Lokaj; Viktor Kettmann; Viktor Milata; Milan Marko","4,4-Dinitro-5,6,7,8,9,10-hexahydro-4<i>H</i>-cyclonona[<i>d</i>]isoxazole","Acta Crystallographica Section E","2005","61","4","o808","o810","10.1107/S1600536805004186","","","0.71073","MoKα","","0.1451","0.0561","","","0.1346","0.1623","","","","","","0.913","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205500","8.109","0.001","6.6266","0.0008","8.381","0.001","90","","113.406","0.002","90","","413.3","0.09","100","2","100","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","3-cyano-N-methylpyridinium bromide","","- C7 H7 Br N2 -","- C7 H7 Br N2 -","- C14 H14 Br2 N4 -","2","0.5","HG6136","Mague, Joel T.; Ivie, Ryan M.; Hartsock, Robert W.; Koplitz, Lynn Vogel; Spulak, Mary","3-Cyano-<i>N</i>-methylpyridinium bromide","Acta Crystallographica Section E","2005","61","4","o851","o853","10.1107/S1600536805006264","","","0.71073","MoKα","","0.0347","0.0291","","","0.0616","0.0629","","","","","","0.927","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205501","14.7792","0.0003","16.739","0.0002","14.692","0.0003","90","","132.09","0.0005","90","","2697.24","0.09","293","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H31 Cl N2 O4 -","- C30 H31 Cl N2 O4 -","- C120 H124 Cl4 N8 O16 -","4","1","HG6138","Shan-Zhong Jian; Jian-Ming Gu; Yan-Guang Wang","3-[(2<i>R</i>*,3<i>S</i>*)-3-(4-Chlorophenyl)-3-(2-methoxyanilino)-2-methylpropionyl]spiro[2<i>H</i>-1,3-benzoxazine-2,1'-cyclohexan]-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o814","o815","10.1107/S1600536805005854","","","0.7107","MoKα","","","0.038","","","","0.102","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205502","12.1981","0.001","10.1097","0.0008","19.9112","0.0016","90","","90","","90","","2455.4","0.3","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","4-Phenyl-1-(1H-1,2,4-triazol-3-ylcarbonyl)thiosemicarbazide","","- C10 H10 N6 O S -","- C10 H10 N6 O S -","- C80 H80 N48 O8 S8 -","8","1","HG6140","Ding-Ben Chen; Ling Huang; Fu-You Pan; Jian-Guo Yang","4-Phenyl-1-(1<i>H</i>-1,2,4-triazol-3-ylcarbonyl)thiosemicarbazide","Acta Crystallographica Section E","2005","61","4","o836","o837","10.1107/S1600536805003387","","","0.71073","MoKα","","0.0746","0.0419","","","0.0699","0.0768","","","","","","0.85","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205503","11.3496","0.0019","18.016","0.003","10.9165","0.0018","90","","90","","90","","2232.1","0.6","273","2","273","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","3-(2,4-Dichlorophenyl)-4-[(1E)-(2,4-dichlorophenyl)methyleneamino]- 4,5-dihydro-1H-1,2,4-triazole-5-thione dimethylformamide solvate","","- C18 H15 Cl4 N5 O S -","- C18 H15 Cl4 N5 O S -","- C72 H60 Cl16 N20 O4 S4 -","4","1","HG6143","Fang, Xiao-Niu; Zhong, Fan; Dai, Mei-Zhen; Hu, Rong-Hua","3-(2,4-Dichlorophenyl)-4-[(1<i>E</i>)-(2,4-dichlorophenyl)methyleneamino]-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione dimethylformamide solvate","Acta Crystallographica Section E","2005","61","4","o863","o865","10.1107/S1600536805006240","","","0.71073","MoKα","","0.0581","0.0311","","","0.0371","0.0388","","","","","","0.821","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205504","8.295","0.002","13.178","0.007","24.714","0.004","90","","95.412","0.001","90","","2689.5","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","benzyltrimethylammonium dihydrogen orthophosphate monohydrate.","","- C10 H20 N O5 P -","- C10 H20 N O5 P -","- C80 H160 N8 O40 P8 -","8","2","HG6146","A. Criado; María Jesús Diánez; María Dolores Estrada; Simeón Pérez-Garrido; I. M. L. Fernandes; M. Belsley; E. de Matos Gomes","Benzyltrimethylammonium dihydrogen orthophosphate monohydrate","Acta Crystallographica Section E","2005","61","4","o1127","o1129","10.1107/S1600536805008755","","","0.71069","MoKα","","0.0753","0.0512","","0.1698","","0.1429","","","1.019","","","1.014","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205505","11.366","0.0007","21.4096","0.0012","12.9034","0.0011","90","","90","","90","","3139.9","0.4","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(2,2-Dimethyl-4-oxo-1,3-thiazolidin-3-yl)-6- methylimidazo[2,1-b][1,3]thiazole-5-carboxamide monohydrate","","- C12 H16 N4 O3 S2 -","- C12 H16 N4 O3 S2 -","- C96 H128 N32 O24 S16 -","8","1","HG6147","Sema Öztürk Yıldırım; Mehmet Akkurt; Fusun Ur; Zafer Cesur; Nesrin Cesur; Orhan Büyükgüngör","<i>N</i>-(2,2-Dimethyl-4-oxo-1,3-thiazolidin-3-yl)-6-methylimidazo[2,1-<i>b</i>][1,3]thiazole-5-carboxamide monohydrate","Acta Crystallographica Section E","2005","61","4","o892","o894","10.1107/S1600536805006525","","","0.71073","MoKα","","0.086","0.0549","","","0.166","0.1783","","","","","","1.075","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205506","4.9264","0.0019","28","0.011","11.098","0.004","90","","97.957","0.007","90","","1516.1","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Hydroxy-2'-(4-isopropylbenzylidene)benzohydrazide","","- C17 H18 N2 O2 -","- C17 H18 N2 O2 -","- C68 H72 N8 O8 -","4","1","HG6148","Jian-Guo Yang; Fu-You Pan","2-Hydroxy-2'-(4-isopropylbenzylidene)benzohydrazide","Acta Crystallographica Section E","2005","61","4","o1038","o1040","10.1107/S1600536805007385","","","0.71073","MoKα","","0.1275","0.0763","","","0.2041","0.2283","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205507","16.544","0.002","15.0056","0.0019","7.3884","0.001","90","","100.22","0.002","90","","1805.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Bromophenyl)-5-(3,4-dimethoxyphenyl)-3,4-dimethylthiophene","","- C20 H19 Br O2 S -","- C20 H19 Br O2 S -","- C80 H76 Br4 O8 S4 -","4","1","HG6149","Lei, Yingjie; Shi, Jixian; Yu, Mei; Zheng, Xiufang","2-(4-Bromophenyl)-5-(3,4-dimethoxyphenyl)-3,4-dimethylthiophene","Acta Crystallographica Section E","2005","61","4","o873","o874","10.1107/S1600536805006288","","","0.71073","MoKα","","0.0913","0.0404","","","0.0903","0.1055","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205508","11.1573","0.0006","14.8063","0.0012","16.8629","0.0013","66.738","0.003","86.74","0.004","83.251","0.004","2541.4","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","N-(3-Methylphenyl)-N,N-bis(4-methylphenyl)amine","","- C21 H21 N -","- C21 H21 N -","- C126 H126 N6 -","6","3","HG6150","Manifar, Touraj; Rohani, Sohrab; Jennings, Michael, C.","<i>N</i>-(3-Methylphenyl)-<i>N,N</i>-bis(4-methylphenyl)amine","Acta Crystallographica Section E","2005","61","4","o1032","o1034","10.1107/S1600536805007488","","","0.71073","MoKα","","0.217","0.0711","","","0.1809","0.2448","","","","","","0.928","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205509","13.986","0.002","10.8228","0.0019","9.0976","0.0016","90","","108.474","0.004","90","","1306.1","0.4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","benzamidinium tetrachlogallate(III)","benzamidinium tetrachlogallate(III)","","- C7 H9 Cl4 Ga N2 -","- C7 H9 Cl4 Ga N2 -","- C28 H36 Cl16 Ga4 N8 -","4","1","HG6154","Barker, James; Errington, William; Wallbridge, Malcolm G. H.","Benzamidinium tetrachlorogallate(III)","Acta Crystallographica Section E","2005","61","4","m748","m750","10.1107/S1600536805008597","","","0.71073","MoKα","","0.096","0.0434","","","0.0659","0.0786","","","","","","0.992","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205510","8.856","0.001","9.05","0.002","12.343","0.001","85.35","0.01","87.82","0.01","64.82","0.01","892.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-Acetyl-2-phenyl-4-acetoxy-decahydroquinoline","","- C19 H25 N O3 -","- C19 H25 N O3 -","- C38 H50 N2 O6 -","2","1","HG6155","R. Padmavathy; K. Saminathan; D. Natarajan; N. Bhavani; K. Sivakumar","1-Acetyl-2-phenylperhydroquinolin-4-yl acetate","Acta Crystallographica Section E","2005","61","4","o1109","o1111","10.1107/S1600536805008780","","","0.71073","MoKα","","0.0656","0.0485","","","0.1447","0.1544","","","","","","1.111","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205511","5.6507","0.0006","12.8745","0.0017","24.386","0.003","90","","90","","90","","1774.1","0.4","293","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl (2S,3S)-3-phenyloxirane-2-carboxylate","","- C19 H26 O3 -","- C19 H26 O3 -","- C76 H104 O12 -","4","1","HG6156","Shan-Zhong Jian; Yan-Guang Wang","(1<i>R</i>,2<i>S</i>,5<i>R</i>)-2-Isopropyl-5-methylcyclohexyl (2<i>S</i>,3<i>S</i>)-3-phenyloxirane-2-carboxylate","Acta Crystallographica Section E","2005","61","4","o1135","o1136","10.1107/S1600536805008883","","","0.71069","MoKα","","","0.0467","","","","0.1235","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205512","6.9483","0.0002","22.4844","0.0005","8.2364","0.0002","90","","92.765","0.001","90","","1285.26","0.06","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3,5-dinitro-4-methylbenzoic acid DMSO solvate","3,5-dinitro-4-methylbenzoic acid dimethyl sulfoxide","","- C10 H12 N2 O7 S -","- C10 H12 N2 O7 S -","- C40 H48 N8 O28 S4 -","4","1","HG6157","Trask, A. V.; Abthorpe, M.; Jones, W.","4-Methyl-3,5-dinitrobenzoic acid‒dimethyl sulfoxide (1/1)","Acta Crystallographica Section E","2005","61","4","o1100","o1102","10.1107/S1600536805008779","","","0.71073","MoKα","","0.0626","0.0407","","","0.0914","0.1024","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205513","9.02","0.001","18.233","0.003","11.219","0.002","90","","107.908","0.002","90","","1755.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4,6-tris(pyrimidin-2-ylsulfanyl)-1,3,5-triazine","","- C15 H9 N9 S3 -","- C15 H9 N9 S3 -","- C60 H36 N36 S12 -","4","1","HG6159","Zhang, Lei; Zhao, Xin-Hua; Wang, Xiao-Dong","2,4,6-Tris(pyrimidin-2-ylsulfanyl)-1,3,5-triazine","Acta Crystallographica Section E","2005","61","4","o1133","o1134","10.1107/S1600536805008901","","","0.71073","MoKα","","0.0613","0.035","","","","0.0895","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205514","14.251","0.0012","14.251","0.0012","14.251","0.0012","116.402","0.007","116.402","0.007","116.402","0.007","1391","0.8","298","2","298","2","","","","","","","","5","R -3 :R","-P 3*","148","","Potassium ethane-1,1-bis(diazeniumdiolate) monohydrate","","- C2 H6 K2 N4 O5 -","- C2 H6 K2 N4 O5 -","- C12 H36 K12 N24 O30 -","6","1","HK6000","Arulsamy, Navamoney; Bohle, D. Scott","Dipotassium ethane-1,1-diylbis(diazeniumdiolate) monohydrate","Acta Crystallographica Section E","2005","61","4","m764","m766","10.1107/S1600536805008822","","","0.71073","MoKα","","0.0472","0.0329","","","0.0772","0.0838","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205515","9.8647","0.0008","13.3308","0.001","16.9443","0.0014","90","","101.63","0.001","90","","2182.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis[4-phenyl-5-(1H-1,2,4-triazol-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl] disulfide","","- C20 H14 N12 S2 -","- C20 H14 N12 S2 -","- C80 H56 N48 S8 -","4","1","IS6051","Fu-You Pan; Jian-Guo Yang; Ding-Ben Chen; Ling Huang","Bis[4-phenyl-5-(1<i>H</i>-1,2,4-triazol-3-yl)-4<i>H</i>-1,2,4-triazol-3-yl] disulfide","Acta Crystallographica Section E","2005","61","4","o866","o867","10.1107/S1600536805006276","","","0.71073","MoKα","","0.0655","0.0415","","","0.0789","0.0852","","","","","","0.868","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205516","8.424","0.005","10.184","0.005","20.943","0.005","90","","90","","90","","1796.7","1.4","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[[triaquacadmium(II)-μ~3~-lactato] dilactatoboron(1-)]","","- C9 H19 B Cd O12 -","- C9 H19 B Cd O12 -","- C36 H76 B4 Cd4 O48 -","4","1","IS6052","Mehmet Akkurt; Sema Öztürk Yıldırım; Jayaraman Ramajothi; Orhan Büyükgüngör; Sivasubramanian Dhanuskodi","Poly[[triaquacadmium(II)-μ~3~-lactato] dilactatoboron(1‒)]","Acta Crystallographica Section E","2005","61","4","m632","m634","10.1107/S1600536805005970","","","0.71073","MoKα","","0.0311","0.0241","","","0.0505","0.0518","","","","","","0.933","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205517","8.863","0.0016","10.3923","0.0015","12.1022","0.0016","90","","100.466","0.002","90","","1096.2","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(1H-imidazole-κN^3^)bis(3-methylbenzoato-κO)copper(II)","","- C22 H22 Cu N4 O4 -","- C22 H22 Cu N4 O4 -","- C44 H44 Cu2 N8 O8 -","2","0.5","IS6053","Tu-Gen Xu; Jia-Geng Liu; Duan-Jun Xu","Bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)bis(3-methylbenzoato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2005","61","4","m622","m624","10.1107/S1600536805005726","","","0.71073","MoKα","","0.049","0.039","","","0.098","0.103","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205518","4.911","0.0018","12.466","0.004","21.018","0.007","90","","91.299","0.006","90","","1286.4","0.8","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1-(2-Hydroxyphenyl)ethanone benzoylhydrazone","1-(2-Hydroxyphenyl)ethanone benzoylhydrazone","","- C15 H14 N2 O2 -","- C15 H14 N2 O2 -","- C60 H56 N8 O8 -","4","1","IS6055","Ngah, Nurziana; Mohamad, Nuriah; Ahmad, Musa; Yamin, Bohari M.","1-(2-Hydroxyphenyl)ethanone benzoylhydrazone","Acta Crystallographica Section E","2005","61","4","o969","o970","10.1107/S1600536805007191","","","0.71073","MoKα","","0.07","0.059","","","0.133","0.138","","","","","","1.24","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205519","6.9876","0.0003","8.1549","0.0004","8.6495","0.0003","63.53","0.002","85.004","0.003","85.179","0.002","438.96","0.03","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","4-(2-Chloroethyl)morpholinium chloride","","- C6 H13 Cl2 N O -","- C6 H13 Cl2 N O -","- C12 H26 Cl4 N2 O2 -","2","1","IS6056","Rajenahally S. Narasegowda; Hemmige S. Yathirajan; Padmarajaiah Nagaraja; Daniel E. Lynch","4-(2-Chloroethyl)morpholinium chloride","Acta Crystallographica Section E","2005","61","4","o849","o850","10.1107/S1600536805006136","","","0.71073","MoKα","","0.0351","0.0278","","","0.0716","0.078","","","","","","0.943","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205520","13.4973","0.0005","8.0905","0.0002","8.8358","0.0003","90","","102.627","0.002","90","","941.53","0.05","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(Carbamoylmethyl)cyclohexanecarboxylic acid","","- C9 H15 N O3 -","- C9 H15 N O3 -","- C36 H60 N4 O12 -","4","1","IS6057","Basavegowda Nagaraj; Hemmige S. Yathirajan; Padmarajaiah Nagaraja; Daniel E. Lynch","1-(Carbamoylmethyl)cyclohexanecarboxylic acid","Acta Crystallographica Section E","2005","61","4","o884","o885","10.1107/S1600536805006148","","","0.71073","MoKα","","0.0447","0.038","","","0.0989","0.1031","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205521","8.442","0.002","7.117","0.001","13.162","0.003","90","","103.76","0.03","90","","768.1","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-acetylpyridinium chloride","","- C7 H8 Cl N O -","- C7 H8 Cl N O -","- C28 H32 Cl4 N4 O4 -","4","1","IS6058","Andrzej Kochel","4-Acetylpyridinium chloride","Acta Crystallographica Section E","2005","61","4","o926","o927","10.1107/S1600536805006872","","","0.71073","MoKα","","0.141","0.0728","","","0.1543","0.1788","","","","","","1.103","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205522","5.617","0.0011","12.247","0.002","16.993","0.003","90","","93.06","0.03","90","","1167.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-Chloromethyl-3-[4-(methylsulfonyl)phenyl]-1,2,4-oxadiazole","","- C10 H9 Cl N2 O3 S -","- C10 H9 Cl N2 O3 S -","- C40 H36 Cl4 N8 O12 S4 -","4","1","IS6059","Wang, Hai-Bo; Chen, Jia-Hui; Pu, Yue-Qing; Wang, Jin-Tang","5-Chloromethyl-3-[4-(methylsulfonyl)phenyl]-1,2,4-oxadiazole","Acta Crystallographica Section E","2005","61","4","o953","o954","10.1107/S1600536805007087","","","0.71073","MoKα","","0.0649","0.0435","","","0.1341","0.1486","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205523","4.7477","0.0005","5.5644","0.0008","47.983","0.003","90.205","0.009","90.523","0.007","102.288","0.01","1238.5","0.2","296","1","","","","","","","","","","3","P -1","-P 1","2","","Tricosane-1,23-dithiol","","- C23 H48 S2 -","- C23 H48 S2 -","- C46 H96 S4 -","2","1","IS6060","Naotake Nakamura; Hirotaka Shimizu; Yoshihiro Ogawa","Tricosane-1,23-dithiol","Acta Crystallographica Section E","2005","61","4","o1046","o1048","10.1107/S1600536805008032","","","1.5418","CuKα","","","0.056","","","","0.126","","","","","","1.001","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205524","7.7151","0.001","8.5541","0.0011","9.6887","0.0013","88.516","0.002","76.964","0.002","83.401","0.002","618.81","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-p-Tolyl-1,3,4,4a,5,6,7,8a-octahydro-2H-pyrano[2,3-d]pyrimidin-2-one","","- C14 H18 N2 O2 -","- C14 H18 N2 O2 -","- C28 H36 N4 O4 -","2","1","JH6001","Lei Yan; Yu-Lin Zhu; Yuan-Jiang Pan","4-<i>p</i>-Tolyl-1,3,4,4a,5,6,7,8a-octahydro-2<i>H</i>-pyrano[2,3-<i>d</i>]pyrimidin-2-one","Acta Crystallographica Section E","2005","61","4","o1049","o1051","10.1107/S1600536805008147","","","0.71073","MoKα","","0.0429","0.0373","","","0.1083","0.1115","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205525","11.991","0.002","5.486","0.001","18.894","0.004","90","","94.64","0.03","90","","1238.8","0.4","293","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaquacadmium(II)]-μ-4-(carboxylatomethylsulfanyl)phenyoxyacetato]","","- C10 H12 Cd O7 S -","- C10 H12 Cd O7 S -","- C40 H48 Cd4 O28 S4 -","4","0.5","KP6025","Gao, Shan; Su, Hong; Huo, Li Hua; Ng, Seik Weng","<i>catena</i>-Poly[[diaquacadmium(II)]-μ-4-(carboxylatomethylsulfanyl)phenoxyacetato]","Acta Crystallographica Section E","2005","61","4","m725","m726","10.1107/S1600536805008500","","","0.71073","MoKα","","0.039","0.035","","","0.093","0.094","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205526","7.8208","0.0011","11.0356","0.0014","11.5767","0.0015","91.531","0.01","102.391","0.011","91.567","0.011","975","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,5-Bis(3-methoxythiophenoxy)phthalonitrile","","- C22 H16 N2 O2 S2 -","- C22 H16 N2 O2 S2 -","- C44 H32 N4 O4 S4 -","2","1","KP6030","Akbal, Tufan; Akdemir, Nesuhi; Özil, Musa; Ağar, Erbil; Erdönmez, Ahmet","4,5-Bis(3-methoxyphenylsulfanyl)phthalonitrile","Acta Crystallographica Section E","2005","61","4","o1121","o1122","10.1107/S1600536805008706","","","0.71073","MoKα","","0.1197","0.0514","","","0.1282","0.1513","","","","","","0.849","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205527","7.836","0.002","16.833","0.004","8.49","0.002","90","","96.72","0.02","90","","1112.2","0.5","293","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","2-bromobenzophenone","2-Bromobenzophenone","","- C13 H9 Br O -","- C13 H9 Br O -","- C52 H36 Br4 O4 -","4","1","KP6034","Baumer, Vyacheslav N.; Romashkin, Roman V.; Strzhemechny, Mikhail A.; Avdeenko, Anatoly A.; Pyshkin, Oleg S.; Zubatyuk, Roman I.; Buravtseva, Lyubov M.","2-Bromobenzophenone","Acta Crystallographica Section E","2005","61","4","o1170","o1172","10.1107/S1600536805009190","","","0.71073","MoKα","","","0.0383","","","","0.0641","","","","","","0.94","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205528","8.8423","0.0008","12.2784","0.0011","14.438","0.0013","90","","101.374","0.002","90","","1536.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-Bis(5-chloro-2-methyl-3-thienyl)cyclopentene","","- C15 H14 Cl2 S2 -","- C15 H14 Cl2 S2 -","- C60 H56 Cl8 S8 -","4","1","KP6041","Guan, Jin-Tao; Yin, Jun; Yu, Guang-Ao; Liu, Sheng-Hua","1,2-Bis(5-chloro-2-methyl-3-thienyl)cyclopentene","Acta Crystallographica Section E","2005","61","4","o951","o952","10.1107/S1600536805006033","","","0.71073","MoKα","","0.0814","0.0561","","","0.1652","0.1822","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205529","9.8562","0.0012","13.4978","0.0017","11.8371","0.0014","90","","90","","90","","1574.8","0.3","298","2","298","2","","","","","","","","3","A b a 2","A 2 -2ab","41","","6,6'-Dioxo-2,2-bi(7-oxatricyclo[3.2.1.1^3,8^]nonane)-4,4'-dicarboxylic acid","","- C18 H18 O8 -","- C18 H18 O8 -","- C72 H72 O32 -","4","","KP6045","Mao-Lin Hu; Ya-Qian Cheng; Shun Wang; Ji-Xin Yuan; Xiao-Qing Cai","6,6'-Dioxo-2,2-bi(7-oxatricyclo[3.2.1.1^3,8^]nonane)-4,4'-dicarboxylic acid","Acta Crystallographica Section E","2005","61","4","o1196","o1197","10.1107/S1600536805009669","","","0.71073","MoKα","","0.0414","0.0403","","","0.0881","0.0887","","","","","","1.185","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205530","16.7835","0.0004","8.458","0.0002","18.0373","0.0005","90","","111.653","0.001","90","","2379.8","0.1","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diethyl 2-aminothiazole-4,5-dicarboxylate hemihydrate","","- C9 H13 N2 O4.5 S -","- C9 H13 N2 O4.5 S -","- C72 H104 N16 O36 S8 -","8","2","KP6046","Daniel E. Lynch; Ian McClenaghan","Diethyl 2-aminothiazole-4,5-dicarboxylate hemihydrate","Acta Crystallographica Section E","2005","61","4","o824","o826","10.1107/S1600536805006197","","","0.71073","MoKα","","0.0633","0.0457","","","0.1122","0.1218","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205531","12.485","0.004","13.666","0.004","25.801","0.008","90","","90","","90","","4402","2","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,1'-Diphenyl-5,5'-[o-phenylenebis(methylenethio)]di-1H-tetrazole","","- C22 H18 N8 S2 -","- C22 H18 N8 S2 -","- C176 H144 N64 S16 -","8","1","KP6048","Luo, Xiao-Lan; Wang, Wei; Ma, Guo-Chun; Zhang, Wen-Qin","1,1'-Diphenyl-5,5'-[<i>o</i>-phenylenebis(methylenethio)]di-1<i>H</i>-tetrazole","Acta Crystallographica Section E","2005","61","4","o1161","o1162","10.1107/S1600536805009219","","","0.71073","MoKα","","0.0949","0.0513","","","0.111","0.1375","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205532","15.121","0.004","8.872","0.002","11.025","0.003","90","","90","","90","","1479","0.7","298","2","298","2","","","","","","","","3","C m c 21","C 2c -2","36","","9-Butyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione","","- C17 H22 O3 -","- C17 H22 O3 -","- C68 H88 O12 -","4","0.5","LH6333","Yu-Lin Zhu; Shen-Lin Huang; Yuan-Jiang Pan","9-Butyl-3,4,5,6,7,9-hexahydro-2<i>H</i>-xanthene-1,8-dione","Acta Crystallographica Section E","2005","61","4","o1139","o1140","10.1107/S1600536805006501","","","0.71073","MoKα","","0.0605","0.0389","","","0.0823","0.0889","","","","","","0.877","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205533","6.9281","0.0002","8.6629","0.0002","24.3962","0.0007","90","","90","","90","","1464.2","0.07","90","0.2","90","0.2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(Z)-2-(3-Thienyl)-3-(3,4,5-trimethoxyphenyl)acrylonitrile","","- C16 H15 N O3 S -","- C16 H15 N O3 S -","- C64 H60 N4 O12 S4 -","4","1","LH6335","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>Z</i>)-2-(3-Thienyl)-3-(3,4,5-trimethoxyphenyl)acrylonitrile","Acta Crystallographica Section E","2005","61","4","o933","o935","10.1107/S160053680500680X","","","0.71073","MoKα","","0.0554","0.0395","","","0.0807","0.0871","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205534","5.8067","0.001","12.7007","0.0014","8.7274","0.0007","90","","99.643","0.014","90","","634.54","0.14","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","5-Ferrocenyl-5-methyltetrahydrofuran-2-one","","- C15 H16 Fe O2 -","- C15 H16 Fe O2 -","- C30 H32 Fe2 O4 -","2","1","LH6364","Rybarczyk-Pirek, Agnieszka J.; Plażuk, Damian; Zakrzewski, Janusz","5-Ferrocenyl-5-methyltetrahydrofuran-2-one, the product of the Friedel‒Crafts reaction of ferrocene with γ-methylenebutyrolactone","Acta Crystallographica Section E","2005","61","4","m644","m646","10.1107/S1600536805006239","","","1.54178","CuKα","","0.0612","0.0488","","","0.1168","0.1274","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205535","27.937","0.009","8.828","0.003","19.072","0.006","90","","93.974","0.006","90","","4692","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[di-μ~3~-benzoato-tetra-μ~2~-benzoato-dipyrroletricadmium(II)]","","- C50 H38 Cd3 N2 O12 -","- C50 H38 Cd3 N2 O12 -","- C200 H152 Cd12 N8 O48 -","4","0.5","LH6367","Xuan-Wen Liu","<i>catena</i>-Poly[di-μ~3~-benzoato-tetra-μ~2~-benzoato-dipyrroletricadmium(II)]","Acta Crystallographica Section E","2005","61","4","m662","m663","10.1107/S160053680500677X","","","0.71073","MoKα","","0.0903","0.0432","","","0.0878","0.1149","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205536","7.3809","0.0001","8.3383","0.0001","11.8498","0.0002","94.659","0.001","97.724","0.001","93.244","0.001","718.597","0.018","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[diaquazinc(II)-μ-(diethyl dichloromethylenebisphosphonato)- κ^3^O,O':O''-tetraaquazinc(II)-μ-(diethyl dichloromethylenebisphosphonato)- κ^3^O:O',O'']","","- C5 H16 Cl2 O9 P2 Zn -","- C5 H16 Cl2 O9 P2 Zn -","- C10 H32 Cl4 O18 P4 Zn2 -","2","1","LH6370","Kontturi, Mervi; Peräniemi, Sirpa; Vepsäläinen, Jouko J.; Ahlgrén, Markku","<i>catena</i>-Poly[diaquazinc(II)-μ-(diethyl dichloromethylenebisphosphonato)-κ^3^<i>O,O</i>':<i>O</i>''-tetraaquazinc(II)-μ-(diethyl dichloromethylenebisphosphonato)-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'']","Acta Crystallographica Section E","2005","61","4","m635","m637","10.1107/S1600536805005957","","","0.71073","MoKα","","0.0242","0.0202","","","0.0518","0.0531","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205537","7.5437","0.0002","8.5071","0.0002","11.8973","0.0004","97.4564","0.0012","97.4929","0.0011","91.4131","0.0012","749.92","0.04","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[diaquacadmium(II)-μ-(diethyl dichloromethylenebisphosphonato)- κ^3^O,O':O''-tetraaquacadmium(II)-μ-(diethyl dichloromethylenebisphosphonato)- κ^3^O:O',O'']","","- C5 H16 Cd Cl2 O9 P2 -","- C5 H16 Cd Cl2 O9 P2 -","- C10 H32 Cd2 Cl4 O18 P4 -","2","1","LH6371","Kontturi, Mervi; Peräniemi, Sirpa; Vepsäläinen, Jouko J.; Ahlgrén, Markku","<i>catena</i>-Poly[diaquacadmium(II)-μ-(diethyl dichloromethylenebisphosphonato)-κ^3^<i>O,O</i>':<i>O</i>''-tetraaquacadmium(II)-μ-(diethyl dichloromethylenebisphosphonato)-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'']","Acta Crystallographica Section E","2005","61","4","m638","m640","10.1107/S1600536805005969","","","0.71073","MoKα","","0.0329","0.0261","","","0.0685","0.0716","","","","","","0.968","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205538","6.0502","0.0006","16.524","0.002","19.031","0.002","90","","95.744","0.007","90","","1893","0.4","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tert-Butyl 1,4-dioxo-3,6-diphenyl-1,2,4,5-tetrahydropyrrolo[3,4-c]pyrrole-2-carboxylate","","- C23 H20 N2 O4 -","- C23 H20 N2 O4 -","- C92 H80 N8 O16 -","4","1","LH6372","Imura, Yasuo; Senju, Takatoshi; Mizuguchi, Jin","<i>tert</i>-Butyl 1,4-dioxo-3,6-diphenyl-1,2,4,5-tetrahydropyrrolo[3,4-<i>c</i>]pyrrole-2-carboxylate","Acta Crystallographica Section E","2005","61","4","o816","o818","10.1107/S1600536805005829","","","1.5418","CuKα","","","0.0509","","","","0.1413","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205539","9.42","0.006","10.479","0.006","19.269","0.009","85.44","0.05","89.45","0.05","71.94","0.05","1802.4","1.8","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","Bis(triphenylsilyl) phenylphosphonate","","- C42 H35 O3 P Si2 -","- C42 H35 O3 P Si2 -","- C84 H70 O6 P2 Si4 -","2","1","LH6373","Ferguson, George; O'Leary, Brian J.; Spalding, Trevor R.","Bis(triphenylsilyl) phenylphosphonate","Acta Crystallographica Section E","2005","61","4","o838","o840","10.1107/S1600536805005945","","","0.7107","MoKα","","0.1508","0.0516","","","0.1189","0.1432","","","","","","0.949","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205540","7.3437","0.0004","17.944","0.001","21.34","0.001","90","","90","","90","","2812.1","0.3","295","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","5-Bromo-1H-indole-3-carbaldehyde 2-thienoylhydrazone","","- C14 H10 Br N3 O S -","- C14 H10 Br N3 O S -","- C112 H80 Br8 N24 O8 S8 -","8","1","LH6375","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Lajis, Nordin Hj.; Basirun, Wan Jefri; Zain, Sharifuddin M.; Ng, Seik Weng","5-Bromo-1<i>H</i>-indole-3-carbaldehyde 2-thienoylhydrazone","Acta Crystallographica Section E","2005","61","4","o914","o915","10.1107/S1600536805006616","","","0.71073","MoKα","","0.082","0.053","","","0.131","0.151","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205541","8.9066","0.0005","11.7021","0.0006","11.7768","0.0006","90","","97.097","0.001","90","","1218.04","0.11","295","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Oxo-2,3-dihydro-1H-indol-3-one nicotinoylhydrazone","","- C14 H10 N4 O2 -","- C14 H10 N4 O2 -","- C56 H40 N16 O8 -","4","1","LH6376","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Basirun, Wan Jefri; Ng, Seik Weng","2-Oxo-2,3-dihydro-1<i>H</i>-indol-3-one nicotinoylhydrazone","Acta Crystallographica Section E","2005","61","4","o916","o917","10.1107/S1600536805006628","","","0.71073","MoKα","","0.047","0.036","","","0.099","0.109","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205542","11.4198","0.0007","11.0121","0.0007","12.2262","0.0008","90","","93.319","0.001","90","","1534.94","0.17","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Methoxybenzoyl)-N'-(4-methoxyphenyl)thiourea","","- C16 H16 N2 O3 S -","- C16 H16 N2 O3 S -","- C64 H64 N8 O12 S4 -","4","1","LH6377","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Basirun, Wan Jefri; Ng, Seik Weng","<i>N</i>-(4-Methoxybenzoyl)-<i>N</i>'-(4-methoxyphenyl)thiourea","Acta Crystallographica Section E","2005","61","4","o1093","o1094","10.1107/S160053680500663X","","","0.71073","MoKα","","0.064","0.042","","","0.116","0.132","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205543","20.2456","0.0006","20.2456","0.0006","8.5209","0.0005","90","","90","","90","","3492.6","0.3","100","2","100","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","2,3-Bis(5-bromothien-2-yl)-6,7-dichloroquinoxaline","","- C16 H6 Br2 Cl2 N2 S2 -","- C16 H6 Br2 Cl2 N2 S2 -","- C128 H48 Br16 Cl16 N16 S16 -","8","1","LH6378","Stacy, Vanessa; Crundwell, Guy; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","2,3-Bis(5-bromo-2-thienyl)-6,7-dichloroquinoxaline","Acta Crystallographica Section E","2005","61","4","o904","o905","10.1107/S1600536805006793","","","0.71073","MoKα","","0.0407","0.031","","","0.0644","0.0674","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205544","7.8491","0.0002","10.2612","0.0003","11.2111","0.0005","78.5212","0.0012","89.0564","0.0012","73.722","0.002","848.68","0.05","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","bis(μ-ferrocene-1,1'-diyl)bis[chloro(N,N,N',N'- tetramethylethylenediamine)aluminium","","- C32 H48 Al2 Cl2 Fe2 N4 -","- C32 H48 Al2 Cl2 Fe2 N4 -","- C32 H48 Al2 Cl2 Fe2 N4 -","1","0.5","LH6380","Schachner, Jörg A.; Lund, Clinton L.; Quail, J. Wilson; Müller, Jens","The first aluminium-bridged [1.1]ferrocenophane","Acta Crystallographica Section E","2005","61","4","m682","m684","10.1107/S1600536805007695","","","0.71073","MoKα","","0.0819","0.0469","","","0.1044","0.1195","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205545","10.284","0.002","13.055","0.003","19.015","0.004","91.75","0.02","105.47","0.02","106.31","0.02","2346","0.9","294","1","294","1","","","","","","","","6","P -1","-P 1","2","","Tris(triphenylsilyl)phosphate dichloromethane solvate","","- C54.26 H45.53 Cl0.53 O4 P Si3 -","- C54.263 H45.526 Cl0.526 O4 P Si3 -","- C108.526 H91.052 Cl1.052 O8 P2 Si6 -","2","1","LH6381","Ferguson, George; O'Leary, Brian J.; Spalding, Trevor R.","Tris(triphenylsilyl)phosphate dichloromethane solvate","Acta Crystallographica Section E","2005","61","4","o906","o907","10.1107/S1600536805006604","","","0.7107","MolybdenumKα","","0.1763","0.0591","","","0.109","0.1304","","","","","","0.856","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205546","7.5132","0.0005","7.8133","0.0003","16.1313","0.0011","77.537","0.004","89.546","0.003","65.6","0.003","838.53","0.09","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","2,6-Bis(4-nitrobenzylidene)cyclohexanone","","- C20 H16 N2 O5 -","- C20 H16 N2 O5 -","- C40 H32 N4 O10 -","2","1","LH6382","Quail, J. Wilson; Das, Umashankar; Dimmock, Jonathan R.","2,6-Bis(4-nitrobenzylidene)cyclohexanone","Acta Crystallographica Section E","2005","61","4","o1150","o1152","10.1107/S1600536805008871","","","0.71073","MoKα","","0.0923","0.056","","","0.1166","0.1318","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205547","13.4405","0.0011","6.4774","0.0005","9.3684","0.0007","90","","90","","90","","815.61","0.11","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Adeninium(2+) dichloride","","- C5 H7 Cl2 N5 -","- C5 H7 Cl2 N5 -","- C20 H28 Cl8 N20 -","4","0.5","LH6383","Thomas C. Lewis; Derek A. Tocher","Redetermination of adeninium dichloride: the question of centrosymmetry","Acta Crystallographica Section E","2005","61","4","o1052","o1054","10.1107/S1600536805007993","","","0.71073","MoKα","","0.0243","0.0241","","","0.0626","0.0627","","","","","","0.985","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205548","9.364","0.004","11.445","0.004","13.597","0.006","90","","108.46","0.02","90","","1382.2","1","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichlorobis(pyridinium-2-thiolato)cadmium(II)","","- C10 H10 Cd Cl2 N2 S2 -","- C10 H10 Cd Cl2 N2 S2 -","- C40 H40 Cd4 Cl8 N8 S8 -","4","0.5","LH6384","Yi-Hang Wen; Yun-Long Feng","Dichlorobis(pyridinium-2-thiolato)cadmium(II)","Acta Crystallographica Section E","2005","61","4","m767","m768","10.1107/S1600536805009426","","","0.71073","MoKα","","","0.0189","","","0.0457","0.0464","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205549","7.127","0.0001","12.63","0.0004","13.2847","0.0004","107.338","0.0013","103.623","0.0017","101.423","0.0018","1061.98","0.05","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","11-(4-chlorophenyl)-10-methyl-8-phenyl-6,8-dihydro-5H- benzo[f]pyrazolo[3,4-b]quinoline","","- C27 H20 Cl N3 -","- C27 H20 Cl N3 -","- C54 H40 Cl2 N6 -","2","1","LH6385","Serrano, Hugo; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","11-(4-Chlorophenyl)-10-methyl-8-phenyl-6,8-dihydro-5<i>H</i>-benzo[<i>f</i>]pyrazolo[3,4-<i>b</i>]quinoline","Acta Crystallographica Section E","2005","61","4","o1058","o1060","10.1107/S160053680500797X","","","0.71073","MoKα","","0.0589","0.0412","","","0.1003","0.1101","","","","","","1.079","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205550","12.5653","0.0013","8.3613","0.001","9.9285","0.0015","90","","90.694","0.01","90","","1043","0.2","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-ethylenedisuccinimide","","- C10 H12 N2 O4 -","- C10 H12 N2 O4 -","- C40 H48 N8 O16 -","4","1","LH6386","Christopher L. Brown; Sarah J. Atkinson; Peter C. Healy","<i>N</i>,<i>N</i>'-Ethylenedisuccinimide","Acta Crystallographica Section E","2005","61","4","o1072","o1073","10.1107/S1600536805008226","","","0.7107","MoKα","","0.0657","0.0482","","","0.124","0.1367","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205551","10.3982","0.0007","5.7749","0.0004","11.248","0.0008","90","","96.132","0.001","90","","671.56","0.08","200","2","200","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C17 H16 O3 -","- C17 H16 O3 -","- C34 H32 O6 -","2","1","LH6387","George R. Clark; Kit Yee Tsang; Margaret A. Brimble","5-Methoxyspiro[1-benzofuran-2(3<i>H</i>),2'-chroman]","Acta Crystallographica Section E","2005","61","4","o1123","o1124","10.1107/S1600536805008743","","","0.71073","MoKα","","0.034","0.0298","","","0.0771","0.08","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205552","6.5683","0.0002","6.7921","0.0002","22.4418","0.0006","90","","94.206","0.002","90","","998.49","0.05","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde","","- C11 H9 Cl N2 O -","- C11 H9 Cl N2 O -","- C44 H36 Cl4 N8 O4 -","4","1","LH6388","Trilleras, Jorge; Quiroga, Jaime; Cobo, Justo; Low, John N.; Glidewell, Christopher","5-Chloro-3-methyl-1-phenyl-1<i>H</i>-pyrazole-4-carbaldehyde: sheets built from C—H···O and C—H···π(arene) hydrogen bonds","Acta Crystallographica Section E","2005","61","4","o1055","o1057","10.1107/S1600536805007981","","","0.71073","MoKα","","0.0418","0.0334","","","0.0801","0.0847","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205553","18.924","0.0002","10.996","0.001","8.8821","0.0001","90","","92.58","0.001","90","","1846.39","0.17","298","2","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Bis[tris(3,5-dimethylpyrazolyl)methane]nickel(II) dibromide","","- C32 H44 Br2 N12 Ni -","- C32 H44 Br2 N12 Ni -","- C64 H88 Br4 N24 Ni2 -","2","0.25","LH6391","Annie Michaud; Frédéric-Georges Fontaine; Davit Zargarian","Bis[tris(3,5-dimethylpyrazolyl)methane]nickel(II) dibromide","Acta Crystallographica Section E","2005","61","4","m784","m786","10.1107/S1600536805009451","","","1.54178","CuKα","","0.0436","0.0402","","0.1105","","0.1082","","","1.07","","","1.114","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205554","20.203","0.005","17.021","0.006","9.643","0.003","90","","90","","90","","3316","1.8","295","","295","","","","","","","","","4","P b c a","-P 2ac 2ab","61","Succinimido 4-(N-maleimidomethyl)cyclohexanecarboxylate","2,5-dioxo-3-pyrrolidin-1-yl 4-[(2,5-dioxo-3-pyrrolin-1-yl)methyl]cyclohexanecarboxylate","","- C16 H18 N2 O6 -","- C16 H18 N2 O6 -","- C128 H144 N16 O48 -","8","1","LH6393","Christopher L. Brown; Sarah J. Atkinson; Peter C. Healy","Succinimido 4-(<i>N</i>-maleimidomethyl)cyclohexanecarboxylate","Acta Crystallographica Section E","2005","61","4","o1203","o1204","10.1107/S1600536805009074","","","0.7107","MoKα","","0.1201","0.0425","","","0.1063","0.132","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205555","9.498","0.001","13.028","0.001","16.598","0.002","90","","95.04","0.01","90","","2045.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dimethyl[4-methyl-2,6-bis(phenyliminomethyl)phenolato-κ^2^N,O]gallium(III)","","- C23 H23 Ga N2 O -","- C23 H23 Ga N2 O -","- C92 H92 Ga4 N8 O4 -","4","1","NG6095","Gu, Wei-Jin; Li, Yi-Zhi; Pan, Yi; Liu, San-Hui","Dimethyl[4-methyl-2,6-bis(phenyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]gallium(III)","Acta Crystallographica Section E","2005","61","4","m614","m615","10.1107/S1600536805005702","","","0.71073","MoKα","","0.0564","0.0374","","","0.0824","0.0849","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205556","6.434","0.0013","22.876","0.005","16.273","0.003","90","","95.87","0.03","90","","2382.6","0.8","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Heptaaqua(isonicotinato-κ^2^O,O')lanthanum(III) 1,5-naphthalenedisulfonate","","- C16 H24 La N O15 S2 -","- C16 H24 La N O15 S2 -","- C64 H96 La4 N4 O60 S8 -","4","1","NG6104","Gao, Shan; Zhu, Zhi-Biao; Huo, Li-Hua; Zhao, Hui","Heptaaqua(isonicotinato-κ^2^<i>O,O</i>')lanthanum(III) 1,5-naphthalenedisulfonate","Acta Crystallographica Section E","2005","61","4","m656","m658","10.1107/S1600536805006513","","","0.71073","MoKα","","0.0463","0.0381","","","0.119","0.1254","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205557","9.5218","0.0006","13.5515","0.0008","13.6083","0.0008","89.216","0.001","78.692","0.001","82.348","0.001","1706.38","0.18","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(4-carboxybenzenesulfonato)bis(1,10-phenanthroline)manganese(II)","","- C38 H26 Mn N4 O10 S2 -","- C38 H26 Mn N4 O10 S2 -","- C76 H52 Mn2 N8 O20 S4 -","2","1","NG6119","Zhang, Li-Ping; Zhu, Long-Guan; Xiao, Hong-Ping","Bis(4-carboxybenzenesulfonato)bis(1,10-phenanthroline)manganese(II)","Acta Crystallographica Section E","2005","61","4","m705","m707","10.1107/S1600536805008020","","","0.71073","MoKα","","0.077","0.0718","","","0.1418","0.1444","","","","","","1.252","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205558","13.0071","0.0005","13.9756","0.0006","9.7024","0.0004","90","","96.042","0.002","90","","1753.92","0.12","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[[bis(1H-benzimidazole-κN^3^)manganese(II)]-μ-aqua-μ-succinato-κ^2^O:O']","","- C18 H18 Mn N4 O5 -","- C18 H18 Mn N4 O5 -","- C72 H72 Mn4 N16 O20 -","4","0.5","NG6122","Hong Li; Jia-Geng Liu; Duan-Jun Xu","Poly[[bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)manganese(II)]-μ-aqua-μ-succinato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","4","m761","m763","10.1107/S1600536805009098","","","0.71073","MoKα","","0.029","0.027","","","0.074","0.075","","","","","","1.107","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205559","10.1597","0.0018","17.105","0.002","12.593","0.002","90","","100.178","0.004","90","","2154","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-dichlorobis(phenanthroline-κ^2^N,N')manganese(II)","","- C24 H16 Cl2 Mn N4 -","- C24 H16 Cl2 Mn N4 -","- C96 H64 Cl8 Mn4 N16 -","4","1","OB6468","Tian-Tian Pan; Duan-Jun Xu","A polymorph of <i>cis</i>-dichlorobis(phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)","Acta Crystallographica Section E","2005","61","4","m740","m742","10.1107/S1600536805002916","","","0.71073","MoKα","","0.099","0.075","","","0.199","0.221","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205560","7.339","0.001","7.521","0.001","12.23","0.004","98.66","0.02","99.26","0.02","111.13","0.01","605.3","0.2","291","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H13 N O2 -","- C15 H13 N O2 -","- C30 H26 N2 O4 -","2","1","OB6478","De Borger, Roeland; Vande Velde, Christophe M.L.; Blockhuys, Frank","(<i>E</i>)-1-(4-Methylphenyl)-2-(4-nitrophenyl)ethene","Acta Crystallographica Section E","2005","61","4","o819","o821","10.1107/S1600536805005830","","","0.71069","MoKα","","","0.0515","","","","0.1838","","","","","","1.011","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205561","6.2769","0.0016","8.6095","0.001","14.775","0.003","91.154","0.012","90.796","0.018","103.908","0.014","774.7","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","(3RS,1SR)-3-Bromo-3-(1-phenylpropyl)chroman-2,4-dione","","- C18 H15 Br O3 -","- C18 H15 Br O3 -","- C36 H30 Br2 O6 -","2","1","OB6484","Schollmeyer, Dieter; Bernd Kammerer; Christian Peifer; Stefan Laufer","(3<i>RS</i>,1<i>S</i><i>R</i>)-3-Bromo-3-(1-phenylpropyl)chroman-2,4-dione","Acta Crystallographica Section E","2005","61","4","o868","o869","10.1107/S1600536805006124","","","1.54178","CuKα","","0.0458","0.0411","","","0.1115","0.1153","","","","","","1.117","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205562","6.756","0.002","8.783","0.003","11.271","0.004","90","","90","","90","","668.8","0.4","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R*,2S*,4S*,5S*)-Cyclohexane-1,2,4,5-tetraol","","- C6 H12 O4 -","- C6 H12 O4 -","- C24 H48 O16 -","4","1","OB6485","Goverdhan Mehta; Saikat Sen; Siddharth Dey","(1<i>R</i>*,2<i>S</i>*,4<i>S</i>*,5<i>S</i>*)-Cyclohexane-1,2,4,5-tetrol","Acta Crystallographica Section E","2005","61","4","o920","o922","10.1107/S1600536805006653","","","0.71073","MoKα","","0.0295","0.0289","","","0.0804","0.0808","","","","","","1.182","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205563","16.688","0.004","12.946","0.003","19.178","0.004","90","","111.97","0.02","90","","3842.4","1.6","93.2","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Bis[3,5-di-tert-butyl-2-hydroxybenzoato-κO]bis(dimethyl sulfoxide-κO)zinc(II)","","- C34 H54 O8 S2 Zn -","- C34 H54 O8 S2 Zn -","- C136 H216 O32 S8 Zn4 -","4","1","OB6486","Makino, Takashi; Mizuguchi, Jin","Bis[3,5-di-<i>tert</i>-butyl-2-hydroxybenzoato-κ<i>O</i>]bis(dimethyl sulfoxide-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2005","61","4","m679","m681","10.1107/S1600536805007397","","","1.5418","CuKα","","","0.0584","","","","0.1703","","","","","","0.472","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205564","8.043","0.001","11.877","0.001","20.233","0.003","90","","99.4","0.01","90","","1906.8","0.4","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 3-amino-1-(2-chlorophenyl)-9-methoxy-5,6-dihydro-1H- naphtha[2,1-b]pyran-2-carboxylate","","- C22 H20 Cl N O4 -","- C22 H20 Cl N O4 -","- C88 H80 Cl4 N4 O16 -","4","1","OB6487","Xiang-Shan Wang; Zhao-Sen Zeng; Yu-Ling Li; Da-Qing Shi; Xian-Yong Wei; Zhi-Min Zong","Methyl 3-amino-1-(2-chlorophenyl)-9-methoxy-5,6-dihydro-1<i>H</i>-naphtho[2,1-<i>b</i>]pyran-2-carboxylate","Acta Crystallographica Section E","2005","61","4","o923","o925","10.1107/S1600536805006641","","","0.71073","MoKα","","0.0712","0.0397","","","0.0907","0.098","","","","","","0.869","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205565","3.782","0.001","14.84","0.004","12.942","0.003","90","","91.93","0.02","90","","726","0.3","93.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,9-Dichloro-5,12-dihydroquino[2,3-b]acridine-7,14-dione","","- C20 H10 Cl2 N2 O2 -","- C20 H10 Cl2 N2 O2 -","- C40 H20 Cl4 N4 O4 -","2","0.5","OB6489","Senju, Takatoshi; Hoki, Tomonori; Mizuguchi, Jin","2,9-Dichloro-5,12-dihydroquino[2,3-<i>b</i>]acridine-7,14-dione","Acta Crystallographica Section E","2005","61","4","o1061","o1063","10.1107/S1600536805007634","","","1.5418","CuKα","","","0.1","","","","0.35","","","","","","1.143","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205566","24.271","0.006","11.2","0.003","23.316","0.006","90","","109.679","0.003","90","","5968","3","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrakis(1,4-dimethylpyridinium) dodecamolybdophosphate nitrate","","- C28 H40 Mo12 N5 O43 P -","- C28 H40 Mo12 N5 O43 P -","- C112 H160 Mo48 N20 O172 P4 -","4","0.5","OB6490","Xue-Jie Tan; Si-Xiu Sun; Jian-Ping Ma; Shu-Lian Liu; Dian-Xiang Xing","Tetrakis(1,4-dimethylpyridinium) dodecamolybdophosphate nitrate","Acta Crystallographica Section E","2005","61","4","m711","m713","10.1107/S1600536805008044","","","0.71073","MoKα","","0.1217","0.081","","","0.1665","0.1831","","","","","","1.105","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205567","4.729","0.002","8.282","0.002","14.693","0.004","89.35","0.02","91.15","0.03","104.83","0.03","556.2","0.3","93.2","","","","","","","","","","","4","P -1","-P 1","2","","Dibenzimidazo[2,1-a:2',1'-a']anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline- 10,21-dione","","- C36 H16 N4 O2 -","- C36 H16 N4 O2 -","- C36 H16 N4 O2 -","1","0.5","OB6491","Mizuguchi, Jin","Dibenzimidazo[2,1-<i>a</i>:2',1'-<i>a</i>']anthra[2,1,9-<i>def</i>:6,5,10-<i>d</i>'<i>e</i>'<i>f</i>']diisoquinoline-10,21-dione: <i>trans</i> form (I)","Acta Crystallographica Section E","2005","61","4","o1064","o1065","10.1107/S1600536805008056","","","1.5418","CuKα","","","0.1018","","","","0.2218","","","","","","0.933","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205568","4.7501","0.0006","28.079","0.003","8.728","0.001","90","","99.21","0.01","90","","1149.1","0.2","93.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dibenzimidazo[2,1-a:2',1'-a']anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline- 10,21-dione","","- C36 H16 N4 O2 -","- C36 H16 N4 O2 -","- C72 H32 N8 O4 -","2","0.5","OB6492","Mizuguchi, Jin","Dibenzimidazo[2,1-<i>a</i>:1',2'-<i>b</i>']anthra[2,1,9-<i>def</i>:6,5,10-<i>d</i>'<i>e</i>'<i>f</i>']diisoquinoline-6,11-dione: <i>cis</i> form (II)","Acta Crystallographica Section E","2005","61","4","o1066","o1067","10.1107/S1600536805008068","","","1.5418","CuKα","","","0.0825","","","","0.1955","","","","","","1.144","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205569","3.871","0.0004","21.44","0.002","18.7091","0.0019","90","","95.555","0.002","90","","1545.5","0.3","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E,E,E)-1,6-Bis(4-nitrophenyl)hexa-1,3,5-triene","","- C18 H14 N2 O4 -","- C18 H14 N2 O4 -","- C72 H56 N8 O16 -","4","1","OB6494","Yoriko Sonoda; Yuji Kawanishi; Midori Goto","(<i>E</i>,<i>E</i>,<i>E</i>)-1,6-Bis(4-nitrophenyl)hexa-1,3,5-triene","Acta Crystallographica Section E","2005","61","4","o1200","o1202","10.1107/S1600536805009736","","","0.71073","MoKα","","0.0585","0.04","","","0.1047","0.1258","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205570","9.797","0.002","10.29","0.003","13.856","0.003","90","","90","","90","","1396.8","0.6","290","2","290","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","6-tert-Butyl-4-isopropylideneamino-3-methylsulfanyl-1,2,4-triazin-5(4H)-one","","- C11 H18 N4 O S -","- C11 H18 N4 O S -","- C44 H72 N16 O4 S4 -","4","1","OB6495","Chopra, Deepak; Mohan, T. P.; Rao, K.S.; Guru Row, T. N.","6-<i>tert</i>-Butyl-4-isopropylideneamino-3-methylsulfanyl-1,2,4-triazin-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o1112","o1114","10.1107/S1600536805008585","","","0.71073","MoKα","","0.0547","0.047","","","0.1027","0.1058","","","","","","1.151","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205571","10.044","0.002","7.2816","0.0015","25.006","0.005","90","","90","","90","","1828.8","0.6","297","2","297","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Cu2Br4(mu-O-Py-NO2)2","Bis(μ-4-nitropyridine N-oxide-κ^2^O:O)bis[bromocopper(II)]","","- C10 H8 Br4 Cu2 N4 O6 -","- C10 H8 Br4 Cu2 N4 O6 -","- C40 H32 Br16 Cu8 N16 O24 -","4","0.5","OM6228","Twamley, Brendan","Bis(μ-4-nitropyridine <i>N</i>-oxide-κ^2^<i>O</i>:<i>O</i>)bis[dibromocopper(II)]","Acta Crystallographica Section E","2005","61","4","m619","m621","10.1107/S1600536805005441","","","0.71073","MoKα","","0.0542","0.0443","","","0.1074","0.1142","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205572","5.995","0.004","10.54","0.004","12.586","0.006","90","","90","","90","","795.3","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[zinc(II)-μ~2~-azido-κ^2^N^1^:N^1^-μ~3~-nicotinato-κ^3^N:O:O']","","- C6 H4 N4 O2 Zn -","- C6 H4 N4 O2 Zn -","- C24 H16 N16 O8 Zn4 -","4","1","OM6229","Chen, Hong-Ji","Poly[zinc(II)-μ~2~-azido-κ^2^<i>N</i>^1^:<i>N</i>^1^-μ~3~-nicotinato-κ^3^<i>N</i>:<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","4","m616","m618","10.1107/S1600536805005866","","","0.71073","MoKα","","0.0283","0.0242","","","0.0583","0.0599","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205573","12.415","0.0007","12.415","0.0007","28.03","0.003","90","","90","","120","","3741.5","0.5","153","2","153","2","","","","","","","","6","R -3 :H","-R 3","148","","Hexakis(μ~4~-2-amino-2-methylpropane-1,3-diolato)hexachloroheptairon(II,III) acetonitrile disolvate monohydrate","","- C28 H62 Cl6 Fe7 N8 O13 -","- C28 H59.94 Cl6 Fe7 N8 O13 -","- C84 H179.82 Cl18 Fe21 N24 O39 -","3","0.166667","OM6230","Gaël Labat; Colette Boscovic; Hans U. Güdel","Hexakis(μ~4~-2-amino-2-methylpropane-1,3-diolato)hexachloroheptairon(II,III) acetonitrile disolvate monohydrate","Acta Crystallographica Section E","2005","61","4","m611","m613","10.1107/S160053680500557X","","","0.71073","MoKα","","0.114","0.0652","","","0.156","0.1688","","","","","","0.883","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205574","7.285","0.001","24.298","0.002","11.945","0.001","90","","93.523","0.002","90","","2110.4","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ-Piperidine-κ^2^N:N'-bis[(3-nitrobenzoato-κO)silver(I)] monohydrate","","- C18 H20 Ag2 N4 O9 -","- C18 H20 Ag2 N4 O9 -","- C72 H80 Ag8 N16 O36 -","4","1","OM6231","Li, Yu-Guang; Wang, Meng; Zhu, Hai-Liang","μ-Piperidine-κ^2^<i>N</i>:<i>N</i>'-bis[(3-nitrobenzoato-κ<i>O</i>)silver(I)] monohydrate","Acta Crystallographica Section E","2005","61","4","m667","m668","10.1107/S1600536805007026","","","0.71073","MoKα","","0.0603","0.0509","","","0.1089","0.1149","","","","","","1.045","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205575","10.492","0.0006","23.6166","0.0013","10.6391","0.0006","90","","91.436","0.001","90","","2635.4","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Di-μ~2~-Iodo-bis[(1,10-phenanthroline-κ^2^N,N')copper(I)] acetonitrile solvate","","- C26 H19 Cu2 I2 N5 -","- C26 H19 Cu2 I2 N5 -","- C104 H76 Cu8 I8 N20 -","4","1","RN6037","Zhou, Xiao-Ping; Li, Dan; Ng, Seik Weng","Di-μ~2~-Iodo-bis[(1,10-phenanthroline-κ^2^N,N')copper(I)] acetonitrile solvate","Acta Crystallographica, Section E","2005","61","4","m654","1m655","10.1107/S1600536805006458","","","0.71073","MoKα","","0.0581","0.041","","","0.0991","0.107","","","","","","1.026","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205576","4.8587","0.0011","13.228","0.003","14.612","0.003","90","","93.862","0.004","90","","937","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Guaninium chloride dihydrate","","- C5 H10 Cl N5 O3 -","- C5 H10 Cl N5 O3 -","- C20 H40 Cl4 N20 O12 -","4","1","RN6044","Thomas C. Lewis; Derek A. Tocher","Redetermination of guaninium chloride dihydrate","Acta Crystallographica Section E","2005","61","4","o1023","o1025","10.1107/S160053680500752X","","","0.71073","MoKα","","0.0401","0.0315","","","0.0778","0.0817","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205577","10.63","0.019","18","0.03","12.54","0.02","90","","108.75","0.03","90","","2272","7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N-{3-Cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}-4- nitrobenzamide ethanol solvate","","- C20 H14 Cl2 F3 N5 O4 -","- C20 H14 Cl2 F3 N5 O4 -","- C80 H56 Cl8 F12 N20 O16 -","4","1","RZ6048","Zhong, Ping; Yang, Zhiping; Shi, Qian","<i>N</i>-{3-Cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazol-5-yl}-4-nitrobenzamide ethanol solvate","Acta Crystallographica Section E","2005","61","4","o841","o842","10.1107/S1600536805006112","","","0.71073","MoKα","","0.078","0.055","","","0.15","0.167","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205578","6.7145","0.0012","10.931","0.002","13.616","0.003","77.464","0.003","83.116","0.003","81.47","0.003","960.8","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(4-methoxyphenyl)methylene]imino- 1H-pyrazole-3-enitrile","","- C19 H11 Cl2 F3 N4 O -","- C19 H11 Cl2 F3 N4 O -","- C38 H22 Cl4 F6 N8 O2 -","2","1","RZ6054","Zhang, Xiaohong; Yang, Zhiping; Zhong, Ping; Hu, Maolin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-methoxyphenyl)methyleneimino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","4","o908","o909","10.1107/S1600536805006707","","","0.71073","MoKα","","0.125","0.09","","","0.194","0.211","","","","","","1.146","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205579","8.9637","0.0009","24.689","0.003","9.099","0.0009","90","","117.788","0.006","90","","1781.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-3-(9-Ethyl-9H-carbazol-3-yl)-1-(2-hydroxyphenyl)prop-2-en-1-one","","- C23 H19 N O2 -","- C23 H19 N O2 -","- C92 H76 N4 O8 -","4","1","RZ6055","Cao, Du-Xia; Li, Guo-Zhong; Xue, Gang; Yu, Wen-Tao; Liu, Zhi-Qiang","(<i>E</i>)-3-(9-Ethyl-9<i>H</i>-carbazol-3-yl)-1-(2-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","4","o977","o979","10.1107/S1600536805006987","","","0.71073","MoKα","","0.1091","0.0492","","","0.1114","0.1446","","","","","","0.951","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205580","5.8149","0.0005","10.9359","0.001","12.9304","0.0012","73.684","0.002","86.383","0.001","79.589","0.002","776.09","0.12","84","1","84","1","","","","","","","","3","P -1","-P 1","2","","6,8'-Dimethoxy-2,2'-spirobichroman","","- C19 H20 O4 -","- C19 H20 O4 -","- C38 H40 O8 -","2","1","RZ6056","George R. Clark; Christopher L. Flowers; Margaret A. Brimble","6,8'-Dimethoxy-2,2'-spirobichroman","Acta Crystallographica Section E","2005","61","4","o910","o911","10.1107/S1600536805006938","","","0.71073","MoKα","","0.1301","0.068","","","0.146","0.1734","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205581","5.362","0.0001","8.5764","0.0002","15.0992","0.0004","75.564","0.001","80.4","0.001","79.137","0.001","655.13","0.03","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(dimethyl sulfoxide)bis(2,4-dinitrobenzoato)cobalt(II)","","- C18 H22 Co N4 O16 S2 -","- C18 H22 Co N4 O16 S2 -","- C18 H22 Co N4 O16 S2 -","1","0.5","RZ6058","Miminoshvili, Elguja B.; Miminoshvili, Ketevan E.; Sobolev, Alexandre N.","Diaquabis(dimethyl sulfoxide)bis(2,4-dinitrobenzoato)cobalt(II)","Acta Crystallographica Section E","2005","61","4","m775","m777","10.1107/S1600536805009050","","","0.71073","MoKα","","0.0307","0.0259","","","0.0721","0.0747","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205582","4.693","0.001","19.14","0.003","12.682","0.002","90","","97.973","0.002","90","","1128.1","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(o-Tolyliminomethyl)phenol","","- C14 H13 N O -","- C14 H13 N O -","- C56 H52 N4 O4 -","4","1","RZ6059","Cheng, Kui; You, Zhong-Lu; Li, Yu-Guang; Zhu, Hai-Liang","2-(<i>o</i>-Tolyliminomethyl)phenol","Acta Crystallographica Section E","2005","61","4","o1137","o1138","10.1107/S1600536805008986","","","0.71073","MoKα","","0.1013","0.0565","","","0.1222","0.1419","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205583","10.931","0.002","9.149","0.002","12.522","0.001","90","","110.94","0.02","90","","1169.6","0.4","298","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[2-(o-tolyliminomethyl)phenolato]copper(II)","","- C28 H24 Cu N2 O2 -","- C28 H24 Cu N2 O2 -","- C56 H48 Cu2 N4 O4 -","2","0.5","RZ6060","Zhu, Hai-Liang; Cheng, Kui; You, Zhong-Lu; Li, Yu-Guang","Bis[2-(<i>o</i>-tolyliminomethyl)phenolato]copper(II)","Acta Crystallographica Section E","2005","61","4","m755","m756","10.1107/S1600536805009025","","","0.71073","MoKα","","0.1146","0.0597","","","0.1566","0.1969","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205584","19.994","0.003","5.402","0.0008","9.0305","0.0015","90","","99.939","0.013","90","","960.7","0.3","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylaminium chloride","","- C7 H5 Cl F5 N O -","- C7 H5 Cl F5 N O -","- C28 H20 Cl4 F20 N4 O4 -","4","1","RZ6061","Maria Gdaniec","<i>O</i>-(2,3,4,5,6-Pentafluorobenzyl)hydroxylaminium chloride","Acta Crystallographica Section E","2005","61","4","o1187","o1189","10.1107/S1600536805009347","","","0.71073","MoKα","","0.0757","0.039","","","0.0807","0.0895","","","","","","0.897","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205585","12.439","0.004","16.9472","0.0018","7.4504","0.0008","90","","106.437","0.018","90","","1506.4","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methylanilinium picrate","","- C13 H12 N4 O7 -","- C13 H12 N4 O7 -","- C52 H48 N16 O28 -","4","1","SG6000","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar","3-Methylanilinium picrate","Acta Crystallographica Section E","2005","61","4","o1153","o1155","10.1107/S1600536805009189","","","1.54178","CuKα","","0.0647","0.0552","","","0.1596","0.1702","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205586","13.636","0.006","7.218","0.003","12.467","0.006","90","","105.398","0.006","90","","1183","0.9","163","2","163","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(±)-5-Ethyl-1-methyl-5-phenylpyrimidine-2,4,6-trione","(±)-5-Ethyl-1-methyl-5-phenylpyrimidine-2,4,6-trione","","- C13 H14 N2 O3 -","- C13 H14 N2 O3 -","- C52 H56 N8 O12 -","4","1","SJ6050","Lewis, William; McKeown, Robert H.; Robinson, Ward T.","(±)-5-Ethyl-1-methyl-5-phenylpyrimidine-2,4,6-trione at 163K","Acta Crystallographica Section E","2005","61","4","o799","o800","10.1107/S1600536805005593","","","0.71073","MoKα","","0.0669","0.0421","","","0.1092","0.1273","","","","","","1.084","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205587","8.3575","0.0014","15.114","0.002","7.184","0.0012","90","","90","","90","","907.4","0.2","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Dibromoazulene","1,3-Dibromoazulene","","- C10 H6 Br2 -","- C10 H6 Br2 -","- C40 H24 Br8 -","4","0.5","SJ6051","Chen, Xue-Yi; Dias, Jerry R.; Powell, Doug R.; Van Horn, J. David; Sandreczki, Thomas C.","1,3-Dibromoazulene","Acta Crystallographica Section E","2005","61","4","o941","o943","10.1107/S1600536805006811","","","0.71073","MoKα","","0.018","0.0162","","","0.0445","0.0457","","","","","","0.957","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205588","7.487","0.003","23.287","0.009","5.675","0.002","90","","95.579","0.007","90","","984.7","0.6","100","2","100","2","","","","","","","","3","C 1 c 1","C -2yc","9","Diiodoazulene","1,3-Diiodoazulene","","- C10 H6 I2 -","- C10 H6 I2 -","- C40 H24 I8 -","4","1","SJ6052","Chen, Xue-Yi; Dias, Jerry R.; Powell, Doug R.; Van Horn, J. David; Sandreczki, Thomas C.","1,3-Diiodoazulene","Acta Crystallographica Section E","2005","61","4","o944","o946","10.1107/S1600536805006823","","","0.71073","MoKα","","0.0212","0.0211","","","0.055","0.055","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205589","10.597","0.005","11.996","0.011","13.046","0.006","85.58","0.06","73.76","0.04","76.2","0.07","1546.2","1.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Octaureasamarium(III) triiodide","","- C8 H32 I3 N16 O8 Sm -","- C8 H32 I3 N16 O8 Sm -","- C16 H64 I6 N32 O16 Sm2 -","2","1","SJ6053","Elena V. Savinkina; Yana F. Al Ansari; Ilya A. Zamilatskov; Dmitry V. Albov; Aslan Yu. Tsivadze","Octaureasamarium(III) triiodide","Acta Crystallographica Section E","2005","61","4","m664","m666","10.1107/S1600536805006781","","","0.71073","MoKα","","0.0823","0.0363","","","0.0507","0.0581","","","","","","0.93","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205590","13.27","0.005","11.612","0.005","10.53","0.006","90","","112.48","0.03","90","","1499.3","1.3","297","2","297","2","","","","","","","","7","P 1 21 1","P 2yb","4","","Diaqua[(1R,2R)-N,N'-bis(3,5-dibromosalicylidene)cyclohexane-1,2-diamine- κ^4^O,N,N',O']manganese(III) perchlorate dihydrate","","- C20 H24 Br4 Cl Mn N2 O10 -","- C20 H16 Br4 Cl Mn N2 O10 -","- C40 H32 Br8 Cl2 Mn2 N4 O20 -","2","1","SJ6054","Akitsu, Takashiro; Takeuchi, Yuiri; Einaga, Yasuaki","Diaqua[(1<i>R</i>,2<i>R</i>)-<i>N</i>,<i>N</i>'-bis(3,5-dibromosalicylidene)cyclohexane-1,2-diamine-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']manganese(III) perchlorate dihydrate","Acta Crystallographica Section E","2005","61","4","m772","m774","10.1107/S1600536805009062","","","0.71073","MoKα","","0.1037","0.0416","","","0.0983","0.1224","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205591","7.547","0.003","9.122","0.002","11.437","0.003","107.905","0.002","108.506","0.004","92.139","0.003","702.5","0.4","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","2-(2,3-Dimethoxyphenyl)chroman-4-one","","- C17 H16 O4 -","- C17 H16 O4 -","- C34 H32 O8 -","2","1","SJ6057","Hui Wu; Zhou Xu; Jun Zhou; Yongmin Liang","2-(2,3-Dimethoxyphenyl)chroman-4-one","Acta Crystallographica Section E","2005","61","4","o1095","o1096","10.1107/S160053680500838X","","","0.71073","MoKα","","0.1093","0.0514","","","0.1065","0.126","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205592","28.991","0.002","5.9448","0.0005","21.5013","0.0018","90","","111.848","0.002","90","","3439.5","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis[4,4'-oxydibenzoato(1-)]cadmium(II)]-μ-1,2-di-4- pyridylethylene]","","- C40 H28 Cd N2 O10 -","- C40 H28 Cd N2 O10 -","- C160 H112 Cd4 N8 O40 -","4","0.5","SJ6058","Yin, De-Wu; Xiao, Hong-Ping","<i>catena</i>-Poly[[bis[4,4'-oxydibenzoato(1‒)]cadmium(II)]-μ-1,2-di-4-pyridylethylene]","Acta Crystallographica Section E","2005","61","4","m708","m710","10.1107/S1600536805008007","","","0.71073","MoKα","","0.0637","0.056","","","0.1191","0.1231","","","","","","1.209","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205593","7.6386","0.0009","8.259","0.002","15.761","0.0012","84.415","0.012","89.48","0.008","74.529","0.019","953.6","0.3","292","2","292","2","","","","","","","","3","P 1","P 1","1","","17-Oxo-5β-hydroxyandrostan-3β-yl acetate","","- C21 H32 O4 -","- C21 H32 O4 -","- C42 H64 O8 -","2","2","SJ6059","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J. M.; Tavares da Silva, E. J.; Fernandes Roleira, F. M.","17-Oxo-5β-hydroxyandrostan-3β-yl acetate","Acta Crystallographica Section E","2005","61","4","o1144","o1146","10.1107/S1600536805008895","","","1.5418","CuKα","","0.0358","0.0324","","","0.0882","0.092","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205594","8.7176","0.0004","7.5589","0.0003","17.5879","0.0007","90","","100.666","0.002","90","","1138.94","0.08","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl β-N-(3-nitrophenylmethylene)dithiocarbazate","","- C9 H9 N3 O2 S2 -","- C9 H9 N3 O2 S2 -","- C36 H36 N12 O8 S8 -","4","1","SJ6063","Yan-Ling Zhang; Shang Shan; Duan-Jun Xu","Methyl β-<i>N</i>-(3-nitrophenylmethylene)dithiocarbazate","Acta Crystallographica Section E","2005","61","4","o1173","o1175","10.1107/S1600536805009281","","","0.71073","MoKα","","0.059","0.032","","","0.074","0.079","","","","","","0.876","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205595","6.044","0.0004","14.6516","0.0009","16.8653","0.0011","90","","100.266","0.005","90","","1469.58","0.17","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzoin thiosemicarbazone","","- C15 H15 N3 O S -","- C15 H15 N3 O S -","- C60 H60 N12 O4 S4 -","4","1","SU6174","Dinçer, Muharrem; Özdemir, Namık; Çukurovalı, Alaaddin; Yılmaz, İbrahim","Benzoin thiosemicarbazone","Acta Crystallographica Section E","2005","61","4","o880","o883","10.1107/S160053680500646X","","","0.71073","MoKα","","0.0482","0.0362","","","0.1027","0.1067","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205596","24.733","0.009","4.42","0.002","12.376","0.004","90","","90.72","0.006","90","","1352.8","0.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Chloro-2-(1-naphthyliminomethyl)phenol","","- C17 H12 Cl N O -","- C17 H12 Cl N O -","- C68 H48 Cl4 N4 O4 -","4","1","SU6175","Li, Zong-Xiao; Zhang, Xin-Li","4-Chloro-2-(1-naphthyliminomethyl)phenol","Acta Crystallographica Section E","2005","61","4","o875","o876","10.1107/S1600536805006392","","","0.71073","MoKα","","0.0954","0.0554","","","0.1089","0.1249","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205597","21.893","0.009","7.756","0.003","13.187","0.007","90","","112.23","0.03","90","","2072.7","1.7","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(1S*,4aR*,8aR*)-decahydronaphthalene-1-carboxylic acid","","- C11 H18 O2 -","- C11 H18 O2 -","- C88 H144 O16 -","8","1","SU6176","Davison, Mark; Lalancette, Roger A.; Thompson, Hugh W.","Formation of non-centrosymmetric dimers in (1<i>S</i>*,4a<i>R</i>*,8a<i>R</i>*)-decahydronaphthalene-1-carboxylic acid","Acta Crystallographica Section E","2005","61","4","o877","o879","10.1107/S1600536805006410","","","0.71073","MoKα","","0.087","0.055","","","0.14","0.162","","","","","","1.01","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205598","23.469","0.005","8.953","0.005","8.492","0.005","90","0.005","95.879","0.005","90","0.005","1774.9","1.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,5-Bis(pivaloylsulfanyl)-1,3-dithiolane-2-thione","","- C13 H18 O2 S5 -","- C13 H18 O2 S5 -","- C52 H72 O8 S20 -","4","0.5","SU6177","Wang, Yan Ling; Yu, Wen Tao; Xu, Dong; Wang, Xin Qiang; Zhang, Guang Hui","4,5-Bis(pivaloylsulfanyl)-1,3-dithiolane-2-thione","Acta Crystallographica Section E","2005","61","4","o971","o973","10.1107/S160053680500721X","","","0.71069","MoKα","","0.0782","0.0607","","","0.1578","0.1695","","","","","","1.076","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205599","30.514","0.003","8.436","0.002","7.742","0.002","90","","90","","90","","1992.9","0.7","273","2","298","2","","","","","","","","5","C m c 21","C 2c -2","36","","{1,1'-[Propane-1,3-diylbis(nitrilomethylidyne)]di-2-naphtholato}iron(II)","","- C25 H20 Fe N2 O2 -","- C25 H20 Fe N2 O2 -","- C100 H80 Fe4 N8 O8 -","4","0.5","SU6178","Zhao, Bin; Sun, Yu-Xi","{1,1'-[Propane-1,3-diylbis(nitrilomethylidyne)]di-2-naphtholato}iron(II)","Acta Crystallographica Section E","2005","61","4","m652","m653","10.1107/S1600536805006409","","","0.71073","MoKα","","0.0494","0.04","","","0.0916","0.0963","","","","","","0.996","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205600","19.288","0.004","15.84","0.003","15.485","0.003","90","","124.297","0.003","90","","3908.4","1.3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N'-Bis(3-nitrobenzylidene)-trans-1,2-cyclohexanediamine","","- C20 H20 N4 O4 -","- C20 H20 N4 O4 -","- C160 H160 N32 O32 -","8","1","SU6179","Liu, Zhao-Di; Tan, Min-Yu; Zhu, Hai-Liang","<i>N</i>,<i>N</i>'-Bis(3-nitrobenzylidene)-<i>trans</i>-1,2-cyclohexanediamine","Acta Crystallographica Section E","2005","61","4","o962","o963","10.1107/S1600536805007099","","","0.71073","MoKα","","0.206","0.093","","","0.1561","0.1988","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205601","10.912","0.007","7.797","0.005","20.777","0.013","90","","96.899","0.013","90","","1754.9","1.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis{2-[3-(cyclohexylammonio)propyliminomethyl]phenolato}dithiocyanatocobalt(II)","","- C34 H48 Co N6 O2 S2 -","- C34 H48 Co N6 O2 S2 -","- C68 H96 Co2 N12 O4 S4 -","2","0.5","SU6180","Yue, Guo-Ren; Shi, Yu-Zhen; Lin, Min; Feng, Lei","Bis{2-[3-(cyclohexylammonio)propyliminomethyl]phenolato}dithiocyanatocobalt(II)","Acta Crystallographica Section E","2005","61","4","m720","m721","10.1107/S1600536805008251","","","0.71073","MoKα","","0.1326","0.0609","","","0.1345","0.192","","","","","","0.844","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205602","10.216","0.001","15.053","0.002","10.61","0.001","90","","91.164","0.002","90","","1631.3","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[N,N-Dimethyl-N'-(2-pyridylmethylene)ethane-1,2-diamine]dithiocyanatocopper(II)","","- C12 H15 Cu N5 S2 -","- C12 H15 Cu N5 S2 -","- C48 H60 Cu4 N20 S8 -","4","1","SU6181","Yue, Guo-Ren; Xu, Xin-Jian; Shi, Yu-Zhen; Feng, Lei","[<i>N,N</i>-Dimethyl-<i>N</i>'-(2-pyridylmethylene)ethane-1,2-diamine]dithiocyanatocopper(II)","Acta Crystallographica Section E","2005","61","4","m693","m694","10.1107/S1600536805007567","","","0.71073","MoKα","","0.0625","0.039","","","0.0975","0.1098","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205603","11.75","0.002","7.41","0.002","33.842","0.007","90","","90","","90","","2946.5","1.1","298","2","295","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","catena-Poly[[[4-bromo-2-(2-dimethylaminoethyliminomethyl)phenolato]zinc(II)]- μ-thiocyanato]","","- C12 H14 Br N3 O S Zn -","- C12 H14 Br N3 O S Zn -","- C96 H112 Br8 N24 O8 S8 Zn8 -","8","2","SU6182","Yue, Guo-Ren; Lei, Xin-You; Xu, Xin-Jian; Xue, Guo-Qing","<i>catena</i>-Poly[[[4-bromo-2-(2-dimethylaminoethyliminomethyl)phenolato]zinc(II)]-μ-thiocyanato]","Acta Crystallographica Section E","2005","61","4","m722","m724","10.1107/S1600536805008305","","","0.71073","MoKα","","0.0539","0.0405","","","0.0869","0.0933","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205604","6.413","0.002","7.285","0.003","15.654","0.006","97.229","0.004","92.625","0.004","105.2","0.005","697.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2,4,6-triamino-1,3,5-triazin-1-ium 4-methylbenzenesulfonate monohydrate","","- C10 H16 N6 O4 S -","- C10 H16 N6 O4 S -","- C20 H32 N12 O8 S2 -","2","1","TK6211","Li, Xue-Mei; Lu, Li-Ping; Feng, Si-Si; Zhang, Hong-Mei; Qin, Shi-Dong; Zhu, Miao-Li","2,4,6-Triamino-1,3,5-triazin-1-ium 4-methylbenzenesulfonate monohydrate","Acta Crystallographica Section E","2005","61","4","o811","o813","10.1107/S1600536805005842","","","0.71073","MoKα","","0.052","0.046","","","0.132","0.136","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205605","11.909","0.004","6.166","0.002","16.937","0.006","90","","110.278","0.007","90","","1166.6","0.7","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4:5,8-dimethano-1,1a,4,4a,5,5a,8,8a-octahydroanthracene-9,10-dione","","- C16 H16 O2 -","- C16 H16 O2 -","- C64 H64 O8 -","4","1","TK6215","Andrey A. Yakovenko; Fedor M. Dolgushin","Redetermination of the Diels‒Alder diadduct of 1,4-benzoquinone and cyclopentadiene: 1,4:5,8-dimethano-1,1a,4,4a,5,5a,8,8a-octahydroanthracene-9,10-dione","Acta Crystallographica Section E","2005","61","4","o1178","o1179","10.1107/S1600536805009311","","","0.71073","MoKα","","0.05","0.042","","","0.081","0.084","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205606","10.061","0.002","11.763","0.002","19.337","0.004","100.87","0.03","100.71","0.03","108.14","0.03","2061.1","0.9","293","2","","","","","","","","","","6","P -1","-P 1","2","","trans-Carbonylchlorobis(tri-m-tolylphosphino)rhodium(I) dichloromethane solvate","","- C44 H44 Cl3 O P2 Rh -","- C44 H44 Cl3 O P2 Rh -","- C88 H88 Cl6 O2 P4 Rh2 -","2","1","WK6036","Meijboom, Reinout; Muller, Alfred; Roodt, Andreas","<i>trans</i>-Carbonylchlorobis(tri-<i>m</i>-tolylphosphino)rhodium(I) dichloromethane solvate","Acta Crystallographica Section E","2005","61","4","m699","m701","10.1107/S1600536805005738","","","0.71073","MoKα","","","0.0617","","","","0.1509","","","","","","1.015","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205607","11.496","0.002","13.755","0.003","15.052","0.003","110.74","0.01","93.45","0.01","100.09","0.01","2172.1","0.8","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Hemi[4-(carboxymethoxy)phenylsulfanylacetato-κ^2^O,O']hemi[4- (carboxymethylsulfanyl)phenyloxyacetato]bis(1,10-phenanthroline- κ^2^N,N')cadmium(II) 4-(carboxymethoxy)phenylsulfanylacetate dihydrate","","- C44 H38 Cd N4 O12 S2 -","- C44 H38 Cd N4 O12 S2 -","- C88 H76 Cd2 N8 O24 S4 -","2","1","WK6040","Huo, Li-Hua; Gao, Shan; Zhao, Hui; Ng, Seik Weng","Hemi[4-(carboxymethoxy)phenylsulfanylacetato-κ^2^<i>O,O</i>']hemi[4-(carboxymethylsulfanyl)phenyloxyacetato]bis(1,10-phenanthroline-κ^2^<i>N,N</i>')cadmium(II) 4-(carboxymethoxy)phenylsulfanylacetate dihydrate","Acta Crystallographica Section E","2005","61","4","m727","m729","10.1107/S1600536805006665","","","0.71073","MoKα","","0.091","0.062","","","0.181","0.203","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2205608","6.902","0.002","9.036","0.002","15.164","0.004","103.6","0.01","93.36","0.01","108.75","0.01","861.1","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","μ-[2,8-Dimethyl-5,11-bis(dimethylethyleneamine)-1,4,5,6,7,10,11,12- octahydroimidazo[4,5-h]imidazo[4,5-c][1,6]diazecine]bis[aquasulfatocopper(II)] hexahydrate","","- C20 H52 Cu2 N8 O16 S2 -","- C20 H52 Cu2 N8 O16 S2 -","- C20 H52 Cu2 N8 O16 S2 -","1","0.5","WK6042","Gasque, Laura; Mijangos, Edgar; Ortiz-Frade, Luis","[μ-5,11-Bis(dimethylethyleneamino)-2,8-dimethyl-1,4,5,6,7,10,11,12-octahydroimidazo[4,5-<i>h</i>]imidazo[4,5-<i>c</i>][1,6]diazecine]bis[aquasulfatocopper(II)] hexahydrate: a dinuclear copper sulfate complex based on a diazecine ligand","Acta Crystallographica Section E","2005","61","4","m673","m676","10.1107/S1600536805006896","","","0.71073","MoKα","","0.1276","0.0609","","","0.1179","0.1482","","","","","","0.978","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205609","15.641","0.002","14.2886","0.0018","17.112","0.002","90","","112.678","0.002","90","","3528.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Benzoyl-1-tert-butyl-2-(2-tert-butyl-1,2-dibenzoylhydrazinosulfanyl)- 1-(3,5-dimethylbenzoyl)hydrazine","","- C38 H42 N4 O4 S -","- C38 H42 N4 O4 S -","- C152 H168 N16 O16 S4 -","4","1","WK6044","Shang, Jian; Wang, Qing-Min; Song, Hai-Bin; Huang, Run-Qiu; Chen, Li; Mao, Chun-Hui","2-Benzoyl-1-<i>tert</i>-butyl-2-(1,2-dibenzoyl-2-<i>tert</i>-butylhydrazinosulfanyl)-1-(3,5-dimethylbenzoyl)hydrazine","Acta Crystallographica Section E","2005","61","4","o936","o938","10.1107/S1600536805006537","","","0.71073","MoKα","","0.113","0.045","","","0.104","0.137","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205610","9.4362","0.0005","13.9625","0.0007","10.1948","0.0005","90","","90.78","0.001","90","","1343.07","0.12","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Octapotassium di-μ-sulfato-κ^2^O:O'-bis[cis-dioxo-cis-disulfatotungstate(VI)]","","- K8 O28 S6 W2 -","- K8 O28 S6 W2 -","- K16 O56 S12 W4 -","2","0.5","WM6051","Susan J. Cline Schäffer; Rolf W. Berg","Potassium bis(μ-sulfato-1κ<i>O</i>:2κ<i>O</i>')bis[<i>cis</i>-dioxido-<i>cis</i>-bis(sulfato-κ<i>O</i>)tungstate(VI)]","Acta Crystallographica Section E","2005","61","4","i49","i51","10.1107/S1600536805007579","","","0.71073","MoKα","","0.0136","0.0132","","","0.0309","0.0311","","","","","","1.125","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205611","6.946","0.002","6.157","0.002","11.172","0.006","90","","90","","90","","477.8","0.3","293","2","293","2","","","","","","","","5","P m n 21","P 2ac -2","31","","ammonium hexaaquacobalt(II) orthophosphate","","- Co H16 N O10 P -","- Co H16 N O10 P -","- Co2 H32 N2 O20 P2 -","2","0.5","WM6054","El Bali, Brahim; Esseli, Rachid; Capitelli, Francesco; Lachkar, Mohammed","Reinvestigation of NH~4~[Co(H~2~O)~6~]PO~4~ based on single-crystal data","Acta Crystallographica Section E","2005","61","4","i52","i54","10.1107/S1600536805007245","","","0.71073","MoKα","","0.0385","0.0293","","","0.0634","0.0663","","","","","","1.08","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2205612","16.292","0.001","7.2154","0.0006","13.68","0.001","90","","90","","90","","1608.1","0.2","193","2","193","2","","","","","","","","4","P c a 21","P 2c -2ac","29","caesium thorium phyllosilicate","cesium thorium(IV) silicate","","- Cs2 O15 Si6 Th -","- Cs2 O15 Si6 Th -","- Cs8 O60 Si24 Th4 -","4","1","WM6055","Woodward, Jonathan D.; Almond, Philip M.; Albrecht-Schmitt, Thomas E.","Caesium thorium silicate, Cs~2~ThSi~6~O~15~","Acta Crystallographica, Section E","2005","61","4","i58","i60","10.1107/S1600536805008421","","","0.71073","MoKα","","0.0405","0.0353","","","0.0744","0.0759","","","","","","1.066","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2205613","7.067","0.001","7.368","0.001","7.852","0.001","81.23","0.01","70.68","0.01","88.54","0.01","381.18","0.09","301","2","301","2","","","","","","","","5","P -1","-P 1","2","","Diammonium cobalt(II) dihydrogendiphosphate(V) dihydrate","","- Co H16 N2 O16 P4 -","- Co H16 N2 O16 P4 -","- Co H16 N2 O16 P4 -","1","0.5","WM6057","Essehli, Rachid; Lachkar, Mohammed; Svoboda, Ingrid; Fuess, Hartmut; El Bali, Brahim","(NH~4~)~2~[Co(H~2~P~2~O~7~)~2~(H~2~O)~2~]","Acta Crystallographica Section E","2005","61","4","i61","i63","10.1107/S1600536805008639","","","0.71073","MoKα","","0.0366","0.0338","","","0.0834","0.0851","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205614","7.0344","0.0009","7.3214","0.0009","7.792","0.001","81.53","0.01","70.91","0.01","88.21","0.01","375.03","0.09","301","2","301","2","","","","","","","","5","P -1","-P 1","2","","Diammonium nickel(II) dihydrogendiphosphate(V) dihydrate","","- H16 N2 Ni O16 P4 -","- H16 N2 Ni O16 P4 -","- H16 N2 Ni O16 P4 -","1","0.5","WM6058","Essehli, Rachid; Lachkar, Mohammed; Svoboda, Ingrid; Fuess, Hartmut; El Bali, Brahim","(NH~4~)~2~[Ni(H~2~P~2~O~7~)~2~(H~2~O)~2~]","Acta Crystallographica Section E","2005","61","4","i64","i66","10.1107/S1600536805008640","","","0.71073","MoKα","","0.0341","0.033","","","0.1059","0.1069","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205615","9.4794","0.0011","7.9025","0.0009","16.2016","0.0019","90","","94.089","0.003","90","","1210.6","0.2","110","2","110","2","","","","","","","","4","P 1 21 1","P 2yb","4","Amygdalin tri-hydrate","(R)-1-cyano-1-(phenylmethyl)-β-D-glucopyranosyl-(1→6)-β-D- glucopyranoside","","- C20 H33 N O14 -","- C20 H33 N O14 -","- C40 H66 N2 O28 -","2","1","WN6326","Eriksson, Lars; Widmalm, Göran","Amygdalin trihydrate","Acta Crystallographica Section E","2005","61","4","o860","o862","10.1107/S1600536805006227","","","0.891","synchrotron","","0.0407","0.0372","","","0.0959","0.0973","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205616","15.554","0.006","10.012","0.004","8.856","0.004","90","","96.217","0.008","90","","1371","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[(2-Hydroxybenzylidene)hydrazinocarbonyl]-1H-1,2,4-triazole ethanol solvate","","- C12 H15 N5 O3 -","- C12 H15 N5 O3 -","- C48 H60 N20 O12 -","4","1","WN6328","Chang-Hua Ge; Jian-Guo Yang; Fu-You Pan","3-[(2-Hydroxybenzylidene)hydrazinocarbonyl]-1<i>H</i>-1,2,4-triazole ethanol solvate","Acta Crystallographica Section E","2005","61","4","o833","o835","10.1107/S1600536805006069","","","0.71073","MoKα","","0.1293","0.0764","","","0.2018","0.2293","","","","","","0.959","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205617","5.4716","0.0004","12.48","0.001","16.695","0.001","90","","90","","90","","1140.03","0.14","292","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,2'-Diaminodibenzyl","","- C14 H16 N2 -","- C14 H16 N2 -","- C56 H64 N8 -","4","1","WN6331","Narasegowda, R. S.; Malathy Sony, S. M.; Mondal, S.; Nagaraj, B.; Yathirajan, H. S.; Narasimhamurthy, T.; Charles, P.; Ponnuswamy, M. N.; Nethaji, M.; Rathore, R. S.","2,2'-Diaminodibenzyl: a rare case of crystallographically non-compliant molecular symmetry","Acta Crystallographica Section E","2005","61","4","o843","o845","10.1107/S1600536805006021","","","0.71073","MoKα","","0.0446","0.04","","","0.0998","0.1025","","","","","","1.108","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205618","7.7442","0.0011","8.6866","0.0012","8.7559","0.0012","90.213","0.003","110.427","0.003","103.074","0.003","535.46","0.13","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H18 Cd2 Cl4 N6 S2 -","- C12 H18 Cd2 Cl4 N6 S2 -","- C12 H18 Cd2 Cl4 N6 S2 -","1","0.5","WN6332","Radosavljević Evans, Ivana; Mészáros Szécsényi, Katalin; Leovac, Vukadin M.","Di-μ-chloro-bis{chloro[3,5-dimethyl-1-(thiocarbamoyl)pyrazole-κ^2^<i>N</i>^2^,<i>S</i>]cadmium(II)}","Acta Crystallographica Section E","2005","61","4","m641","m643","10.1107/S1600536805006173","","","0.71073","MoKα","","0.0313","0.0234","","0.0544","0.0526","0.0526","","","","","","0.9109","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205619","7.663","0.004","12.119","0.007","18.303","0.009","90","","93.217","0.014","90","","1697.1","1.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[(2-Hydroxyphenyl)amino]-1-phenylbut-3-en-1-one ethanol solvate","","- C18 H21 N O3 -","- C18 H21 N O3 -","- C72 H84 N4 O12 -","4","1","WN6333","Yao-Cheng Shi","3-[(2-Hydroxyphenyl)amino]-1-phenylbut-3-en-1-one ethanol solvate","Acta Crystallographica Section E","2005","61","4","o1130","o1132","10.1107/S1600536805008925","","","0.71073","MoKα","","0.1115","0.0582","","","0.1584","0.1891","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205620","14.031","0.003","5.5082","0.001","14.601","0.003","90","","107.412","0.003","90","","1076.7","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Phenylalaninium malonate L-phenylalanine","","- C21 H26 N2 O8 -","- C21 H26 N2 O8 -","- C42 H52 N4 O16 -","2","1","WN6334","M. Alagar; R. V. Krishnakumar; P. Parimala Devi; S. Natarajan","<small>L</small>-Phenylalanine <small>L</small>-phenylalaninium malonate","Acta Crystallographica Section E","2005","61","4","o992","o994","10.1107/S1600536805007014","","","0.71073","MoKα","","0.056","0.0351","","","0.0903","0.1012","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205621","8.5622","0.0004","14.0393","0.0007","14.7524","0.0007","90","","90","","90","","1773.35","0.15","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Bis-(3-methyl-4-aminopyridine)-Zinc(II)isothiocyanate","Bis(4-amino-3-methylpyridine)diisothiocyanatozinc(II)","","- C14 H16 N6 S2 Zn -","- C14 H16 N6 S2 Zn -","- C56 H64 N24 S8 Zn4 -","4","0.5","WN6335","Suchada Chantrapromma; Hoong-Kun Fun; Xiao-Jun Feng; Jia-Xiang Yang; Jie-Ying Wu; Yu-Peng Tian","Bis(4-amino-3-methylpyridine)diisothiocyanatozinc(II)","Acta Crystallographica Section E","2005","61","4","m733","m735","10.1107/S160053680500810X","","","0.71073","MoKα","","0.0402","0.0312","","","0.0815","0.0894","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205622","8.7855","0.0007","9.8033","0.0007","14.874","0.001","88.368","0.001","79.065","0.001","64.09","0.001","1129.21","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","3-Bromo-2-(2-bromo-4,5-dimethoxybenzyl)-1-phenylsulfonyl-1H-indole","","- C23 H19 Br2 N O4 S -","- C23 H19 Br2 N O4 S -","- C46 H38 Br4 N2 O8 S2 -","2","1","WN6336","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","3-Bromo-2-(2-bromo-4,5-dimethoxybenzyl)-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","4","o998","o1000","10.1107/S1600536805007348","","","0.71073","MoKα","","0.0904","0.0416","","","0.0816","0.0998","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205623","8.232","0.004","6.065","0.003","16.71","0.009","90","","97.864","0.006","90","","826.4","0.7","292.15","","292.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(4-dimethylaminobenzyl)-2,3-diaza-1,3-butadiene","","- C18 H22 N4 -","- C18 H22 N4 -","- C36 H44 N8 -","2","0.5","WN6337","Qing-Hua Wang; Guo-Cong Guo; Ming-Sheng Wang","1,4-Bis(4-dimethylaminobenzyl)-2,3-diaza-1,3-butadiene","Acta Crystallographica Section E","2005","61","4","o1156","o1157","10.1107/S1600536805008664","","","0.71073","MoKα","","0.1004","0.065","","","0.1475","0.1669","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205624","9.6003","0.0011","13.0545","0.0015","7.6874","0.0009","90","","90","","90","","963.44","0.19","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","2,4-Dichloro-6-morpholino-1,3,5-triazine","","- C7 H8 Cl2 N4 O -","- C7 H8 Cl2 N4 O -","- C28 H32 Cl8 N16 O4 -","4","0.5","WN6338","Dong, Chuan-Ming; Chen, Li-Gong; Duan, Xue-Min; Shu, Xue-Gui; Zeng, Tao; Yan, Xi-Long","2,4-Dichloro-6-morpholino-1,3,5-triazine","Acta Crystallographica Section E","2005","61","4","o1168","o1169","10.1107/S1600536805008949","","","0.71073","MoKα","","0.035","0.0292","","","0.0837","0.0866","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205625","9.877","0.002","4.6915","0.001","32.603","0.006","90","","106.25","0.01","90","","1450.4","0.5","105","2","105","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","DL-methionine","DL-methionine","","- C5 H11 N O2 S -","- C5 H11 N O2 S -","- C40 H88 N8 O16 S8 -","8","1","WN6339","M. Alagar; R. V. Krishnakumar; A. Mostad; S. Natarajan","β-<small>DL</small>-Methionine at 105 K","Acta Crystallographica Section E","2005","61","4","o1165","o1167","10.1107/S1600536805009141","","","0.71073","MoKα","","0.0422","0.0408","","","0.0996","0.1003","","","","","","1.231","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205626","9.8818","0.0005","24.3572","0.0013","9.7867","0.0005","90","","99.42","0.001","90","","2323.8","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(3-Bromo-1-phenylsulfonyl-1H-indole-2-ylmethylsulfanyl)-6-methyl-1H- benzimidazole","","- C23 H18 Br N3 O2 S2 -","- C23 H18 Br N3 O2 S2 -","- C92 H72 Br4 N12 O8 S8 -","4","1","WN6342","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","2-(3-Bromo-1-phenylsulfonyl-1<i>H</i>-indol-2-ylmethylsulfanyl)-6-methyl-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","4","o1184","o1186","10.1107/S1600536805009414","","","0.71073","MoKα","","0.092","0.0721","","","0.2029","0.2187","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205627","5.8037","0.0007","12.0508","0.0015","20.16","0.003","90","","90","","90","","1410","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S)-1-(2-Hydroxy-1-naphthylmethyl)pyrrolidinio-2-carboxylate","","- C16 H17 N O3 -","- C16 H17 N O3 -","- C64 H68 N4 O12 -","4","1","WW6352","Dong, Chuan-Ming; Chen, Li-Gong; Duan, Xue-Min; Shu, Xue-Gui; Zeng, Tao; Li, Yang","<i>N</i>-(2-Hydroxy-1-naphthylmethyl)-(<i>S</i>)-proline","Acta Crystallographica Section E","2005","61","4","o960","o961","10.1107/S1600536805006859","","","0.71073","MoKα","","0.0661","0.0387","","","0.0985","0.1131","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205628","19.508","0.002","10.731","0.001","25.92","0.004","90","","108.666","0.002","90","","5140.7","1.1","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","16α,17-Epoxy-11α-(p-tolylsulfonyloxy)pregn-4-ene-3,20-dione","17-acetyl-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17- tetradecahydro-1H-20-oxacyclopropa[16,17]cyclopenta[a]phenanthren-11-yl toluene-4-sulfonate","","- C28 H34 O6 S -","- C28 H34 O6 S -","- C224 H272 O48 S8 -","8","2","WW6358","Nie, Qiang; Wang, Jingkang; Wang, Shi; Zhang, Meijing","16α,17-Epoxy-11α-(<i>p</i>-tolylsulfonyloxy)pregn-4-ene-3,20-dione","Acta Crystallographica Section E","2005","61","4","o912","o913","10.1107/S1600536805006835","","","0.71073","MoKα","","0.0906","0.0463","","","0.0923","0.1044","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205629","7.9225","0.0011","8.0119","0.001","11.7565","0.0014","83.979","0.002","86.251","0.002","64.422","0.002","669.22","0.15","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1,2-dihydrotanshinquinone","8,9-Dihydro-1,6-dimethylphenanthro[1,2-b]furan-10,11-dione","","- C18 H14 O3 -","- C18 H14 O3 -","- C36 H28 O6 -","2","1","WW6359","Qin, Jiang-Ke; Liao, Cheng-Zhu; Wang, Yong-Tao; Bu, Xian-Zhang; Huang, Zhi-Shu; Gu, Lian-Quan","8,9-Dihydro-1,6-dimethylphenanthro[1,2-<i>b</i>]furan-10,11-dione","Acta Crystallographica Section E","2005","61","4","o804","o805","10.1107/S1600536805005581","","","0.71073","MoKα","","0.0479","0.0402","","","0.117","0.1265","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205630","9.702","0.003","6.093","0.002","14.64","0.005","90","","100.914","0.001","90","","849.8","0.5","123.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H23 Br O2 -","- C20 H23 Br O2 -","- C40 H46 Br2 O4 -","2","1","YA6235","Masataka Watanabe; Taisuke Matsumoto; Shuntaro Mataka; Thies Thiemann","17-Bromo-16-formyl-3-methoxyestra-1,3,5(10),16-tetraene","Acta Crystallographica Section E","2005","61","4","o974","o976","10.1107/S160053680500704X","","","0.7107","MoKα","","","0.023","","","","0.061","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205631","11.2952","0.0008","11.2952","0.0008","4.5325","0.0004","90","","90","","120","","500.79","0.07","100","","100","","","","","","","","","4","P 32","P 32","145","","2-Iodoaniline","","- C6 H6 I N -","- C6 H6 I N -","- C18 H18 I3 N3 -","3","1","YA6240","Andrew Parkin; Christopher K. Spanswick; Colin R. Pulham; Chick C. Wilson","2-Iodoaniline at 100 K","Acta Crystallographica Section E","2005","61","4","o1087","o1089","10.1107/S1600536805007038","","","0.71073","MoKα","","0.058","0.048","","0.124","0.119","0.124","","","","","","0.999","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205632","10.4015","0.0016","23.653","0.004","32.204","0.005","90","","90","","90","","7923","2","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2α,3β,12β,20S-Trihydroxydammar-24-ene 20-O-β-D-glucopyranoside","","- C38.5 H72 O11.5 -","- C38.5 H72 O11.5 -","- C308 H576 O92 -","8","2","AC6165","Valentina Razmovski-Naumovski; Rujee K. Duke; Peter Turner; Colin C. Duke","(20<i>S</i>)-2α,3β,12β-Trihydroxydammar-24-ene 20-<i>O</i>-β-<small>D</small>-glucopyranoside (Gynosaponin TN1) as the 2.5-methanol solvate","Acta Crystallographica Section E","2005","61","5","o1239","o1241","10.1107/S1600536805009773","","","0.71073","MoKα","","0.0634","0.0549","","","0.1525","0.1583","","","","","","1.38","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205633","8.572","0.0002","21.1088","0.0005","19.352","0.0006","90","","93.556","0.001","90","","3494.9","0.16","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C66 H98 Cl6 N10 O4 -","- C66 H98 Cl6 N10 O4 -","- C132 H196 Cl12 N20 O8 -","2","0.5","AC6167","Light, Mark E.; Gale, Philip A.; Navakhun, Korakot","1,4-Phenylene-bis-(3,4-dichloro-5-phenylcarbamoyl-1<i>H</i>-pyrrole-2-carboxamide) bis(tetrabutylammonium chloride) acetonitrile disolvate","Acta Crystallographica Section E","2005","61","5","o1300","o1301","10.1107/S1600536805010688","","","0.71073","MoKα","","0.0978","0.0596","","","0.1312","0.1438","","","","","","1.105","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205634","9.524","0.002","10.363","0.003","17.056","0.004","78.293","0.011","88.733","0.014","80.136","0.014","1623.9","0.7","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H94 Cl4 N8 O4 -","- C64 H94 Cl4 N8 O4 -","- C64 H94 Cl4 N8 O4 -","1","0.5","AC6168","Light, Mark E.; Gale, Philip A.; Navakhun, Korakot; Maynard-Smith, Michael","4-Aminomethyl-phenylamino-bis-(3,4-dichloro-5-phenylcarbamoyl-1<i>H</i>-pyrrole-2-carboxamide) tetrabutylammonium salt","Acta Crystallographica Section E","2005","61","5","o1302","o1303","10.1107/S160053680501069X","","","0.71073","MoKα","","0.2189","0.1014","","","0.1577","0.1921","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205635","11.9992","0.0004","7.8052","0.0002","16.6679","0.0003","90","","96.158","0.002","90","","1552.04","0.07","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2':6',2''-Terpyridinium nitrate","","- C15 H13 N5 O6 -","- C15 H13 N5 O6 -","- C60 H52 N20 O24 -","4","1","AT6002","Berthon, Claude; Grigoriev, Mikhail S.","2,2':6',2''-Terpyridinium dinitrate","Acta Crystallographica Section E","2005","61","5","o1216","o1217","10.1107/S1600536805009931","","","0.71073","MoKα","","0.0459","0.0404","","","0.0968","0.1009","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205636","4.5833","0.0015","18.843","0.006","11.112","0.004","90","","100.738","0.007","90","","942.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 3,5-dinitrobenzoate","","- C8 H6 N2 O6 -","- C8 H6 N2 O6 -","- C32 H24 N8 O24 -","4","1","AT6003","Jin, Long-Fei; Xiao, Feng-Ping","Methyl 3,5-dinitrobenzoate","Acta Crystallographica Section E","2005","61","5","o1276","o1277","10.1107/S1600536805010317","","","0.71073","MoKα","","0.1147","0.0607","","","0.1387","0.1695","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205637","7.3142","0.0009","9.6929","0.0011","12.9986","0.0016","81.233","0.009","83.004","0.01","74.967","0.009","876.34","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(3,4-Dicyanophenoxy)-4-methoxybenzophenone","","- C22 H14 N2 O3 -","- C22 H14 N2 O3 -","- C44 H28 N4 O6 -","2","1","AT6004","Erdem, Talip Kaya; Atalay, Şehriman; Akdemir, Nesuhi; Aǧar, Erbil; Kantar, Cihan","4-(2-Benzoyl-5-methoxyphenoxy)benzene-1,2-dicarbonitrile","Acta Crystallographica Section E","2005","61","5","o1429","o1431","10.1107/S1600536805011918","","","0.71073","MoKα","","0.0719","0.0383","","","0.0755","0.0852","","","","","","0.97","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205638","10.083","0.004","12.576","0.004","13.849","0.005","90","","90","","90","","1756.1","1.1","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","3,8-Diphenyl-6-methyl-5H-pyrazolo[3,4-e]-1,2,4-triazolo[4,3-b]- 1,3,4-thiadiazepine","","- C19 H14 N6 S -","- C19 H14 N6 S -","- C76 H56 N24 S4 -","4","1","AT6005","Li-Min Yang; Zhao-Jie Liu","6-Methyl-3,8-diphenyl-5<i>H</i>-pyrazolo[3,4-<i>e</i>][1,2,4]triazolo[4,3-<i>b</i>][1,3,4]thiadiazepine","Acta Crystallographica Section E","2005","61","5","o1466","o1468","10.1107/S160053680501192X","","","0.71073","MoKα","","0.0591","0.0343","","","0.0716","0.0821","","","","","","1.034","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205639","14.9807","0.0006","15.5273","0.0006","9.4228","0.0004","90","","99.962","0.001","90","","2158.79","0.15","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","N,N'-Di(9H-fluoren-9-ylidene)benzene-1,2-diamine","","- C32 H20 N2 -","- C32 H20 N2 -","- C128 H80 N8 -","4","0.5","BH6000","Glagovich, Neil M.; Reed, Elizabeth M.; Crundwell, Guy; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","<i>N</i>,<i>N</i>'-Bis(9<i>H</i>-fluoren-9-ylidene)benzene-1,2-diamine","Acta Crystallographica Section E","2005","61","5","o1251","o1253","10.1107/S1600536805010251","","","0.71073","MoKα","","0.0483","0.0466","","","0.1153","0.1166","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205640","13.5324","0.0015","7.2128","0.0008","12.988","0.0015","90","","109.501","0.002","90","","1195","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraaquabis(4,6-oxidopyrimidin-1-ium-κ^3^N)cobalt(II)","","- C8 H14 Co N4 O8 -","- C8 H14 Co N4 O8 -","- C32 H56 Co4 N16 O32 -","4","0.5","BR6186","Huang, You-Gui; Zhou, You-Fu; Yuan, Da-Qiang; Wu, Ben-Lei; Hong, Mao-Chun","Tetraaquabis(4,6-dioxidopyrimidin-1-ium-κ^3^<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2005","61","5","m832","m834","10.1107/S1600536805009785","","","0.71073","MoKα","","0.0355","0.0323","","","0.0787","0.0817","","","","","","1.172","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205641","5.0843","0.0009","29.44","0.005","10.823","0.002","90","","92.419","0.016","90","","1618.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Propyl 4-(3,4-dicyanophenoxy)benzoate","","- C18 H14 N2 O3 -","- C18 H14 N2 O3 -","- C72 H56 N8 O12 -","4","1","BT6626","Petek, Hande; Akdemir, Nesuhi; Kantar, Cihan; Ağar, Erbil; Şenel, İsmet","Propyl 4-(3,4-dicyanophenoxy)benzoate","Acta Crystallographica Section E","2005","61","5","o1233","o1234","10.1107/S1600536805010020","","","0.71073","MoKα","","0.1717","0.0612","","","0.1349","0.1533","","","","","","0.807","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205642","20.543","0.003","4.0082","0.0008","12.813","0.002","90","","95.497","0.006","90","","1050.2","0.3","133","2","133","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,5-Dibromo-2,6-dimethylnaphthalene","","- C12 H10 Br2 -","- C12 H10 Br2 -","- C48 H40 Br8 -","4","0.5","BT6633","Jones, Peter G.; Kuś, Piotr","1,5-Dibromo-2,6-dimethylnaphthalene","Acta Crystallographica Section E","2005","61","5","o1235","o1236","10.1107/S1600536805008652","","","0.71073","MoKα","","0.0352","0.0237","","","0.0503","0.0537","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205643","5.5138","0.0004","7.1866","0.0005","12.0459","0.0004","90","","90","","90","","477.32","0.05","150","1","150","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","para-aminopyridine","4-aminopyridine","","- C5 H6 N2 -","- C5 H6 N2 -","- C20 H24 N8 -","4","1","BT6634","Anderson, Frankie P.; Gallagher, John F.; Kenny, Peter T.M.; Lough, Alan J.","Redetermination of <i>para</i>-aminopyridine (fampridine, EL-970)at 150 K","Acta Crystallographica Section E","2005","61","5","o1350","o1353","10.1107/S1600536805010433","","","0.71073","MolybdenumKα","","0.0376","0.0314","","","0.082","0.0858","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205644","10.6453","0.0018","10.7928","0.0019","11.458","0.002","90","","90","","90","","1316.4","0.4","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Tricarbonyl[η^6^-(R)-N,N-dimethyl-1-phenylethylamine]chromium(0)","","- C13 H15 Cr N O3 -","- C13 H15 Cr N O3 -","- C52 H60 Cr4 N4 O12 -","4","1","BT6636","Braun, Wolfgang; Calmuschi, Beatrice; Salzer, Albrecht","Tricarbonyl[η^6^-(<i>R</i>)-<i>N,N</i>-dimethyl-1-phenylethylamine]chromium(0)","Acta Crystallographica Section E","2005","61","5","m828","m829","10.1107/S160053680501007X","","","0.71073","MoKα","","0.0228","0.0222","","","0.0603","0.0608","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205645","7.6461","0.0006","8.4018","0.0007","8.4258","0.0007","85.89","0.01","78.08","0.01","69.757","0.009","496.9","0.08","170","2","170","2","","","","","","","","7","P -1","-P 1","2","","Bis[N-(2-aminoethyl)morpholine]copper(II) bis(tetrafluoroborate)","","- C12 H28 B2 Cu F8 N4 O2 -","- C12 H28 B2 Cu F8 N4 O2 -","- C12 H28 B2 Cu F8 N4 O2 -","1","0.5","BT6637","Sander, Ole; Tuczek, Felix; Näther, Christian","Bis[<i>N</i>-(2-aminoethyl)morpholine]copper(II) bis(tetrafluoroborate)","Acta Crystallographica Section E","2005","61","5","m824","m825","10.1107/S1600536805010056","","","0.71073","MoKα","","0.0363","0.0336","","","0.0899","0.0918","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205646","14.0994","0.0007","9.5999","0.0005","28.0432","0.0013","90","","102.249","0.004","90","","3709.3","0.3","291","0.5","291","0.5","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","O,O'-Diisopropyl (4-methyl-7-cumarinyloxy)phosphonothioate","","- C16 H21 O5 P S -","- C16 H21 O5 P S -","- C128 H168 O40 P8 S8 -","8","2","BT6638","Kruszynski, Rafal; Trzesowska, Agata; Majewski, Piotr; Skretowska, Sylwia; Marszalek, Hanna","<i>O,O</i>'-Diisopropyl (4-methyl-7-coumarinyloxy)phosphonothioate","Acta Crystallographica Section E","2005","61","5","o1248","o1250","10.1107/S1600536805010172","","","0.71073","MoKα","","0.0687","0.0552","","","0.1316","0.1405","","","","","","1.185","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205647","6.4058","0.0006","11.284","0.001","14.51","0.001","90","","93.686","0.002","90","","1046.66","0.15","293","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diμ-chloro-bis[bis(ethane-1,2-diamine-κ^2^N,N')manganese(II)] dichloride","","- C8 H32 Cl4 Mn2 N8 -","- C8 H32 Cl4 Mn2 N8 -","- C16 H64 Cl8 Mn4 N16 -","2","0.5","BT6639","Hao, Zheng-Ming; Zhang, Xian-Ming; Wu, Hai-Shun; Ng, Seik Weng","Di-μ-chloro-bis[bis(ethane-1,2-diamine-κ^2^<i>N,N</i>')manganese(II)] dichloride","Acta Crystallographica Section E","2005","61","5","m973","m974","10.1107/S1600536805010184","","","0.71073","MoKα","","0.035","0.032","","","0.082","0.086","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205648","9.4776","0.0009","10.7072","0.0012","10.0023","0.0011","90","","99.463","0.008","90","","1001.21","0.19","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,5-Pentylenebisphosphonic Acid","Pentane-1,5-bisphosphonic acid","","- C5 H14 O6 P2 -","- C5 H14 O6 P2 -","- C20 H56 O24 P8 -","4","1","BT6640","McLauchlan, Craig C.; Ziegler, Amanda J.; Herlinger, Albert W.","Pentane-1,5-bisphosphonic acid","Acta Crystallographica Section E","2005","61","5","o1359","o1361","10.1107/S1600536805011207","","","0.71073","MoKα","","0.0463","0.0356","","","0.0916","0.0956","","","","","","1.116","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205649","12.4125","0.0005","15.4864","0.0006","17.5542","0.0007","106.082","0.001","105.386","0.001","106.52","0.001","2883.5","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis[μ-oxoaquadichloromolybdenum(VI)]‒cucurbit[6]uril 10.5-hydrate","","- C36 H61 Cl4 Mo2 N24 O28.5 -","- C36 H60 Cl4 Mo2 N24 O28.5 -","- C72 H120 Cl8 Mo4 N48 O57 -","2","1","BT6642","Lin, Rong-Guang; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","A hydrated co-crystal of bis(μ-oxo-κ^2^<i>O</i>:<i>O</i>)bis[aquaoxodichloromolybdenum(VI)] with cucurbit[6]uril","Acta Crystallographica Section E","2005","61","5","m885","m888","10.1107/S1600536805010858","","","0.71073","MoKα","","0.0493","0.0463","","","0.1369","0.1394","","","","","","1.03","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2205650","8.7638","0.0007","10.7287","0.001","12.2216","0.001","74.845","0.01","72.997","0.01","88.978","0.01","1058.54","0.18","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-aminoethylammonium)(ethylenediammonium)(di-μ-sulfido- κ^2^S:S)bis[disulfidotin(IV)]","","- C6 H28 N6 S6 Sn2 -","- C6 H28 N6 S6 Sn2 -","- C12 H56 N12 S12 Sn4 -","2","1","BT6643","Puls, Angela; Näther, Christian; Bensch, Wolfgang","Bis(2-aminoethylammonium) (ethylenediammonium) (di-μ-sulfido-κ^2^<i>S</i>:<i>S</i>)bis[dithiostannate(IV)]","Acta Crystallographica Section E","2005","61","5","m868","m870","10.1107/S1600536805010871","","","0.71073","MoKα","","0.0379","0.0291","","","0.0732","0.0765","","","","","","0.965","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205651","16.289","0.002","16.22","0.002","16.452","0.002","90","","94.981","0.002","90","","4330.3","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[tris(μ~2~-oxalato-κ^4^O,O':O''O''')bis(μ~2~-4,4'-bipyridyl- κ^2^N,N')bis(4,4'-bipyridyl-κN)trimanganese(II)]","","- C46 H32 Mn3 N8 O12 -","- C46 H32 Mn3 N8 O12 -","- C184 H128 Mn12 N32 O48 -","4","1","BT6644","Zhu, Li-Hong; Zeng, Ming-Hua; Ng, Seik Weng","Poly[bis(μ~2~-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis(4,4'-bipyridyl-κ<i>N</i>)tris(μ~2~-oxalato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>''<i>O</i>''')trimanganese(II)]<i></i>","Acta Crystallographica Section E","2005","61","5","m916","m918","10.1107/S1600536805011499","","","0.71073","MoKα","","0.039","0.031","","","0.087","0.094","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205652","10.029","0.001","10.476","0.001","13.2088","0.0013","90","","90","","90","","1387.8","0.2","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","S-Dianin's compound","(S)-4-(4-Hydroxyphenyl)-2,2,4-trimethylchroman","","- C18 H20 O2 -","- C18 H20 O2 -","- C72 H80 O8 -","4","1","BT6647","Gareth O. Lloyd; Martin W. Bredenkamp","(<i>S</i>)-4-(4-Hydroxyphenyl)-2,2,4-trimethylchroman","Acta Crystallographica Section E","2005","61","5","o1512","o1514","10.1107/S1600536805012651","","","0.71073","MoKα","","0.0414","0.0384","","","0.0975","0.0997","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205653","32.208","0.0019","6.8884","0.0004","16.6204","0.001","90","","109.156","0.001","90","","3483.3","0.4","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,4-dihydro-6-methy-5-N-methy carbamoyl-4-phenyl-2(3H)-pyrimidinethione","","- C15 H21 N3 O2 S2 -","- C15 H21 N3 O2 S2 -","- C120 H168 N24 O16 S16 -","8","1","BT6648","B. Sridhar; K. Ravikumar","A carbamoyl-substituted dihydropyrimidine with dimethyl sulfoxide solvent","Acta Crystallographica Section E","2005","61","5","o1414","o1416","10.1107/S1600536805011773","","","0.71073","MoKα","","0.0595","0.0536","","","0.1568","0.1635","","","","","","1.046","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205654","6.6508","0.001","7.9576","0.0012","8.4012","0.0012","81.03","0.012","88.572","0.012","81.179","0.012","434","0.11","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","6-Bromo-8-Thio-1,4-Epoxybicyclo[4.3.0]non-2-ene","","- C8 H9 Br O S -","- C8 H9 Br O S -","- C16 H18 Br2 O2 S2 -","2","1","BT6650","Büyükgüngör, Orhan; Koşar, Başak; Demircan, Aydın; Turaç, Ersen","6-Bromo-8-thia-1,4-epoxybicyclo[4.3.0]non-2-ene","Acta Crystallographica Section E","2005","61","5","o1441","o1442","10.1107/S1600536805012122","","","0.71073","MoKα","","0.05","0.0394","","","0.0883","0.0929","","","","","","1.089","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205655","35.204","0.003","5.282","0.006","12.738","0.004","90","","97.503","0.015","90","","2348","3","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,6-(Z,Z)-Bis[(3,4,5-trimethyoxyphenyl)methylene]piperazine-2,5-dione","","- C24 H26 N2 O8 -","- C24 H26 N2 O8 -","- C96 H104 N8 O32 -","4","0.5","BT6651","Wendy A. Loughlin; Raymond L. Marshall; Kathryn E. Fairfull-Smith (nee Elson); Peter C. Healy","(<i>Z</i>,<i>Z</i>)-3,6-Bis[(3,4,5-trimethoxyphenyl)methylene]piperazine-2,5-dione","Acta Crystallographica Section E","2005","61","5","o1443","o1445","10.1107/S1600536805012316","","","0.7107","MoKα","","0.1294","0.0517","","","0.1445","0.1887","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205656","9.578","0.003","7.3024","0.0017","25.656","0.005","90","","94.83","0.013","90","","1788.1","0.8","566","2","566","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(8-hydroxyquinolinium) squarate","","- C22 H16 N2 O6 -","- C22 H16 N2 O6 -","- C88 H64 N8 O24 -","4","1","BT6652","Tonko Kolev; Snezana Sinadinovic-Fiser; Michael Spiteller; William S. Sheldrick; Heike Mayer-Figge","Bis(8-hydroxyquinolinium) squarate","Acta Crystallographica Section E","2005","61","5","o1469","o1471","10.1107/S1600536805012523","","","0.71073","MoKα","","0.1364","0.0602","","","0.1242","0.1523","","","","","","0.991","","","","has coordinates","198633","2020-10-21","18:00:00",""
"2205657","7.1729","0.0004","13.5386","0.0008","14.353","0.0008","90","","103.917","0.002","90","","1352.92","0.13","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Pifithrin-β","2-p-tolyl-5,6,7,8-tetrahydrobenzo[d]imidazo[2,1-b]thiazole","","- C16 H16 N2 S -","- C16 H16 N2 S -","- C64 H64 N8 S4 -","4","1","BT6656","Clegg, William; Jamieson, Clare","Pifithrin-β","Acta Crystallographica Section E","2005","61","5","o1486","o1488","10.1107/S160053680501264X","","","0.71073","MoKα","","0.0426","0.0376","","","0.0993","0.1032","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205658","15.023","0.006","8.27","0.007","24.038","0.007","90","","96.03","0.03","90","","2970","3","150","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorobis(3,5-dimethylpyrazole)copper(II)","","- C10 H16 Cl2 Cu N4 -","- C10 H16 Cl2 Cu N4 -","- C80 H128 Cl16 Cu8 N32 -","8","1","BV6012","Zhao, Ning-Feng; Eichhorn, David M.","Dichlorobis(3,5-dimethylpyrazole)copper(II)","Acta Crystallographica Section E","2005","61","5","m822","m823","10.1107/S1600536805009621","","","0.71073","MoKα","","","0.0665","","","","0.2109","","","","","","1.074","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2205659","29.398","0.003","9.839","0.001","13.59","0.001","90","","108.189","0.006","90","","3734.4","0.6","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","bis(L-histidinato)cobalt(III)‒chloride‒nitrate‒water (1/0.4/0.6/2.5)","","- C12 H21 Cl0.4 Co N6.6 O8.3 -","- C12 H17.5 Cl0.4 Co N6.6 O8.3 -","- C96 H140 Cl3.2 Co8 N52.8 O66.4 -","8","2","BV6016","Leverett J. Zompa","<i>trans</i>-Imidazole isomer of the bis(<small>L</small>-histidinato)cobalt(III) complex","Acta Crystallographica Section E","2005","61","5","m849","m851","10.1107/S1600536805010123","","","0.71073","MoKα","","0.0444","0.0383","","","0.0979","0.1026","","","","","","1.081","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205660","28.831","0.003","9.3063","0.0012","8.6456","0.0012","90","","100.642","0.01","90","","2279.8","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tripotassium ethanoate-2,2-diylbis(diazeniumdiolate) 2.5-hydrate","","- C2 H6 K3 N4 O8.5 -","- C2 H6 K3 N4 O8.5 -","- C16 H48 K24 N32 O68 -","8","1","BV6018","Arulsamy, Navamoney; Bohle, D. Scott","Tripotassium carboxylatomethylenebis(diazeniumdiolate) 2.5-hydrate","Acta Crystallographica Section E","2005","61","5","m930","m932","10.1107/S1600536805010834","","","0.71073","MoKα","","0.0438","0.0371","","","0.0939","0.0983","","","","","","1.038","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205661","19.386","0.006","5.584","0.0015","17.928","0.005","90","","90","","90","","1940.7","1","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","9-oxo-10-diphenylphosphinoylanthracene","","- C26 H19 O2 P -","- C26 H19 O2 P -","- C104 H76 O8 P4 -","4","1","CF6410","Qing-Xiang Liu; Hai-bin Song","9-Oxo-10-diphenylphosphinoylanthracene","Acta Crystallographica Section E","2005","61","5","o1489","o1490","10.1107/S1600536805006598","","","0.71073","MoKα","","0.0725","0.0402","","","0.074","0.0828","","","","","","0.948","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205662","6.1521","0.0005","7.5495","0.0007","9.3055","0.0008","90","","98.501","0.005","90","","427.45","0.06","190","","190","","","","","","","","","3","P 1 21 1","P 2yb","4","","2-C-Methyl-D-allono-1,4-lactone","","- C7 H12 O6 -","- C7 H12 O6 -","- C14 H24 O12 -","2","1","CF6418","Christopher C. Harding; David J. Watkin; Nicola K. Sawyer; Sarah F. Jenkinson; George W. J. Fleet","2-<i>C</i>-Methyl-<small>D</small>-allono-1,4-lactone","Acta Crystallographica Section E","2005","61","5","o1472","o1474","10.1107/S1600536805012328","","","0.71073","MoKα","","0.0418","0.037","","0.0919","0.0886","0.0919","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205663","10.3116","0.0003","5.9084","0.0002","17.2641","0.0006","90","","94.2891","0.0013","90","","1048.87","0.06","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Amino-1-deoxy-N,N-dibenzyl-α-D-tagatopyranose","","- C21 H29 N O6 -","- C21 H29 N O6 -","- C42 H58 N2 O12 -","2","1","CF6419","Christopher C. Harding; Andrew R. Cowley; David J. Watkin; Francesco Punzo; David Hotchkiss; George W. J. Fleet","1-Amino-<i>N</i>,<i>N</i>-dibenzyl-1-deoxy-α-<small>D</small>-tagatopyranose methanol solvate","Acta Crystallographica Section E","2005","61","5","o1475","o1477","10.1107/S160053680501233X","","","0.71073","MoKα","","0.0588","0.041","","0.0947","0.0862","0.0947","","","","","","0.8979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205664","5.802","0.0003","13.6911","0.0008","21.4006","0.0014","90","","92.721","0.004","90","","1698.06","0.17","298","2","293.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-Phthalimidobutoxy Phthalonitrile","4-[4-(1,3-Dioxo-2,3-dihydro-1H-isoindol-2-yl)butoxy]phthalonitrile","","- C20 H15 N3 O3 -","- C20 H15 N3 O3 -","- C80 H60 N12 O12 -","4","1","CI6547","Zhu, Xiao-Li; Lin, Mei-Jin; Wang, Jun-Dong; Chen, Nai-Sheng; Huang, Jin-Ling","4-[4-(1,3-Dioxo-2,3-dihydro-1<i>H</i>-isoindol-2-yl)butoxy]phthalonitrile","Acta Crystallographica Section E","2005","61","5","o1214","o1215","10.1107/S1600536805009797","","","0.71073","MoKα","","0.0493","0.0411","","","0.102","0.1076","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205665","5.883","0.002","8.022","0.003","12.387","0.005","90","","90.185","0.015","90","","584.6","0.4","292","2","292","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N,N'-diphenylethylenediamine","","- C14 H16 N2 -","- C14 H16 N2 -","- C28 H32 N4 -","2","0.5","CI6553","Lennartson, Anders; Kokoli, Theonitsa; Håkansson, Mikael","<i>N,N</i>'-Diphenylethylenediamine, an N—H···π- and C—H···π-bonded network","Acta Crystallographica Section E","2005","61","5","o1245","o1247","10.1107/S1600536805010135","","","0.71073","MoKα","","0.0727","0.0514","","","0.1452","0.1571","","","","","","0.995","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205666","9.9319","0.0007","10.3666","0.0008","10.5606","0.0008","109.71","0.01","94.138","0.001","98.458","0.001","1003.79","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-bromobenzenesulfonate","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-bromobenzenesulfonate","","- C21 H20 Br N O5 S -","- C21 H20 Br N O5 S -","- C42 H40 Br2 N2 O10 S2 -","2","1","CI6556","Boonwasana Jindawong; Suchada Chantrapromma; Hoong-Kun Fun; Xiao-Lan Yu; Chatchanok Karalai","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-bromobenzenesulfonate","Acta Crystallographica Section E","2005","61","5","o1340","o1342","10.1107/S1600536805011086","","","0.71073","MoKα","","0.0404","0.0346","","","0.0886","0.0919","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205667","9.8299","0.0011","10.1415","0.0011","19.486","0.002","83.183","0.002","89.886","0.002","76.646","0.002","1876","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[(triglycol ditolylene)imidiazolium]-2,6-dimethylpyridine dihexaflourphosphate","","- C33 H37 F12 N5 O4 P2 -","- C33 H37 F12 N5 O4 P2 -","- C66 H74 F24 N10 O8 P4 -","2","1","CI6557","Qin, Da-Bin; Song, Hai-Bin; Xu, Feng-Bo; Li, Qing-Shang; Zhang, Zheng-Zhi","[(Triglycol ditolylene)imidazolium]-2,6-dimethylpyridine bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","5","o1503","o1504","10.1107/S1600536805010627","","","0.71073","MoKα","","0.0799","0.0559","","","0.171","0.1875","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205668","10.4682","0.0008","17.7551","0.0013","14.1264","0.001","90","","106.058","0.001","90","","2523.1","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Z)-Ethyl 3-(4-chlorophenyl)-2-[(triphenylphosphoranylidene)amino]prop-2- enoate","","- C29 H25 Cl N O2 P -","- C29 H25 Cl N O2 P -","- C116 H100 Cl4 N4 O8 P4 -","4","1","CI6558","Xiao-Bo Huang; Jin-Chang Ding; Miao-Chang Liu; Xi-Chang Zhang; Mao-Lin Hu","(<i>Z</i>)-Ethyl 3-(4-chlorophenyl)-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","Acta Crystallographica Section E","2005","61","5","o1261","o1262","10.1107/S1600536805010391","","","0.71073","MoKα","","0.1096","0.0778","","","0.1394","0.1525","","","","","","1.138","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205669","9.886","0.002","5.7887","0.0011","20.646","0.004","90","","96.129","0.004","90","","1174.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Isopropyl 3, 5-dinitrobenzoate","","- C10 H10 N2 O6 -","- C10 H10 N2 O6 -","- C40 H40 N8 O24 -","4","1","CI6559","Long-Fei Jin; Feng-Ping Xiao","Isopropyl 3,5-dinitrobenzoate","Acta Crystallographica Section E","2005","61","5","o1269","o1270","10.1107/S1600536805010482","","","0.71073","MoKα","","0.1354","0.0562","","","0.1238","0.155","","","","","","0.974","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205670","9.254","0.002","6.864","0.002","13.174","0.003","90","","102.78","0.03","90","","816.1","0.4","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-{[2-(2-Hydroxyethylamino)ethylimino]methyl}naphthalen-2-ol perchlorate","","- C15 H19 Cl N2 O6 -","- C15 H19 Cl N2 O6 -","- C30 H38 Cl2 N4 O12 -","2","1","CI6560","Zhu, Hai-Liang; You, Zhong-Lu","A perchlorate salt of 1-{[2-(2-hydroxyethylamino)ethylimino]methyl}naphthalen-2-ol","Acta Crystallographica Section E","2005","61","5","o1271","o1272","10.1107/S1600536805010585","","","0.71073","MoKα","","0.0694","0.0531","","","0.1339","0.1452","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205671","11.444","0.002","7.954","0.0016","19.356","0.004","90","","102.83","0.03","90","","1717.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-{[3-(2-methyl)phenyl-1,2,4-oxadiazol-5-yl]methoxy}phenylacetate","","- C19 H18 N2 O4 -","- C19 H18 N2 O4 -","- C76 H72 N8 O16 -","4","1","CI6561","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","Methyl 2-{[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methoxy}phenylacetate","Acta Crystallographica Section E","2005","61","5","o1390","o1392","10.1107/S1600536805011505","","","0.71073","MoKα","","0.114","0.0549","","","0.1402","0.168","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205672","8.372","0.003","10.449","0.003","10.781","0.003","96.099","0.005","110.379","0.005","99.826","0.005","857","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis{[N-(4-hydroxysalicylidene)-N^'^,N^'^-diethylethyldiamine-κ^2^N,O] copper(II)oxalate} dihydrate","","- C30 H44 Cu2 N4 O14 -","- C30 H44 Cu2 N4 O14 -","- C30 H44 Cu2 N4 O14 -","1","0.5","CI6562","Guang-Jun Xu; Shi-Ping Yan; Dai-Zheng Liao; Zong-Hui Jiang; Peng Cheng","A new Schiff base copper (II) complex: bis[<i>N</i>-(4-hydroxysalicylidene)-<i>N</i>',<i>N</i>'-diethylethylenediamine-κ^2^<i>N</i>,<i>O</i>]bis[(oxalato-κ^2^<i>O</i>,<i>O</i>')copper(II)] dihydrate","Acta Crystallographica Section E","2005","61","5","m933","m935","10.1107/S1600536805011700","","","0.71073","MoKα","","0.0443","0.0313","","","0.076","0.0812","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205673","9.964","0.002","7.284","0.0016","11.462","0.003","90","","110.917","0.003","90","","777.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[2-(dimethylamino)ethyl]dithiooxamide","","- C10 H22 N4 S2 -","- C10 H22 N4 S2 -","- C20 H44 N8 S4 -","2","0.5","CI6564","Cui, Jian-Zhong; Zhang, Dan; Zhang, Hong; Pan, Shuo-Wen; Cheng, Peng; Liao, Dai-Zheng; Wang, Geng-Lin","<i>N</i>,<i>N</i>'-Bis[2-(dimethylamino)ethyl]dithiooxamide","Acta Crystallographica Section E","2005","61","5","o1496","o1497","10.1107/S1600536805012225","","","0.71073","MoKα","","0.0793","0.0378","","","0.1011","0.1157","","","","","","0.991","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205674","16.507","0.006","8.361","0.003","18.907","0.007","90","","100.076","0.006","90","","2569.2","1.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-(3H-inden-1-ylmethyl)-2,2'-bis(methoxymethoxy)-1,1'-binaphthalenyl","","- C34 H30 O4 -","- C34 H30 O4 -","- C136 H120 O16 -","4","1","CI6565","Jian Xiao; Yong-Na Lu; Guo-Cang Wang; Qun-sheng Guo; Bin Liu; Hai-Bin Song; Jin-Shan Li","3-(3<i>H</i>-Inden-1-ylmethyl)-2,2'-bis(methoxymethoxy)-1,1'-binaphthalenyl","Acta Crystallographica Section E","2005","61","5","o1501","o1502","10.1107/S1600536805012079","","","0.71073","MoKα","","0.1085","0.0576","","","0.118","0.1379","","","","","","1.086","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205675","11.545","0.002","20.694","0.003","8.597","0.0015","90","","110.147","0.004","90","","1928.3","0.6","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2-chlorophenyl)-3-methyl-1-phenyl-6-(2-pyridyl)pyrazolo[3,4-b]pyridine","","- C24 H17 Cl N4 -","- C24 H17 Cl N4 -","- C96 H68 Cl4 N16 -","4","1","CI6566","Tu, Shu-Jiang; Zhu, Song-Lei; Zou, Xiang","4-(2-Chlorophenyl)-3-methyl-1-phenyl-6-(2-pyridyl)pyrazolo[3,4-<i>b</i>]pyridine","Acta Crystallographica Section E","2005","61","5","o1398","o1399","10.1107/S1600536805011657","","","0.7107","MoKα","","0.0898","0.0666","","","0.1291","0.1396","","","","","","1.156","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205676","10.9746","0.0004","21.409","0.0011","17.0115","0.0006","90","","98.468","0.003","90","","3953.4","0.3","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 N6 Ni O12 -","- C40 H40 N6 Ni O12 -","- C160 H160 N24 Ni4 O48 -","4","1","CI6567","Uçar, İbrahim; Yeşilel, Okan Zafer; Bulut, Ahmet; Ölmez, Halis; Büyükgüngör, Orhan","Tris(1,10-phenanthroline)nickel(II) squarate octahydrate","Acta Crystallographica Section E","2005","61","5","m947","m949","10.1107/S1600536805012055","","","0.71073","MoKα","","0.0751","0.0357","","","0.0751","0.0831","","","","","","0.843","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205677","11.0324","0.0002","5.62","0.0002","16.4317","0.0003","90","","105.789","0.002","90","","980.36","0.04","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DL-Leucinium nitrate","","","- C6 H14 N2 O5 -","- C6 H14 N2 O5 -","- C24 H56 N8 O20 -","4","1","CI6568","Berrah, Fadila; Benali-Cherif, Nourredine; Lamraoui, Hanane","<small>DL</small>-Leucinium nitrate","Acta Crystallographica Section E","2005","61","5","o1517","o1519","10.1107/S1600536805012110","","","0.71073","MoKα","","0.1166","0.0414","","","0.0785","0.0927","","","","","","0.836","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205678","7.3556","0.0004","10.1773","0.0005","10.3602","0.0005","79.123","0.002","74.383","0.002","70.125","0.002","698.39","0.06","180","2","180","2","","","","","","","","6","P -1","-P 1","2","trans-Co(en)2(NO2)2 periodate","trans-bis(ethylenediamine-κ^2^N,N')dinitrocobalt(III) periodate","","- C4 H16 Co I N6 O8 -","- C4 H16 Co I N6 O8 -","- C8 H32 Co2 I2 N12 O16 -","2","1","CI6570","Sharma, Raj Pal; Sharma, Rajni; Bala, Ritu; Bond, Andrew D.","Second-sphere coordination in anion binding: <i>trans</i>-bis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')dinitrocobalt(III) periodate","Acta Crystallographica Section E","2005","61","5","m997","m1000","10.1107/S1600536805012274","","","0.71073","MoKα","","0.0163","0.0153","","","0.0408","0.0411","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205679","6.7861","0.0001","8.5143","0.0001","19.0442","0.0003","88.623","0.0009","81.6364","0.0008","84.8577","0.0006","1084.2","0.03","150","","150","","","","","","","","","6","P -1","-P 1","2","","Poly[N,N,N',N'-tetramethylpropane-1,3-diaminium [aquatetraoxotri-μ~3~-sulfato-diuranate(VI)]]","","- C7 H22 N2 O17 S3 U2 -","- C7 H22 N2 O17 S3 U2 -","- C14 H44 N4 O34 S6 U4 -","2","1","CV6472","Norquist, Alexander J.; Doran, Michael B.; O'Hare, Dermot","(C~7~H~20~N~2~)[(UO~2~)~2~(SO~4~)~3~(H~2~O)]: an organically templated uranium sulfate with a novel layer topology","Acta Crystallographica Section E","2005","61","5","m807","m810","10.1107/S1600536805009670","","","0.71073","MoKα","","0.0406","0.0371","","0.1002","0.0965","0.0965","","","","","","0.9085","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205680","7.3983","0.0002","7.6333","0.0002","12.5946","0.0005","95.1761","0.0012","94.6412","0.0013","96.578","0.002","700.7","0.04","150","","150","","","","","","","","","6","P -1","-P 1","2","","Bis(propane-1,2-diaminium) tetraaquadi-μ~2~-sulfato-disulfatotetraoxodiuranate(VI) dihydrate","","- C6 H36 N4 O26 S4 U2 -","- C6 H36 N4 O26 S4 U2 -","- C6 H36 N4 O26 S4 U2 -","1","0.5","CV6473","Doran, Michael B.; Norquist, Alexander J.; O'Hare, Dermot","(C~3~H~12~N~2~)~2~[UO~2~(H~2~O)~2~(SO~4~)~2~]~2~·2H~2~O: an organically templated uranium sulfate with a novel dimer type","Acta Crystallographica Section E","2005","61","5","m881","m884","10.1107/S1600536805009682","","","0.71073","MoKα","","0.0268","0.0225","","0.0595","0.0555","0.0555","","","","","","0.828","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205681","6.4308","0.0011","9.8948","0.0017","15.356","0.003","90","","99.179","0.004","90","","964.6","0.3","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(3,4- methylenedioxyphenyl)methyleneimino]-1H-pyrazole-3-carbonitrile","","- C19 H9 Cl2 F3 N4 O2 -","- C19 H9 Cl2 F3 N4 O2 -","- C38 H18 Cl4 F6 N8 O4 -","2","1","CV6475","Zhong, Ping; Zhang, Xiao-Hong; Yang, Zhi-Ping; Xiao, Hong-Ping; Hu, Mao-Lin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(3,4-methylenedioxyphenyl)methyleneimino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","5","o1448","o1449","10.1107/S1600536805012262","","","0.71073","MoKα","","0.0868","0.0646","","","0.1305","0.1535","","","","","","1.068","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205682","6.8815","0.0011","16.468","0.003","9.7901","0.0016","90","","95.568","0.002","90","","1104.2","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-cyano-7-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate","","- C11 H10 N4 O2 -","- C11 H10 N4 O2 -","- C44 H40 N16 O8 -","4","1","CV6476","Li-Rong Wen; Shu-wen Wang; Ming Li; Wei-si Guo","Ethyl 3-cyano-7-methylpyrazolo[1,5-<i>a</i>]pyrimidine-6-carboxylate","Acta Crystallographica Section E","2005","61","5","o1459","o1460","10.1107/S1600536805012353","","","0.71073","MoKα","","0.0443","0.0359","","","0.0992","0.1052","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205683","9.8963","0.0016","9.3319","0.0012","13.4112","0.0018","90","","95.234","0.012","90","","1233.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H11 O3 P S4 -","- C7 H11 O3 P S4 -","- C28 H44 O12 P4 S16 -","4","1","CV6478","Chen, Hong-Yu; Yu, Wen-Tao; Xue, Gang; Fang, Qi","Dimethyl (5,6-dihydro-2<i>H</i>-1,3-dithiolo[4,5-<i>b</i>][1,4]dithiin-2-yl)phosphonate","Acta Crystallographica Section E","2005","61","5","o1400","o1402","10.1107/S1600536805011542","","","0.71073","MoKα","","0.1037","0.0826","","","0.2034","0.2222","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205684","10.729","0.003","12.116","0.003","19.552","0.006","89.721","0.005","85.328","0.006","66.677","0.004","2325.1","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{1,8-Bis[2-(1-benzyl-1H-imidazol-3-ylmethyl-κC^2^)phenoxy]-3,6-dioxaoctane- κ^2^O^3^,O^6^}mercury(II) bis(hexaflourophosphate) nitromethane solvate","","- C41 H45 F12 Hg N5 O6 P2 -","- C41 H45 F12 Hg N5 O6 P2 -","- C82 H90 F24 Hg2 N10 O12 P4 -","2","1","CV6480","Da-Bin Qin; Hai-Bin Song; Feng-Bo Xu; Qing-Shang Li; Zheng-Zhi Zhang","{1,8-Bis[2-(1-benzyl-1<i>H</i>-imidazol-3-ylmethyl-κ<i>C</i>^2^)phenoxy]-3,6-dioxaoctane-κ^2^<i>O</i>^3^,<i>O</i>^6^}mercury(II) bis(hexaflourophosphate) nitromethane solvate","Acta Crystallographica Section E","2005","61","5","m826","m827","10.1107/S1600536805009943","","","0.71073","MoKα","","0.0753","0.0492","","","0.101","0.1123","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205685","17.027","0.006","6.828","0.003","10.126","0.004","90","","111.844","0.004","90","","1092.7","0.8","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Tetra-aqua-bis(isothiocyanate)-manganese(II) bis(2-methylpyrazine-1,4-dioxide)","","- C12 H20 Mn N6 O8 S2 -","- C12 H20 Mn N6 O8 S2 -","- C24 H40 Mn2 N12 O16 S4 -","2","0.25","CV6483","Wen, Xu; Shi, Jing Min; Xia, Zhang","Tetraaquabis(isothiocyanato)manganese(II) bis(2-methylpyrazine-1,4-dioxide)","Acta Crystallographica Section E","2005","61","5","m854","m855","10.1107/S1600536805010664","","","0.71073","MoKα","","0.0373","0.035","","","0.0954","0.0974","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205686","7.4937","0.0019","11.764","0.003","9.778","0.002","90","","102.784","0.004","90","","840.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 3-nitrobenzoate","","- C8 H7 N O4 -","- C8 H7 N O4 -","- C32 H28 N4 O16 -","4","1","CV6484","Jin, Long-Fei; Xiao, Feng-Ping","Methyl 3-nitrobenzoate","Acta Crystallographica, Section E","2005","61","5","o1238","o1239","10.1107/S1600536805009955","","","0.71073","MoKα","","0.0622","0.046","","","0.1195","0.1322","","","","","","1.039","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205687","12.429","0.002","13.359","0.002","7.6176","0.0013","90","","103.414","0.002","90","","1230.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2,4-Difluorophenyl)-1-[3-(2-fluorophenyl)oxiran-2-yl]methanone","","- C15 H9 F3 O2 -","- C15 H9 F3 O2 -","- C60 H36 F12 O8 -","4","1","CV6485","Liang-Zhong Xu; Shuang-Hua Yang; Zhi-Guo Jiang; Guan-Ping Yu; Guo-Dong Si","1-(2,4-Difluorophenyl)-1-[3-(2-fluorophenyl)oxiran-2-yl]methanone","Acta Crystallographica Section E","2005","61","5","o1226","o1227","10.1107/S1600536805009967","","","0.71073","MoKα","","0.079","0.0434","","","0.1156","0.1304","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205688","10.0686","0.0018","10.3118","0.0019","10.392","0.0019","87.47","0.003","85.492","0.002","78.284","0.002","1052.8","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(3,5-bis(phenylamino)-1,2-dithiolan-4-yl)(2,5-dichlorophenyl)methanone","","- C22 H14 Cl2 N2 O S2 -","- C22 H14 Cl2 N2 O S2 -","- C44 H28 Cl4 N4 O2 S4 -","2","1","CV6489","Xu, Liang-Zhong; Yu, Guan-Ping; Huang, Yong-Wei; Zhou, Kai; Zhu, Qi","(3,5-Bis(phenylamino)-1,2-dithiolan-4-yl)(2,5-dichlorophenyl)methanone","Acta Crystallographica Section E","2005","61","5","o1321","o1322","10.1107/S1600536805010780","","","0.71073","MoKα","","0.0526","0.0342","","","0.0862","0.0915","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205689","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","2","","","","- C42 H54 N4 -","- C42 H54 N4 -","- C84 H108 N8 -","2","1","CV6490","Bolte, Michael","4,4'-Bis(di-<i>n</i>-butylaminostyryl)-2,2'-bipyridine: a space group revision","Acta Crystallographica Section E","2005","61","5","o1364","o1366","10.1107/S1600536805011414","","","0.71069","MoKα","","0.2045","0.0795","","","0.2159","0.2702","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205690","17.3586","0.0019","9.8854","0.0011","26.324","0.003","90","","90","","90","","4517.1","0.9","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","catena-Poly[[μ-1,2-di-4-pyridylethylene-κ^2^N,N'-[aqua(2-sulfonatobenzoato- κ^2^O,O')copper(II)]] N,N-dimethylformamide]","","- C22 H23 Cu N3 O7 S -","- C22 H23 Cu N3 O7 S -","- C176 H184 Cu8 N24 O56 S8 -","8","1","CV6491","Hong-Ping Xiao; Qian Shi; Ya-Qian Cheng","<i>catena</i>-Poly[[μ-1,2-di-4-pyridylethylene-κ^2^<i>N</i>,<i>N</i>'-[aqua(2-sulfonatobenzoato-κ^2^<i>O</i>,<i>O</i>')copper(II)]] <i>N</i>,<i>N</i>-dimethylformamide]<i></i>","Acta Crystallographica Section E","2005","61","5","m907","m909","10.1107/S1600536805011475","","","0.71073","MoKα","","0.1033","0.0936","","","0.1658","0.1698","","","","","","1.417","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205691","10.5529","0.0008","11.9861","0.0009","11.9789","0.0009","90","","108.662","0.001","90","","1435.52","0.19","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","S-(4-methoxyphenyl) 3-methylsulfonyl-2-oxoimidazolidine-1-carbothioate","","- C12 H14 N2 O5 S2 -","- C12 H14 N2 O5 S2 -","- C48 H56 N8 O20 S8 -","4","1","CV6495","Wen Feng; Xue-ping Wu; Wei-Ke Su","<i>S</i>-(4-Methoxyphenyl) 3-methylsulfonyl-2-oxoimidazolidine-1-carbothioate","Acta Crystallographica Section E","2005","61","5","o1507","o1508","10.1107/S1600536805012560","","","0.71073","MoKα","","0.0584","0.0524","","","0.1153","0.1188","","","","","","1.176","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205692","10.797","0.002","11.571","0.002","12.0982","0.0016","90","","123.576","0.011","90","","1259.3","0.4","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-acetyl-4-methyl-2-(o-toluidinyl)-1,3-thiazole","","- C13 H14 N2 O S -","- C13 H14 N2 O S -","- C52 H56 N8 O4 S4 -","4","1","CV6497","Yamin, Bohari M.; Kasim. N. Azilah; Akhiar, Ezuanita","5-Acetyl-4-methyl-2-(<i>o</i>-toluidinyl)-1,3-thiazole","Acta Crystallographica Section E","2005","61","5","o1478","o1479","10.1107/S160053680501250X","","","0.71073","MoKα","","0.049","0.044","","","0.118","0.122","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205693","10.898","0.002","21.521","0.005","6.623","0.002","90","","90","","90","","1553.3","0.7","298","2","298","2","","","","","","","","4","C m c e","-C 2ac 2","64","","tripotassium triiron(III) tetraarsenate","","- As4 Fe3 K3 O16 -","- As4 Fe3 K3 O16 -","- As16 Fe12 K12 O64 -","4","0.25","DN6202","Ouerfelli, Najoua; Zid, Mohamed Faouzi; Jouini, Tahar","Composé à charpente bidimensionnelle K~3~Fe~3~(AsO~4~)~4~","Acta Crystallographica, Section E","2005","61","5","i67","i69","10.1107/S1600536805008998","","","0.71073","MoKα","","0.0564","0.04","","","0.0945","0.1022","","","","","","1.076","","","","has coordinates","282068","2023-03-26","10:12:38",""
"2205694","12.09","0.003","13.403","0.003","8.157","0.003","90","","95.79","0.03","90","","1315","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 N O5 S -","- C14 H11 N O5 S -","- C56 H44 N4 O20 S4 -","4","1","DN6205","Stefanowicz, Piotr; Jaremko, Łukasz; Jaremko, Mariusz; Lis, Tadeusz","1-[(2-Naphthylsulfonyl)oxy]pyrrolidine-2,5-dione","Acta Crystallographica Section E","2005","61","5","o1326","o1328","10.1107/S1600536805010469","","","0.71073","MoKα","","0.0704","0.0455","","","0.1212","0.1333","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205695","8.7112","0.0015","9.8967","0.0017","11.1551","0.0019","73.323","0.002","88.603","0.002","66.981","0.002","843.7","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","2-(4-Fluorophenyl)-2-oxo-1-(1<i>H</i>-1,2,4-triazol-1-yl)ethyl piperidine-1-carbodithiolate","","- C16 H17 F N4 O S2 -","- C16 H17 F N4 O S2 -","- C32 H34 F2 N8 O2 S4 -","2","1","DN6208","Liang-Zhong Xu; Kai Li; Chong-Yi Zhu; Guo-Dong Si; Guan-Ping Yu","2-(4-Fluorophenyl)-2-oxo-1-(1<i>H</i>-1,2,4-triazol-1-yl)ethyl piperidine-1-carbodithiolate","Acta Crystallographica Section E","2005","61","5","o1306","o1307","10.1107/S1600536805010561","","","0.71073","MoKα","","0.0492","0.0337","","","0.0813","0.0859","","","","","","1.096","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205696","8.2045","0.0009","8.9704","0.001","9.6826","0.001","93.026","0.002","109.337","0.002","109.787","0.002","621.71","0.12","293","2","293","2","","","","","","","","3","P -1","-P 1","2","3-hydroxykojic acid","3,5-dihydroxy-2-hydroxymethyl-4H-pyran-4-one","","- C6 H6 O5 -","- C6 H6 O5 -","- C24 H24 O20 -","4","2","DN6212","Yao, Guang-Min; Wang, Yu-Bo; Wang, Li-Quan; Qin, Guo-Wei","3,5-Dihydroxy-2-hydroxymethyl-4<i>H</i>-pyran-4-one","Acta Crystallographica Section E","2005","61","5","o1403","o1405","10.1107/S1600536805011633","","","0.71073","MoKα","","0.0672","0.0609","","","0.1745","0.1818","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205697","8.159","0.007","8.712","0.007","10.531","0.009","82.385","0.013","77.494","0.013","80.064","0.014","716.3","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H20 Fe N10 O4 S2 -","- C26 H20 Fe N10 O4 S2 -","- C26 H20 Fe N10 O4 S2 -","1","0.5","DN6213","Xiao-Jun Zhao; Jian-Hua Guo; Miao Du","A three-dimensional hydrogen-bonded network of diaquabis(2,5-di-3-pyridyl-1,3,4-oxadiazole)dithiocyanatoiron(II)","Acta Crystallographica Section E","2005","61","5","m913","m915","10.1107/S1600536805011268","","","0.71073","MoKα","","0.0651","0.0407","","","0.0844","0.0932","","","","","","1.023","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205698","10.4874","0.001","12.1216","0.0014","16.3091","0.0016","90","","90","","90","","2073.3","0.4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1-(2-furyl)-3-phenyl-2-propen-1-one","","- C13 H10 O2 -","- C13 H10 O2 -","- C104 H80 O16 -","8","1","DN6214","Ocak Ískeleli, Nazan; Işık, Şamil; Özdemir, Zuhal; Bilgin, Altan","1-(2-Furyl)-3-phenyl-2-propen-1-one","Acta Crystallographica Section E","2005","61","5","o1278","o1279","10.1107/S1600536805010615","","","0.71073","MoKα","","0.108","0.0402","","","0.0658","0.0793","","","","","","0.843","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205699","12.6686","0.001","8.9057","0.0007","13.44","0.0011","90","","91.737","0.001","90","","1515.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(4,5,6,7-tetrachloro-1,3-dioxoisoindolin-2-yl)benzaldehyde","","- C15 H5 Cl4 N O3 -","- C15 H5 Cl4 N O3 -","- C60 H20 Cl16 N4 O12 -","4","1","DN6215","Liu, Xin-Gang; Feng, Ya-Qing; Wang, Wei; Liang, Zu-Pei; Yang, Guang","4-(4,5,6,7-Tetrachloro-1,3-dioxoisoindolin-2-yl)benzaldehyde","Acta Crystallographica Section E","2005","61","5","o1316","o1317","10.1107/S1600536805010822","","","0.71073","MoKα","","0.0382","0.0301","","","","0.0852","","","","","","1.098","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205700","10.2204","0.0011","12.4047","0.0013","13.7842","0.0015","106.505","0.002","94.417","0.002","110.455","0.002","1539.4","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","[Aquabis(1,10-phenanthroline-κ^2^N,N')(2-sulfobenzoato-κO)manganese(II)] trihydrate","","- C31 H28 Mn N4 O9 S -","- C31 H28 Mn N4 O9 S -","- C62 H56 Mn2 N8 O18 S2 -","2","1","DN6217","Hong-Ping Xiao","Aquabis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(2-sulfobenzoato-κ<i>O</i>)manganese(II) trihydrate","Acta Crystallographica Section E","2005","61","5","m942","m944","10.1107/S1600536805011906","","","0.71073","MoKα","","0.101","0.0732","","","0.1419","0.1539","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205701","7.8089","0.0004","8.8904","0.0005","14.7466","0.0012","90","","96.143","0.007","90","","1017.89","0.11","122","1","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-(1-naphtyl)propionic acid","","- C13 H12 O2 -","- C13 H12 O2 -","- C52 H48 O8 -","4","1","ER6003","Riis, Erik; Larsen, Sine","2-(1-Naphthyl)propionic acid","Acta Crystallographica Section E","2005","61","5","o1396","o1397","10.1107/S1600536805004125","","","0.71073","MoKα","","0.0707","0.0549","","","0.1463","0.1606","","","","","","1.053","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205702","9.608","0.0019","22.856","0.004","10.2908","0.0017","90","","98.353","0.016","90","","2235.9","0.7","298","2","298","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C24 H29 N O5 -","- C24 H29 N O5 -","- C96 H116 N4 O20 -","4","1","ER6008","Våbenø, Jon; Ingebrigtsen, Truls; Lejon, Tore; Luthman, Kristina; Hansen, Lars Kr.","Benzyl-5-[<i>N</i>-(<i>tert</i>-butoxycarbonyl)amino]-4-oxo-6-phenylhexanoate","Acta Crystallographica Section E","2005","61","5","o1331","o1332","10.1107/S1600536805010895","","","0.71069","MoKα","","0.1193","0.0354","","","0.0816","0.0987","","","","","","0.912","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205703","9.0795","0.0018","10.134","0.002","12.624","0.003","104.84","0.03","91.11","0.03","92.08","0.03","1121.6","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","{2-[(2-Hydroxyphenyl)iminomethyl]phenolato}(N-oxido-N- phenylbenzamide)oxovanadium(V)","","- C26 H19 N2 O5 V -","- C26 H19 N2 O5 V -","- C52 H38 N4 O10 V2 -","2","1","ER6010","Shan Gao; Li-Hua Huo; Zhao-Peng Deng; Hui Zhao","{2-[(2-Hydroxyphenyl)iminomethyl]phenolato}(<i>N</i>-oxido-<i>N</i>-phenylbenzamide)oxovanadium(V)","Acta Crystallographica Section E","2005","61","5","m978","m980","10.1107/S1600536805012602","","","0.71073","MoKα","","0.0564","0.0456","","","0.1246","0.1313","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205704","10.8349","0.0007","10.8349","0.0007","14.6028","0.0013","90","","90","","120","","1484.62","0.19","298","2","298","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","Tris({2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)cobalt(II) diperchlorate","","- C21 H30 Cl2 Co N10 O8 -","- C21 H30 Cl2 Co N10 O8 -","- C42 H60 Cl4 Co2 N20 O16 -","2","0.333333","ER6012","Chen, Hong-Mei; Yang Shi-Ping; Chen, Qiong-Qiong; Zhang, Fan; Chen Jia-Min; Yu, Xi-Bin","Tris({2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)cobalt(II) diperchlorate","Acta Crystallographica Section E","2005","61","5","m1001","m1003","10.1107/S1600536805012596","","","0.71073","MoKα","","0.055","0.0507","","","0.1331","0.1366","","","","","","1.041","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205705","10.367","0.004","5.1611","0.0007","13.12","0.003","90","","93.2","0.02","90","","700.9","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-Asparaginium picrate","L-Asparaginium picrate","","- C10 H11 N5 O10 -","- C10 H11 N5 O10 -","- C20 H22 N10 O20 -","2","1","ER6019","K. Anitha; S. Athimoolam; R. K. Rajaram","<small>L</small>-Asparaginium picrate","Acta Crystallographica Section E","2005","61","5","o1463","o1465","10.1107/S1600536805012080","","","0.71073","MoKα","","0.0271","0.0251","","","0.0679","0.0695","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205706","11.063","0.002","18.313","0.003","12.615","0.002","90","","92.578","0.002","90","","2553.2","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[μ-salicylaldehyde (1-carboxylatoethylidene)hydrazonato(2-)]bis[ethanolbis(4-fluorobenzyl)tin(IV)]","","- C52 H52 F4 N4 O10 Sn2 -","- C52 H52 F4 N4 O10 Sn2 -","- C104 H104 F8 N8 O20 Sn4 -","2","0.5","FL6151","Min Hong; Handong Yin; Daqi Wang; Zhongjun Gao","Bis(4-fluorobenzyl)tin(IV) ester of pyruvic acid salicylhydrazone","Acta Crystallographica Section E","2005","61","5","m801","m803","10.1107/S1600536805009694","","","0.71073","MoKα","","0.0475","0.0288","","","0.0677","0.0799","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205707","9.245","0.0008","10.0697","0.0009","18.87","0.002","90","","102.654","0.008","90","","1714","0.3","298","2","298","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","12,12'-Diisobutyl-11,11'-ethylenebis(9,10-dihydro-9,10-ethenoanthracene)","","- C44 H46 -","- C44 H46 -","- C88 H92 -","2","0.5","FL6152","Herres, Joeseph P.; Forman, Mark A.; Wheeler, Kraig A.; Yap, Glenn P.A.","11-(2,2-Dimethylpropyl)-12-{2-[12-(2,2-dimethylpropyl)-9,10-dihydro-9,10-ethenoanthracen-11-yl]ethyl}-9,10-dihydro-9,10-ethenoanthracene","Acta Crystallographica Section E","2005","61","5","o1223","o1225","10.1107/S160053680500944X","","","0.71073","MoKα","","0.1336","0.0593","","","0.1087","0.1336","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205708","5.838","0.002","9.883","0.004","10.576","0.004","107.225","0.014","100.203","0.014","98.894","0.014","559.5","0.4","105","2","105","2","","","","","","","","4","P 1","P 1","1","α-thymidine","1-(2-Deoxy-α-D-ribofuranosyl)-5-methyluracil","","- C10 H14 N2 O5 -","- C10 H14 N2 O5 -","- C20 H28 N4 O10 -","2","2","FL6154","Görbitz, Carl Henrik; Nelson, William H.; Sagstuen, Einar","α-Thymidine at 105 K","Acta Crystallographica Section E","2005","61","5","o1207","o1209","10.1107/S1600536805009700","","","0.71073","MoKα","","0.034","0.0322","","","0.085","0.0861","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205709","6.0458","0.0003","9.3592","0.0005","14.0314","0.0006","90","","90.5","0.001","90","","793.92","0.07","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","poly[dioxouranium(VI)-μ~4~-n-pentane-1,5-dicarboxylato]","","- C5 H6 O6 U -","- C5 H6 O6 U -","- C20 H24 O24 U4 -","4","1","FL6155","Borkowski, Lauren A.; Cahill, Christopher L.","A novel uranium-containing coordination polymer: poly[dioxouranium(VI)-μ~4~-<i>n</i>-pentane-1,5-dicarboxylato]","Acta Crystallographica Section E","2005","61","5","m816","m817","10.1107/S1600536805009438","","","0.71073","MoKα","","0.0315","0.0267","","","601","0.0622","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205710","17.815","0.005","8.022","0.003","12.251","0.003","90","","110.09","0.02","90","","1644.3","0.9","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-(Hexyloxy)phenyl)pyridin-4(1H)-one monohydrate","","- C17 H23 N O3 -","- C17 H23 N O3 -","- C68 H92 N4 O12 -","4","1","FL6156","Robinson, Paul D.; Li, Chenguang; Wolf, Jeremy R.; Dyer, Daniel J.","1-[4-(Hexyloxy)phenyl]pyridin-4(1<i>H</i>)-one monohydrate","Acta Crystallographica Section E","2005","61","5","o1254","o1256","10.1107/S1600536805010524","","","0.71069","MoKα","","0.158","0.071","","","0.219","0.28","","","","","","1.04","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205711","8.7362","0.0011","6.8235","0.0008","16.957","0.002","90","","95.769","0.002","90","","1005.7","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(+)-(1S,2S,3S,4R,5R)-N-(1,3-Dihydroxyprop-2-yl)-2,3,4-trihydroxy- 5-(hydroxymethyl)-1-cyclohexanaminium picrate","","- C16 H24 N4 O13 -","- C16 H24 N4 O13 -","- C32 H48 N8 O26 -","2","1","FL6157","Zhu, Jiarong; Chang, Hongjie; Feng, Xiao-Long","(+)-(1<i>S</i>,2<i>S</i>,3<i>S</i>,4<i>R</i>,5<i>R</i>)-<i>N</i>-(1,3-Dihydroxyprop-2-yl)-2,3,4-trihydroxy-5-(hydroxymethyl)-1-cyclohexanaminium picrate","Acta Crystallographica Section E","2005","61","5","o1498","o1500","10.1107/S1600536805012419","","","0.71073","MoKα","","0.0428","0.0373","","","0.0955","0.1029","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205712","6.2782","0.0003","8.5831","0.0004","12.3649","0.0006","90","","100.133","0.002","90","","655.91","0.05","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","p-aminobenzoic acid","","- C7 H7 N O2 -","- C7 H7 N O2 -","- C28 H28 N4 O8 -","4","1","GH6019","Sandra Gracin; Andreas Fischer","Redetermination of the β-polymorph of <i>p</i>-aminobenzoic acid","Acta Crystallographica Section E","2005","61","5","o1242","o1244","10.1107/S160053680500961X","","","0.71073","MoKα","","0.0834","0.0499","","","0.114","0.1314","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205713","19.0062","0.0018","11.2552","0.0011","20.457","0.002","90","","102.273","0.002","90","","4276.1","0.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(1,10-phenanthroline)nickel(II) hexamolybdate","","- C36 H24 Mo6 N6 Ni O19 -","- C36 H24 Mo6 N6 Ni O19 -","- C144 H96 Mo24 N24 Ni4 O76 -","4","0.5","HB6157","Wenju Wang; Lin Xu; Guanggang Gao; Yongge Wei","Tris(1,10-phenanthroline)nickel(II) hexamolybdate","Acta Crystallographica Section E","2005","61","5","m813","m815","10.1107/S1600536805009748","","","0.71073","MoKα","","0.0324","0.0284","","","0.0757","0.0785","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205714","15.2039","0.0013","7.0727","0.0006","19.4242","0.0019","90","","104.018","0.012","90","","2026.5","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Disodium 4-hydroxybutane-1,1-diylbis(diazeniumdiolate) sesquihydrate","","- C4 H11 N4 Na2 O6.5 -","- C4 H8 N4 Na2.005 O6.495 -","- C32 H64 N32 Na16.04 O51.96 -","8","1","HB6168","Arulsamy, Navamoney; Bohle, D. Scott","Disodium 4-hydroxybutane-1,1-diylbis(diazeniumdiolate) sesquihydrate","Acta Crystallographica Section E","2005","61","5","m961","m963","10.1107/S1600536805012250","","","0.71073","MoKα","","0.0302","0.0288","","","0.0732","0.0742","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205715","13.223","0.003","15.779","0.003","19.574","0.004","90","","101.065","0.004","90","","4008.1","1.4","120","","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(Piperidin-1-yl)propionic acid‒triphenyltin chloride (1/2)","","- C44 H45 Cl2 N O2 Sn2 -","- C44 H45 Cl2 N O2 Sn2 -","- C176 H180 Cl8 N4 O8 Sn8 -","4","1","HB6170","Lian Ee Khoo; Alan Hazell","A 1:2 adduct of 3-(piperidin-1-yl)propionic acid and triphenyltin chloride","Acta Crystallographica Section E","2005","61","5","m865","m867","10.1107/S1600536805010792","","","0.71073","MoKα","","","0.022","","","","0.025","","","","","","0.806","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205716","8.682","0.001","9.421","0.001","32.108","0.003","90","","90","","90","","2626.2","0.5","291","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Pentacarbonyl (diphenyl(N-propylamine)phosphine) diiron(μ-1,3-dithiolate propane)","","- C23 H24 Fe2 N O5 P S2 -","- C23 H24 Fe2 N O5 P S2 -","- C92 H96 Fe8 N4 O20 P4 S8 -","4","1","HB6172","Ekström, Jesper; Ott, Sascha; Sun, Licheng; Åkermark, Björn; Eriksson, Lars","Pentacarbonyl(diphenyl(<i>N</i>-propylamine)phosphine)diiron(μ-1,3-propanedithiolate)","Acta Crystallographica Section E","2005","61","5","m852","m853","10.1107/S1600536805010809","","","0.71073","MoKα","","0.123","0.0349","","","0.0488","0.0578","","","","","","0.885","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205717","24.12","0.011","10.732","0.005","21.78","0.011","90","","108.098","0.008","90","","5359","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H92 Cl2 P4 Ru -","- C50 H92 Cl2 P4 Ru -","- C200 H368 Cl8 P16 Ru4 -","4","0.5","HB6174","Linfang Jia; Wenfu Fu; Mingming Yu; Junfeng Zhang; Yong Chen","(<i>Trans</i>-dichloro-κ<i>Cl</i>)bis[(dicyclohexylphosphino)methane-κ^2^<i>P,P</i>'] ruthenium(II)","Acta Crystallographica Section E","2005","61","5","m858","m859","10.1107/S1600536805010743","","","0.71073","MoKα","","0.0504","0.0324","","","0.0743","0.0827","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205718","24.0937","0.0004","24.6345","0.0005","16.7428","0.0003","90","","117.375","0.0011","90","","8824.6","0.3","150","1","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H76 F12 Nd4 O42 S4 -","- C40 H56 F12 Nd4 O40 S4 -","- C160 H224 F48 Nd16 O160 S16 -","4","0.5","HB6176","Singh-Wilmot, Marvadeen A.; Kahwa, Ishenkumba A.; Lough, Alan J.","Octaaquatetrakis(μ~2~-2,6-diformyl-4-methylphenolato)tetra-μ~3~-hydroxo-tetraneodymium(III) trifluoromethanesulfonate butanol disolvate tetrahydrate","Acta Crystallographica Section E","2005","61","5","m970","m972","10.1107/S1600536805011785","","","0.71073","MoKα","","0.0529","0.0486","","","0.1204","0.1219","","","","","","1.232","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205719","7.5665","0.0016","9.701","0.002","14.129","0.003","103.82","0.003","98.958","0.003","91.721","0.003","992.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H20 N4 Ni O5 S2 -","- C14 H20 N4 Ni O5 S2 -","- C28 H40 N8 Ni2 O10 S4 -","2","1","HB6177","Shi, Jing Min; Liu, Zhe; Lu, Jian Jun; Liu, Lian Dong","Diaquabis(isothiocyanato)bis(4-methylpyridine <i>N</i>-oxide)nickel(II) monohydrate","Acta Crystallographica Section E","2005","61","5","m871","m872","10.1107/S1600536805010937","","","0.71073","MoKα","","0.0398","0.0353","","","0.0911","0.0941","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205721","15.235","0.0015","19.329","0.0012","15.875","0.0014","90","","113.96","0.006","90","","4272","0.7","273","","273","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","pyrimethaminium sulfosalicylate monohydrate","2,4-diamino-5-(4-chlorophenyl)-6-ethylpyrimidin-1-ium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","","- C19 H21 Cl N4 O7 S -","- C19 H21 Cl N4 O7 S -","- C152 H168 Cl8 N32 O56 S8 -","8","2","HB6180","Madhukar Hemamalini; Packianathan Thomas Muthiah; Balasubramanian Sridhar; Ramaswamy Karunanandam Rajaram","Pyrimethaminium sulfosalicylate monohydrate","Acta Crystallographica Section E","2005","61","5","o1480","o1482","10.1107/S1600536805012237","","","0.71069","MoKα","","0.0818","0.0356","","","0.0886","0.1059","","","","","","1.012","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2205722","4.9026","0.0005","17.0331","0.0016","10.479","0.001","90","","97.88","0.002","90","","866.8","0.15","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[μ~4~-5-(3-carboxylato)-1H-tetrazolato-zinc(II)]","","- C8 H4 N4 O2 Zn -","- C8 H4 N4 O2 Zn -","- C32 H16 N16 O8 Zn4 -","4","1","HB6181","Li, Jing-Tang; Tao, Jun; Huang, Rong-Bin; Zhang, Lan-Sun","Poly[μ~4~-5-(3-carboxylatophenyl)-1<i>H</i>-tetrazolato-zinc(II)]","Acta Crystallographica Section E","2005","61","5","m984","m985","10.1107/S1600536805012687","","","0.71073","MoKα","","0.0656","0.0513","","","0.1121","0.1184","","","","","","1.119","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205723","8.4429","0.0002","24.1805","0.0006","17.0825","0.0004","90","","103.495","0.007","90","","3391.17","0.17","295","3","295","3","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H30 Mn N4 O8 -","- C38 H30 Mn N4 O8 -","- C152 H120 Mn4 N16 O32 -","4","1","HB6182","Jian-Rong Su; Li Zhang; Duan-Jun Xu","Aqua(4-hydroxybenzoato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II) 4-hydroxybenzoate monohydrate","Acta Crystallographica Section E","2005","61","5","m939","m941","10.1107/S1600536805011694","","","0.71069","MoKα","","0.085","0.046","","","0.077","0.088","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205724","8.4061","0.0007","5.0843","0.0004","10.7278","0.0008","90","","90","","90","","458.5","0.06","93","2","93","2","","","","","","","","3","P n m a","-P 2ac 2n","62","PrCu~5-x~In~1+x~","","","- Cu4.76 In1.24 Pr -","- Cu4.763 In1.237 Pr -","- Cu19.052 In4.948 Pr4 -","4","0.5","HB6183","Bobev, Svilen; Bauer, Eric D.","PrCu~5{-~<i>x</i>}In~1+<i>x~</i> [<i>x</i> = 0.24(1)] with the orthorhombic CeCu~6~ structure type","Acta Crystallographica Section E","2005","61","5","i79","i81","10.1107/S1600536805011797","","","0.71073","MoKα","","0.0205","0.016","","","0.0316","0.0326","","","","","","1.136","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205725","8.4056","0.0007","5.0939","0.0004","10.738","0.0008","90","","90","","90","","459.77","0.06","93","2","93","2","","","","","","","","3","P n m a","-P 2ac 2n","62","CeCu~5-x~In~1+x~","cerium copper indium","","- Ce Cu4.82 In1.17 -","- Ce Cu4.822 In1.178 -","- Ce4 Cu19.288 In4.712 -","4","0.5","HB6184","Bobev, Svilen; Bauer, Eric D.","CeCu~5{-~<i>x</i>}In~1+<i>x~</i> [<i>x</i> = 0.17(1)] with the orthorhombic CeCu~6~ structure","Acta Crystallographica Section E","2005","61","5","i89","i90","10.1107/S1600536805012249","","","0.71073","MoKα","","0.0225","0.0201","","","0.0494","0.0502","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205726","9.705","0.004","10.205","0.004","10.866","0.004","96.481","0.005","111.579","0.005","116.199","0.005","847.7","0.6","183","2","183","2","","","","","","","","7","P -1","-P 1","2","Bis(ferrocenoyl thioureylene)ethane","1,2-Bis(ferrocenylcarbonylthioureido)ethane chloroform trisolvate","","- C28 H28 Cl6 Fe2 N4 O2 S2 -","- C28 H28 Cl6 Fe2 N4 O2 S2 -","- C28 H28 Cl6 Fe2 N4 O2 S2 -","1","0.5","HB6186","Duan, Xine; Zhang, Zhao; Huo, Fangjun","1,2-Bis(ferrocenylcarbonylthioureido)ethane chloroform disolvate","Acta Crystallographica Section E","2005","61","5","m1004","m1005","10.1107/S1600536805012705","","","0.71073","MoKα","","0.0749","0.0684","","","0.1554","0.1591","","","","","","1.127","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205727","8.157","0.001","6.7568","0.0008","17.451","0.002","90","","94.697","0.002","90","","958.6","0.2","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","catena-Poly[[aquazinc(II)]-μ-2-carboxylatophenoxyacetato]","","- C9 H8 O6 Zn -","- C9 H8 O6 Zn -","- C36 H32 O24 Zn4 -","4","1","HB6187","Yang, Yan; Meng, Fa-Yan; Zeng, Ming-Hua; Ng, Seik Weng","<i>catena</i>-Poly[[aquazinc(II)]-μ-2-carboxylatophenoxyacetato]","Acta Crystallographica Section E","2005","61","5","m986","m988","10.1107/S1600536805012729","","","0.71073","MoKα","","0.026","0.022","","","0.058","0.06","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205728","7.15","0.002","8.573","0.003","11.171","0.003","98.316","0.004","98.953","0.004","98.42","0.004","659.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","6-Cyano-3,3-dimethyl-5-methylsulfanyl-1,3-dihydro-2-oxo-1-thia- 3b,4,8-triazaindacene 1,1-dioxide","","- C11 H10 N4 O3 S2 -","- C11 H10 N4 O3 S2 -","- C22 H20 N8 O6 S4 -","2","1","HG6151","Tian, Li; Wang, Da-Xiang","6-Cyano-3,3-dimethyl-5-methylsulfanyl-1,3-dihydro-2-oxo-1-thia-3b,4,8-triazaindacene 1,1-dioxide","Acta Crystallographica Section E","2005","61","5","o1286","o1287","10.1107/S1600536805010329","","","0.71073","MoKα","","0.0447","0.0393","","","0.1184","0.1208","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205729","10.384","0.002","11.867","0.002","12.659","0.003","90.98","0.003","108.339","0.003","111.211","0.002","1365.2","0.5","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","Dianilinodimethylsilane","","- C14 H18 N2 Si -","- C14 H18 N2 Si -","- C56 H72 N8 Si4 -","4","2","HG6152","Dong, Hai-Lin; Tong, Hong-Bo; Wei, Xue-Hong; Huang, Shu-Ping; Liu, Dian-Sheng","Dianilinodimethylsilane","Acta Crystallographica Section E","2005","61","5","o1354","o1355","10.1107/S1600536805011037","","","0.71073","MoKα","","0.0852","0.0785","","","0.1515","0.1552","","","","","","1.231","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205730","7.6811","0.0015","9.754","0.002","14.357","0.003","90","","90","","90","","1075.6","0.4","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Naphthalene-1,4,5,8-tetracarboxylic 1,8-anhydride","","- C14 H6 O7 -","- C14 H6 O7 -","- C56 H24 O28 -","4","1","HG6153","Xu, Yan-Qing; Yuan, Da-Qiang; Zhou, You-Fu; Wu, Ming-Yan; Hong, Mao-Chun","Naphthalene-1,4,5,8-tetracarboxylic 1,8-anhydride","Acta Crystallographica Section E","2005","61","5","o1294","o1296","10.1107/S1600536805009463","","","0.71073","MoKα","","0.0821","0.0634","","","0.128","0.1385","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205731","19.1786","0.0009","7.7058","0.0003","14.0757","0.0007","90","","92.373","0.002","90","","2078.41","0.16","296.1","","","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C23 H23 F O8 -","- C23 H23 F O8 -","- C92 H92 F4 O32 -","4","1","HG6158","Zhou, Feng-Yan; Jian, Shan-Zhong; He, Xue-Ying; Wang, Yan-Guang","(5<i>R</i>,5a<i>R</i>,8a<i>R</i>,9<i>S</i>)-5-(3,4-dihydroxy-5-methoxyphenyl)-9-fluoro-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-<i>d</i>]-1,3-dioxol-6(5a<i>H</i>)-one acetone solvate","Acta Crystallographica Section E","2005","61","5","o1374","o1376","10.1107/S1600536805011189","","","0.7107","MoKα","","","0.047","","","","0.132","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205732","25.035","0.002","25.035","0.002","11.929","0.002","90","","90","","90","","7476.5","1.5","293","2","293","2","","","","","","","","6","I -4","I -4","82","","1-N-methyl-spiro[2.3']oxindole-spiro[3.2""]5""-(4-chloro)phenyl -10""-(4-chloro)benzylidene-2"",3"",6"",7"",8"",9""-hexahydro-5H,10H- cyclohepteno[1,2-d]thiazolo[3,2-a]pyrimidin-3""-one-4-(2,4- dichloro)phenyl-pyrrolidine","","- C41 H32 Cl4 N4 O2 S -","- C41 H32 Cl4 N4 O2 S -","- C328 H256 Cl32 N32 O16 S8 -","8","1","HG6161","Hu, Xiao-Fen; Feng, Ya-Qing; Liu, Xin-Gang; Qiao, Kang-Jian","10''-(4-Chlorobenzylidene)-5''-(4-chlorophenyl)-4'-(2,4-dichlorophenyl)-1'-methyl-2,3,2'',3'',7'',8'',9'',10''-octahydro-1<i>H</i>,5''<i>H</i>,6''<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-cyclohepteno[1,2-<i>d</i>]thiazolo[3,2-<i>a</i>]pyrimidine-2,3''-dione","Acta Crystallographica Section E","2005","61","5","o1411","o1413","10.1107/S1600536805011621","","","0.71073","MoKα","","0.1156","0.0485","","","","0.1678","","","","","","1.004","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2205733","7.602","0.002","23.09","0.006","10.711","0.003","90","","92.05","0.02","90","","1878.9","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","10-(5-chloro-2-hydroxybenzylidene)anthrone acetonitrile solvate","","- C23 H16 Cl N O2 -","- C23 H16 Cl N O2 -","- C92 H64 Cl4 N4 O8 -","4","1","HG6163","Wei Zhou; Jie Yan; Wei-Xiao Hu; Chun-Nian Xia","10-(5-Chloro-2-hydroxybenzylidene)anthrone acetonitrile solvate","Acta Crystallographica Section E","2005","61","5","o1523","o1524","10.1107/S1600536805011955","","","0.71073","MoKα","","0.1998","0.0499","","","0.1141","0.1586","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205734","7.2253","0.0001","8.1217","0.0001","32.7768","0.0004","90","","90","","90","","1923.4","0.04","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H23 F O6 -","- C22 H23 F O6 -","- C88 H92 F4 O24 -","4","1","HG6164","Jian-Hua Zhong; Shan-Zhong Jian; Xue-Ying He; Yan-Guang Wang","(5α,8α,9β,11<i>S</i>)-5,7,8,9-Tetrahydro-11-(fluoromethyl)-9-(3,4,5-trimethoxyphenyl)-5,8-methano-1,3-dioxolo[4,5-<i>h</i>][2]benzoxepin","Acta Crystallographica Section E","2005","61","5","o1280","o1282","10.1107/S1600536805010366","","","0.71069","MoKα","","","0.05","","","","0.1428","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205735","8.759","0.002","10.488","0.003","12.08","0.003","90","","110.015","0.005","90","","1042.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Br N3 O -","- C9 H10 Br N3 O -","- C36 H40 Br4 N12 O4 -","4","1","HG6165","Xiang-Chao Zeng; Yu-Xia Li; Shi-Hai Xu; Po-Run Liu","<i>N</i>-Methyl-3-(4-bromo-1<i>H</i>-pyrrole-2-carbonyl)aminopropionitrile","Acta Crystallographica Section E","2005","61","5","o1291","o1293","10.1107/S160053680501038X","","","0.71073","MoKα","","0.0595","0.0431","","","0.11","0.1203","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205736","13.228","0.009","19.64","0.014","11.524","0.008","90","","114.024","0.011","90","","2735","3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","[4-(2,2-Diphenyl-vinyl)-phenyl]-diphenyl- amine. n-hexane(1/0.25)","","- C33.5 H28.5 N -","- C33.5 H28.5 N -","- C134 H114 N4 -","4","1","HG6166","Chu, Ji-Cheng; Li, Wei; Liu, Dong-Zhi; Cao, Xiao-Dan","[4-(2,2-Diphenylvinyl)phenyl]diphenylamine <i>n</i>-hexane 0.25 solvate","Acta Crystallographica Section E","2005","61","5","o1372","o1373","10.1107/S1600536805011177","","","0.71073","MoKα","","0.122","0.0687","","","0.2033","0.2434","","","","","","1.092","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205737","10.482","0.0011","13.1288","0.0015","10.0749","0.0011","90","","103.719","0.004","90","","1346.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(μ~4~-Disulfido-1:2κ^2^S;3:4κ^2^S')bis(μ~2~-ethylthiolato- κ^2^Fe,Fe')tetrakis[tricarbonyliron(II)(Fe—Fe)]","","- C16 H10 Fe4 O12 S4 -","- C16 H10 Fe4 O12 S4 -","- C32 H20 Fe8 O24 S8 -","2","0.5","HG6168","Cheng, Lan-Xia; Ma, Cheng-Bing; Hu, Ming-Qiang; Chen, Chang-Neng","(μ~4~-Disulfido-1:2κ^2^<i>S</i>,<i>S</i>;3:4κ^2^<i>S</i>',<i>S</i>')bis(μ~2~-ethylthiolato-κ^<i>2^</i><i>S</i>:<i>S</i>)tetrakis[tricarbonyliron(II)(Fe—Fe)]","Acta Crystallographica Section E","2005","61","5","m892","m894","10.1107/S1600536805011165","","","0.71073","MoKα","","","0.0402","","","0.0854","0.0935","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205738","9.735","0.0007","10.9349","0.001","13.0522","0.001","90","","103.544","0.006","90","","1350.78","0.19","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 Cl3 N2 -","- C13 H9 Cl3 N2 -","- C52 H36 Cl12 N8 -","4","1","HG6169","Ton, Quoc Coung; Bolte, Michael","A co-crystal of 1,10-phenanthroline and chloroform","Acta Crystallographica Section E","2005","61","5","o1406","o1407","10.1107/S1600536805011669","","","0.71073","MoKα","","0.0609","0.0445","","","0.1113","0.1194","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205739","10.662","0.002","18.315","0.004","7.6831","0.0015","90","","98.377","0.003","90","","1484.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6,7-dihydro-6-methyl-3-(methylthio)-1-p-tolylpyrano[4,3-c]pyrazol-4(1H)-one","","- C15 H16 N2 O2 S -","- C15 H16 N2 O2 S -","- C60 H64 N8 O8 S4 -","4","1","HG6170","Jing-Jun Hao; You-Ming Wang; Zheng-Ming Li; Hai-Bing Song","6,7-Dihydro-6-methyl-3-(methylsulfanyl)-1-(<i>p</i>-tolyl)pyrano[4,3-<i>c</i>]pyrazol-4(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","5","o1424","o1425","10.1107/S1600536805011931","","","0.71073","MoKα","","0.0639","0.0379","","","0.0943","0.1099","","","","","","0.983","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205740","8.2271","0.0007","9.4663","0.0008","9.5945","0.0009","97.559","0.007","90.415","0.007","90.238","0.007","740.7","0.11","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H38 Cu O14 S8 -","- C12 H38 Cu O14 S8 -","- C12 H38 Cu O14 S8 -","1","0.5","HG6171","Bieller, Susanne; Lerner, Hans-Wolfram; Bolte, Michael","Hexakis(dimethyl sulfoxide)copper(II) bis(hydrogen sulfate)","Acta Crystallographica Section E","2005","61","5","m928","m929","10.1107/S1600536805011670","","","0.71073","MoKα","","0.0233","0.0232","","","0.0581","0.0581","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205741","10.25","0.002","10.691","0.002","12.263","0.003","105.46","0.03","110.74","0.03","92.3","0.03","1197.7","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl 3-(dimethylamino)-2-(2-{1-[3-(2-methylphenyl)-1,2,4-oxadiazol -5-yl]-2-(dimethylamino)vinyloxyl}phenyl)acrylate","","- C25 H28 N4 O4 -","- C25 H28 N4 O4 -","- C50 H56 N8 O8 -","2","1","HG6172","Pu, Yue-Qing; Wang, Hai-Bo; Chen, Jia-Hui; Wang, Jin-Tang","Methyl 3-(dimethylamino)-2-(2-{2-(dimethylamino)-1-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]vinyloxy}phenyl)acrylate","Acta Crystallographica Section E","2005","61","5","o1426","o1428","10.1107/S160053680501189X","","","0.71073","MoKα","","0.1035","0.0596","","","0.1598","0.1929","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205742","12.371","0.002","8.6873","0.0016","9.9175","0.0018","90","","120.599","0.003","90","","917.4","0.3","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Bis(2-methylimidazol-1-yl)methane","","- C9 H12 N4 -","- C9 H12 N4 -","- C36 H48 N16 -","4","0.5","HK6004","Jin, Chuan-Ming; Gong, Chu-Ru","Bis(2-methylimidazol-1-yl)methane","Acta Crystallographica Section E","2005","61","5","o1494","o1495","10.1107/S160053680501247X","","","0.71073","MoKα","","0.0756","0.0681","","","0.1592","0.1686","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205743","11.583","0.001","11.583","0.001","10.747","0.001","90","","90","","90","","1441.9","0.2","289","2","289","2","","","","","","","","5","P 4/n n c :2","-P 4a 2bc","126","","Tetrakis(3,5-lutidine)dichloronickel(II)","","- C28 H36 Cl2 N4 Ni -","- C28 H36 Cl2 N4 Ni -","- C56 H72 Cl4 N8 Ni2 -","2","0.125","IS6061","Xiang-Sheng Xu; Ya-Ping Lü; Dong-Shun Deng; Mao-Lin Hu; Zhi-Min Jin","Tetrakis(3,5-lutidine)dichloronickel(II)","Acta Crystallographica Section E","2005","61","5","m889","m891","10.1107/S1600536805011141","","","0.71073","MoKα","","0.0497","0.0282","","","0.0697","0.075","","","","","","0.909","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205744","8.4152","0.0003","8.7177","0.0003","9.3451","0.0003","67.769","0.002","87.591","0.002","69.878","0.002","592.8","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H26 Cu2 N2 O6 -","- C24 H26 Cu2 N2 O6 -","- C24 H26 Cu2 N2 O6 -","1","0.5","IS6064","Overgaard, Jacob; Chevallier, Marie-Agnes; Iversen, Bo B.","Bis(μ-diacetylacetonato)bis[pyridinecopper(II)]","Acta Crystallographica Section E","2005","61","5","m922","m924","10.1107/S1600536805011360","","","0.71073","MoKα","","0.0475","0.0312","","","0.0771","0.08","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205745","7.3184","0.0004","9.8767","0.0006","12.5639","0.0007","76.6","0.003","88.384","0.003","79.414","0.003","868.28","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H34 Co2 N4 O16 -","- C34 H34 Co2 N4 O16 -","- C34 H34 Co2 N4 O16 -","1","0.5","IS6065","Dao-Yong Wang; Gang Liu; Bo Zheng; Jun Lu; Huai-Ming Hu","Bis[tetraaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)] 1,2,4,5-benzenetetracarboxylate","Acta Crystallographica Section E","2005","61","5","m925","m927","10.1107/S160053680501161X","","","0.71073","MoKα","","0.0442","0.0352","","","0.0831","0.0871","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205746","6.2548","0.0003","16.258","0.0004","11.46","0.0004","90","","91.601","0.001","90","","1164.92","0.07","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Pentaaqua(oxydiacetato-κ^3^O,O',O"")strontium(II) monohydrate","","- C4 H16 O11 Sr -","- C4 H16 O11 Sr -","- C16 H64 O44 Sr4 -","4","1","IS6068","Gaduo; Jian-Rong Su; Duan-Jun Xu","Pentaaqua(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')strontium(II) monohydrate","Acta Crystallographica Section E","2005","61","5","m950","m952","10.1107/S1600536805012201","","","0.71073","MoKα","","0.033","0.028","","","0.078","0.08","","","","","","1.251","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205747","26.552","0.007","7.3127","0.0019","15.933","0.004","90","","119.648","0.003","90","","2688.6","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Methoxy-4-[2-methyl-5-oxo-4,5-dihydro-1,3-oxazol-4-ylidene)methyl]phenyl acetate","","- C14 H13 N O5 -","- C14 H13 N O5 -","- C112 H104 N8 O40 -","8","1","JH6002","Xiangqian Wang; Mingjie Zhang; Zhaobin Qi; Shanshan Ma","2-Methoxy-4-[2-methyl-5-oxo-4,5-dihydro-1,3-oxazol-4-ylidene)methyl]phenyl acetate","Acta Crystallographica Section E","2005","61","5","o1265","o1266","10.1107/S1600536805010196","","","0.71073","MoKα","","0.1126","0.0433","","","0.1124","0.137","","","","","","0.969","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205748","13.616","0.002","5.9421","0.0009","12.7479","0.0019","90","","99.952","0.003","90","","1015.9","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-5-(2-phenyl-1,2,3-triazol-4-yl)-1,3,4-oxadiazole","","- C10 H8 N6 O -","- C10 H8 N6 O -","- C40 H32 N24 O4 -","4","1","KP6022","Fenhua Wang; Zhanglan Qin; Jiangsheng Huang","2-Amino-5-(2-phenyl-1,2,3-triazol-4-yl)-1,3,4-oxadiazole","Acta Crystallographica Section E","2005","61","5","o1343","o1344","10.1107/S1600536805010901","","","0.71073","MoKα","","0.0787","0.045","","","0.109","0.124","","","","","","0.948","","","","has coordinates,has Fobs","211413","2020-10-21","18:00:00",""
"2205749","9.6168","0.0013","9.7218","0.0013","10.7494","0.0015","64.237","0.002","71.31","0.002","80.941","0.002","857.2","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-phenyl-benzimidic acid 2-allyl-phenyl ester","","- C22 H19 N O -","- C22 H19 N O -","- C44 H38 N2 O2 -","2","1","KP6049","Guo, Yuping; Zhao, Bing; Li, Chunbao; Gao, Weimin; Li, Jie; Li, Yang","<i>N</i>-Phenylbenzimidic acid 2-allylphenyl ester","Acta Crystallographica Section E","2005","61","5","o1335","o1336","10.1107/S1600536805011104","","","0.71073","MoKα","","0.0571","0.0361","","","0.0922","0.1006","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205750","11.418","0.0007","13.9536","0.0008","3.8525","0.0002","90","","90","","90","","613.79","0.06","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","5-nitro-2-thiophenecarboxaldehyde","5-nitrothiophene-2-carbaldehyde","","- C5 H3 N O3 S -","- C5 H3 N O3 S -","- C20 H12 N4 O12 S4 -","4","1","LH6379","McBurney, Brian; Crundwell, Guy; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","5-Nitrothiophene-2-carbaldehyde","Acta Crystallographica Section E","2005","61","5","o1221","o1222","10.1107/S1600536805009979","","","0.71073","MoKα","","0.0273","0.0273","","","0.0748","0.0748","","","","","","1.179","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205751","7.671","0.002","16.268","0.005","10.884","0.003","90","","110.415","0.005","90","","1272.9","0.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 N3 O3 -","- C14 H13 N3 O3 -","- C56 H52 N12 O12 -","4","1","LH6389","Yu, Ming; Chen, Xin; Jing, Zuo-Liang","Isonicotinic acid (2-hydroxy-3-methoxybenzylidene)hydrazide","Acta Crystallographica Section E","2005","61","5","o1345","o1346","10.1107/S1600536805011025","","","0.71073","MoKα","","0.0845","0.0511","","","0.1024","0.1156","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205752","6.7867","0.0009","7.0884","0.0009","9.562","0.0013","107.597","0.002","101.854","0.002","97.474","0.002","419.92","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","(2E)-N,N'-bis(pyridin-4-ylmethyl)but-2-enediamide dihydrate","(2E)-N,N'-bis(pyridin-4-ylmethyl)but-2-enediamide dihydrate","","- C16 H20 N4 O4 -","- C16 H20 N4 O4 -","- C16 H20 N4 O4 -","1","0.5","LH6390","Gareth O. Lloyd","(2<i>E</i>)-<i>N,N</i>'-Bis(pyridin-4-ylmethyl)but-2-enediamide dihydrate","Acta Crystallographica Section E","2005","61","5","o1218","o1220","10.1107/S1600536805009980","","","0.71073","MoKα","","0.0423","0.0398","","","0.1087","0.1112","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205753","7.4","0.002","16.462","0.005","10.999","0.003","90","","98.558","0.004","90","","1325","0.6","298","2","298","2","","","","","","","","4","C 1 c 1","C -2yc","9","3-aceto-4-(4-hydroxyphenethylamino)-3-ene-butenone","3-Acetoxy-4-(4-hydroxyphenethylamino)but-3-en-1-one","","- C14 H17 N O3 -","- C14 H17 N O3 -","- C56 H68 N4 O12 -","4","1","LH6395","Zhang, Yong-Bin; Guo, Wei; Hao, Jun-Sheng; Li, Dong-Hong; Huang, Shu-Ping; Xia, Chi-Zhong","3-Acetoxy-4-(4-hydroxyphenethylamino)but-3-en-1-one","Acta Crystallographica Section E","2005","61","5","o1318","o1320","10.1107/S1600536805010706","","","0.71073","MoKα","","0.0508","0.0494","","","0.1115","0.1123","","","","","","1.203","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205754","8.2741","0.0002","13.1807","0.0005","5.7182","0.0003","90","","90","","90","","623.62","0.04","120","2","120","2","","","","","","","","5","P n a 21","P 2c -2n","33","2-Chloronicotinic acid","2-Chloropyridine-3-carboxylic acid","","- C6 H4 Cl N O2 -","- C6 H4 Cl N O2 -","- C24 H16 Cl4 N4 O8 -","4","1","LH6397","Souza, Marcus V. N. de; Wardell, Solange M. S. V.; Howie, R. Alan","2-Chloropyridine-3-carboxylic acid","Acta Crystallographica Section E","2005","61","5","o1347","o1349","10.1107/S160053680501024X","","","0.71073","MoKα","","0.0613","0.0545","","","0.1282","0.1329","","","","","","1.19","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205755","25.705","0.009","7.912","0.004","24.636","0.008","90","","112.742","0.008","90","","4621","3","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ^2^-Diphosphorus(P—P)-1:2κ^2^P,P;1:2κ^2^P',P' bis[η^5^-ethoxycarbonylcyclopentadienyl]- bis(carbonyl-1κC)bis(carbonyl-2κC)dimolybdenum(I)(Mo—Mo)]","","- C20 H18 Mo2 O8 P2 -","- C20 H18 Mo2 O8 P2 -","- C160 H144 Mo16 O64 P16 -","8","1","LH6398","Yao-Cheng Shi; Bei-Bei Zhu; Rong Guo","μ~2~-Diphosphorus(P—P)-1:2κ^2^<i>P</i>,<i>P</i>;1:2κ^2^<i>P</i>',<i>P</i>'-bis[η^5^-ethoxycarbonylcyclopentadienyl]-bis(carbonyl-1κ<i>C</i>)bis(carbonyl-2κ<i>C</i>)dimolybdenum(I)(Mo—Mo)]","Acta Crystallographica Section E","2005","61","5","m844","m845","10.1107/S1600536805010573","","","0.71073","MoKα","","0.0612","0.0352","","","0.0846","0.0918","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205756","5.276","0.002","9.307","0.004","24.841","0.007","90","","95.64","0.02","90","","1213.9","0.8","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Oxcarbazepine","10-oxo-10,11-dihydro-5H-dibenzo[b,f]azepine-5-carboxamide","","- C15 H12 N2 O2 -","- C15 H12 N2 O2 -","- C60 H48 N8 O8 -","4","1","LH6401","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Oxcarbazepine: structure and anticonvulsant activity","Acta Crystallographica Section E","2005","61","5","o1313","o1315","10.1107/S1600536805010676","","","1.54178","CuKα","","0.0466","0.0373","","","0.1167","0.1244","","","","","","0.813","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205757","10.2998","0.0002","18.5245","0.0003","21.966","0.0003","90","","94.118","0.001","90","","4180.26","0.12","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Bis[tris(3,5-dimethylpyrazolyl)methane]nickel(II)][tetrachloronickel(II)] methanol water solvate","","- C33 H50 Cl4 N12 Ni2 O2 -","- C33 H48 Cl4 N12 Ni2 O -","- C132 H192 Cl16 N48 Ni8 O4 -","4","1","LH6402","Annie Michaud; Frédéric-Georges Fontaine; Davit Zargarian","[Bis[tris(3,5-dimethylpyrazolyl)methane]nickel(II)][tetrachloronickelate(II)]‒methanol‒water (1/1/1)","Acta Crystallographica Section E","2005","61","5","m904","m906","10.1107/S1600536805011128","","","1.54178","CuKα","","0.0562","0.0509","","","0.1523","0.1561","","","","","","1.131","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205758","8.394","0.003","5.158","0.002","26.972","0.006","90","","101.47","0.02","90","","1144.5","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","felbamate","2-Phenyl-1,3-propanediol dicarbamate","","- C11 H14 N2 O4 -","- C11 H14 N2 O4 -","- C44 H56 N8 O16 -","4","1","LH6403","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","Felbamate: a carbamate-type anticonvulsant","Acta Crystallographica Section E","2005","61","5","o1381","o1383","10.1107/S1600536805011347","","","1.54178","CuKα","","0.046","0.0335","","","0.0887","0.0932","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205759","9.984","0.002","12.04","0.003","14.36","0.004","96.74","0.02","95.82","0.02","126.51","0.03","1345.8","0.8","294","2","294","2","","","","","","","","4","P -1","-P 1","2","methylfelbamate","2-Methyl-2-phenyl-1,3-propanediol dicarbamate","","- C12 H16 N2 O4 -","- C12 H16 N2 O4 -","- C48 H64 N8 O16 -","4","2","LH6404","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","Methylfelbamate","Acta Crystallographica Section E","2005","61","5","o1384","o1386","10.1107/S1600536805011335","","","1.54178","CuKα","","0.0659","0.0448","","","0.1047","0.111","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205760","18.2966","0.0005","5.06225","0.0001","15.7245","0.0004","90","","104.557","0.0015","90","","1409.68","0.06","295","","295","","","","","","","","","2","P 1 21 1","P 2yb","4","Dibenz[a,c]anthracene","1,2:5,6-Dibenzanthracene","","- C22 H14 -","- C22 H14 -","- C88 H56 -","4","2","LH6405","Fernandes, Philippe; Florence, Alastair; Shankland, Kenneth; David, Bill","Powder diffraction study of 1,2:3,4-dibenzanthracene","Acta Crystallographica Section E","2005","61","5","o1483","o1485","10.1107/S1600536805012171","","","1.54056","CuKα1","","","","","","","","","","1.64","","","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205761","11.597","0.003","14.213","0.003","7.827","0.002","90","","90.15","0.02","90","","1290.1","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Nafimidone monohydrate","2-(1H-imidazol-1-yl)-1-(2-naphthyl)ethanone monohydrate","","- C15 H14 N2 O2 -","- C15 H14 N2 O2 -","- C60 H56 N8 O8 -","4","1","LH6406","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Nafimidone monohydrate: an imidazole anticonvulsant","Acta Crystallographica Section E","2005","61","5","o1387","o1389","10.1107/S1600536805011487","","","1.54178","CuKα","","0.1044","0.055","","","0.1517","0.1743","","","","","","0.917","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205762","15.315","0.007","5.573","0.003","17.487","0.008","90","","99.863","0.009","90","","1470.5","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diphenylguanidinium-monohydrogen-oxalate (1/1)","","- C15 H15 N3 O4 -","- C15 H15 N3 O4 -","- C60 H60 N12 O16 -","4","1","LH6408","Mao-Lin Hu; Wei-Dong Wang","Diphenylguanidinium hydrogen oxalate","Acta Crystallographica Section E","2005","61","5","o1408","o1410","10.1107/S1600536805011591","","","0.71073","MoKα","","0.105","0.0877","","","0.1837","0.1988","","","","","","1.323","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205763","14.379","0.002","13.234","0.002","19.705","0.003","90","","104","0.03","90","","3638.3","1","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[aqua(2,2'-bipyridine-κ^2^N,N')manganese(II)]-μ- 4-carboxylatophenoxyacetato-κ^3^O,O':O'']","","- C19 H16 Mn N2 O6 -","- C19 H16 Mn N2 O6 -","- C152 H128 Mn8 N16 O48 -","8","1","LH6411","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Zhao, Hui","<i>catena</i>-Poly[[aqua(2,2'-bipyridine-κ^2^<i>N,N</i>')manganese(II)]-μ-4-carboxylatophenoxyacetato-κ^3^<i>O,O</i>':<i>O</i>'']","Acta Crystallographica Section E","2005","61","5","m989","m991","10.1107/S1600536805012584","","","0.71073","MoKα","","0.1334","0.0659","","","0.1303","0.146","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205764","11.6604","0.0015","8.0103","0.0011","8.9702","0.0016","90","","90","","90","","837.8","0.2","278","2","293","2","","","","","","","","4","P m m n :2","-P 2ab 2a","59","neodymium triiodide nonahydrate","neodymium triiodide nonahydrate","","- H18 I3 Nd O9 -","- I3 Nd O9 -","- I6 Nd2 O18 -","2","0.25","MG6032","Timofte, Tudor; Babai, Arash; Meyer, Gerd; Mudring, Anja","Neodymium triiodide nonahydrate","Acta Crystallographica Section E","2005","61","5","i87","i88","10.1107/S160053680501216X","","","0.71073","MoKα","","0.0652","0.0476","","","0.1312","0.1433","","","","","","1.021","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205765","12.791","0.002","6.4448","0.0016","12.068","0.003","90","","104.741","0.016","90","","962.1","0.4","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","","(R)-1-Phenyl-1-ethylammonium (R)-2-hydroxymethyl-2-(2-naphthyl)propanoate","","- C22 H25 N O3 -","- C22 H25 N O3 -","- C44 H50 N2 O6 -","2","1","NC6025","Ohba, Shigeru; Tsutsumi, Tomomi; Terao, Yosuke; Miyamoto, Kenji; Ohta, Hiromichi","(<i>R</i>)-1-Phenyl-1-ethylammonium (<i>R</i>)-2-hydroxymethyl-2-(2-naphthyl)propanoate","Acta Crystallographica Section E","2005","61","5","o1283","o1285","10.1107/S1600536805010305","","","0.71073","MoKα","","","0.0484","","","","0.1022","","","","","","0.973","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205766","15.142","0.001","11.6395","0.0008","11.2429","0.0014","90","","111.363","0.007","90","","1845.4","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,3-di(2-furyl)-2-propen-1-one","","- C11 H8 O3 -","- C11 H8 O3 -","- C88 H64 O24 -","8","2","NC6027","Ocak Ískeleli, Nazan; Işık, Şamil; Özdemir, Zuhal; Bilgin, Altan","(<i>E</i>)-1,3-Di(2-furyl)-2-propen-1-one","Acta Crystallographica Section E","2005","61","5","o1356","o1358","10.1107/S1600536805011244","","","0.71073","MoKα","","0.0486","0.0377","","","0.0899","0.0947","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205767","10.4667","0.0017","6.2976","0.0007","14.072","0.002","90","","103.738","0.019","90","","901","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","Hepta-ammonium bis(hydrogenphosphate) phosphate","heptaammonium bis(hydrogenphosphate) phosphate","","- H30 N7 O12 P3 -","- H30 N7 O12 P3 -","- H60 N14 O24 P6 -","2","1","NC6029","Nolte, Matthias; Pantenburg, Ingo; Meyer, Gerd","(NH~4~)~7~(HPO~4~)~2~(PO~4~), heptaammonium bis(hydrogenphosphate) phosphate","Acta Crystallographica Section E","2005","61","5","i84","i86","10.1107/S1600536805012018","","","0.71073","MoKα","","0.0392","0.0306","","","0.0713","0.0839","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205768","15.59","0.003","7.528","0.0015","15.755","0.003","90","","107.85","0.03","90","","1760","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-ferrocenyl-3-(2-hydroxymethylphenyl)aminobut-2-en-1-one","","- C21 H21 Fe N O2 -","- C21 H21 Fe N O2 -","- C84 H84 Fe4 N4 O8 -","4","1","NG6111","Yao-Cheng Shi","Hydrogen-bonded <i>R</i>~2~^2^(16) dimers in 1-ferrocenyl-3-(2-hydroxymethylphenyl)aminobut-2-en-1-one","Acta Crystallographica Section E","2005","61","5","m811","m812","10.1107/S1600536805009104","","","0.71073","MoKα","","0.1049","0.0564","","","0.1424","0.1766","","","","","","0.962","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205769","19.385","0.005","7.5134","0.0019","14.859","0.004","90","","126.487","0.003","90","","1740","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diiodidobis(4-methylpyridine N-oxide-?O)zinc(II)","","- C12 H14 I2 N2 O2 Zn -","- C12 H14 I2 N2 O2 Zn -","- C48 H56 I8 N8 O8 Zn4 -","4","0.5","NG6123","Shi, Jing-Min; Liu, Zhe; Lu, Jian-Jun; Liu, Lian-Dong","Diiodidobis(4-methylpyridine <i>N</i>-oxide-κO)zinc(II)","Acta Crystallographica Section E","2005","61","5","m856","m857","10.1107/S160053680501072X","","","0.71073","MoKα","","0.036","0.0301","","","0.0722","0.0747","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205770","8.1038","0.0007","21.675","0.001","12.6164","0.0009","90","","94.126","0.006","90","","2210.3","0.3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(1-Benzylimidazole)(chloro)bis(dimethylglyoximato)cobalt(III)","","- C18 H24 Cl Co N6 O4 -","- C18 H24 Cl Co N6 O4 -","- C72 H96 Cl4 Co4 N24 O16 -","4","1","NG6128","Shen, Xu-Jie; Pan, Qin-He; Xiao, Li-Ping; Xu, Ru-Ren","(1-Benzyl-1<i>H</i>-imidazole)chlorobis(dimethylglyoximato)cobalt(III)","Acta Crystallographica Section E","2005","61","5","m936","m938","10.1107/S1600536805011359","","","0.71073","MoKα","","0.082","0.0454","","","0.0997","0.1121","","","","","","0.92","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205771","14.748","0.005","14.748","","6.465","0.008","90","","90","","90","","1406.2","1.8","293","2","293","2","","","","","","","","4","I -4","I -4","82","","Tetrakis[4-(trifluoromethyl)phenyl]stannane","","- C28 H16 F12 Sn -","- C28 H16 F12 Sn -","- C56 H32 F24 Sn2 -","2","0.25","NG6134","Young, David J.; Manuaba, Putra; Healy, Peter C.; Tiekink, Edward R. T.","Tetrakis[4-(trifluoromethyl)phenyl]stannane","Acta Crystallographica Section E","2005","61","5","m956","m957","10.1107/S1600536805012213","","","0.71069","MoKα","","0.099","0.051","","","0.134","0.157","","","","","","0.98","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205772","7.2955","0.0005","8.3616","0.0006","11.93","0.0008","89.059","0.001","88.827","0.001","70.549","0.001","686.04","0.08","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Diaquadibenzimidazolebis(5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidine- 1-acetato)nickel(II)","","- C26 H24 F2 N8 Ni O10 -","- C26 H24 F2 N8 Ni O10 -","- C26 H24 F2 N8 Ni O10 -","1","0.5","NG6139","Mao-Lin Hu; Wei-Dong Wang","Diaquadibenzimidazolebis(5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-1-acetato)nickel(II)","Acta Crystallographica Section E","2005","61","5","m975","m977","10.1107/S1600536805012432","","","0.71073","MoKα","","0.0308","0.0291","","","0.073","0.0741","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205773","10.712","0.009","15.593","0.013","9.556","0.008","90","","90","","90","","1596","2","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","Potassium tris(2-aminoethanesulfonato-κ^2^<i>N</i>,<i>O</i>)nickelate(II)","","- C6 H18 K N3 Ni O9 S3 -","- C6 H18 K N3 Ni O9 S3 -","- C24 H72 K4 N12 Ni4 O36 S12 -","4","1","OB6493","Yi-Min Jiang; Jin-Hua Cai; Zhi-Min Liu","Potassium tris(2-aminoethanesulfonato-κ^2^<i>N</i>,<i>O</i>)nickelate(II)","Acta Crystallographica Section E","2005","61","5","m878","m880","10.1107/S1600536805010846","","","0.71073","MoKα","","0.046","0.041","","","0.082","0.085","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205774","17.822","0.004","9.536","0.002","21.256","0.005","90","","97.445","0.017","90","","3582","1.4","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Dibromotetra(3-tert-butylpyrazole-κN)nickel(II)","","- C28 H48 Br2 N8 Ni -","- C28 H48 Br2 N8 Ni -","- C112 H192 Br8 N32 Ni4 -","4","1","OB6496","Annie Michaud; Frédéric-Georges Fontaine; Davit Zargarian","<i>trans</i>-Dibromotetra(3-<i>tert</i>-butylpyrazole-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2005","61","5","m846","m848","10.1107/S1600536805010597","","","1.54178","CuKα","","0.0465","0.045","","","0.124","0.1254","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205775","11.8053","0.001","15.6404","0.0015","22.432","0.002","90","","90","","90","","4141.8","0.6","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","10-Amino-3,3,6,6-tetramethyl-9-(4-bromophenyl)-3,4,5,6,9,10-hexahydroacridine- 1,8(2H,7H)-dione","","- C23 H27 Br N2 O2 -","- C23 H27 Br N2 O2 -","- C184 H216 Br8 N16 O16 -","8","1","OB6497","Shu-Jiang Tu; Jin-Peng Zhang; Xiao-Tong Zhu; Jia-Ning Xu; Qian Wang","10-Amino-9-(4-bromophenyl)-3,3,6,6-tetramethyl-3,4,5,6,9,10-hexahydroacridine-1,8(2<i>H</i>,7<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","5","o1491","o1493","10.1107/S160053680501202X","","","0.7107","MoKα","","0.0473","0.0423","","","0.0993","0.1018","","","","","","1.163","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205776","6.1829","0.0008","7.0696","0.0008","7.3023","0.0006","70.443","0.008","80.153","0.008","63.973","0.01","270.16","0.06","295","2","295","2","","","","","","","","3","P -1","-P 1","2","triquinoyl octahydrate","Dodecahydroxycyclohexane dihydrate","","- C6 H16 O14 -","- C6 H16 O14 -","- C6 H16 O14 -","1","0.5","OB6498","Klapötke, Thomas M.; Polborn, Kurt; Weigand, Jan J.","Dodecahydroxycyclohexane dihydrate","Acta Crystallographica Section E","2005","61","5","o1393","o1395","10.1107/S1600536805010007","","","0.71073","MoKα","","0.0348","0.0328","","","0.0886","0.0908","","","","","","1.098","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205777","7.5031","0.0013","19.61","0.003","18.401","0.004","90","","99.894","0.007","90","","2667.2","0.8","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3,5-Trichloro-4-methoxy-6-[2,3,5-trichloro-4-methoxy-6- (2,3,5,6-tetrachloro-4-methoxyphenoxy)phenoxy]phenol","","- C21 H10 Cl10 O6 -","- C21 H10 Cl10 O6 -","- C84 H40 Cl40 O24 -","4","1","OB6499","Hashizume, Daisuke; Koshino, Hiroyuki; Lee, In-Kyoung; Yoo, Ick-Dong","2,3,5-Trichloro-4-methoxy-6-[2,3,5-trichloro-4-methoxy-6-(2,3,5,6-tetrachloro-4-methoxyphenoxy)phenoxy]phenol","Acta Crystallographica Section E","2005","61","5","o1367","o1369","10.1107/S1600536805011220","","","0.71073","MoKα","","0.046","0.0339","","","0.0741","0.0781","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205778","17.518","0.003","16.667","0.003","18.414","0.003","90","","113.25","0.01","90","","4939.8","1.5","93.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C94 H132 N2 O18 Zn3 -","- C94 H132 N2 O18 Zn3 -","- C188 H264 N4 O36 Zn6 -","2","0.5","OB6501","Mizuguchi, Jin; Makino, Takashi","Diacetonitrileheptakis[μ-3,5-bis(1,1-dimethylethyl)-2-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>']trizinc(II)","Acta Crystallographica Section E","2005","61","5","m953","m955","10.1107/S1600536805011980","","","1.5418","CuKα","","","0.0644","","","","0.1644","","","","","","1.032","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205779","8.171","0.002","8.774","0.002","16.385","0.004","93.826","0.006","94.393","0.006","98.725","0.006","1154","0.5","203.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C21 H15 Cl In N O6 W2 -","- C21 H15 Cl In N O6 W2 -","- C42 H30 Cl2 In2 N2 O12 W4 -","2","1","OB6502","Nakazawa, Hiroshi; Itazaki, Masumi; Owaribe, Mari","Chloropyridinebis[tricarbonyl(η^5^-cyclopentadienyl)tungstenio]indium","Acta Crystallographica Section E","2005","61","5","m945","m946","10.1107/S1600536805011992","","","0.7107","MoKα","","","0.0516","","","","0.0941","","","","","","1.052","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205780","8.511","0.0004","13.526","0.001","8.6612","0.0005","90","","114.119","0.005","90","","910.03","0.1","297.2","","24","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-chloro-3-nitrocoumarin","4-chloro-3-nitro-2H- chromen-2-one","","- C9 H4 Cl N O4 -","- C9 H4 Cl N O4 -","- C36 H16 Cl4 N4 O16 -","4","1","OB6503","Fujii, Isao; Mano, Yoshihiro; Hirayama, Noriaki","4-Chloro-3-nitrocoumarin: an unusual non-bonding C—Cl···O=C interaction","Acta Crystallographica Section E","2005","61","5","o1456","o1458","10.1107/S1600536805011943","","","1.5418","CuKα","","","0.0471","","","","0.1984","","","","","","1.206","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205781","8.2117","0.0006","8.2117","0.0006","27.44","0.003","90","","90","","90","","1850.3","0.3","293","2","293","2","","","","","","","","6","P 43","P 4cw","78","","1,3,3,5-tetramethyl-6'-chloro-8'-bromoSpiro[(2'H,1'- benzopyran)-2,2'-indolines]","","- C20 H19 Br Cl N O -","- C20 H19 Br Cl N O -","- C80 H76 Br4 Cl4 N4 O4 -","4","1","OB6504","Hui Guo; Yong-Bin Gao; Jie Han; Ji-Ben Meng","8-Bromo-6-chloro-1',3',3',5'-tetramethylspiro[2<i>H</i>-1-benzopyran-2,2'-indoline]","Acta Crystallographica Section E","2005","61","5","o1461","o1462","10.1107/S1600536805011864","","","0.71073","MoKα","","0.0413","0.029","","","0.0654","0.069","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205782","25.216","0.003","9.9757","0.0009","25.566","0.003","90","","108.566","0.003","90","","6096.4","1.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","diethyl cis-1,2,3,4,5,10-hexahydro-7,8-dimethyl-1,4-dioxo-2,3,4a,10a- tetraazabenzo[g]cyclopent[cd]azulene-2a,10b-dicarboxylate chloroform disolvate","","- C22 H26 Cl6 N4 O6 -","- C22 H26 Cl6 N4 O6 -","- C176 H208 Cl48 N32 O48 -","8","1","OB6507","Wei, Fa-Qian; Wu, An-Xin","Diethyl <i>cis</i>-1,2,3,4,5,10-hexahydro-7,8-dimethyl-1,4-dioxo-2,3,4a,10a-tetraazabenzo[<i>g</i>]cyclopent[<i>cd</i>]azulene-2a,10b-dicarboxylate chloroform disolvate","Acta Crystallographica Section E","2005","61","5","o1453","o1455","10.1107/S1600536805012183","","","0.71073","MoKα","","0.0947","0.0582","","","0.1126","0.1192","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205783","12.5448","0.0008","13.0525","0.0008","13.3493","0.0009","90","","102.731","0.001","90","","2132.1","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aquabis[2-(2-pyridyl)-1H-benzimidazolato]zinc(II)","","- C24 H18 N6 O Zn -","- C24 H18 N6 O Zn -","- C96 H72 N24 O4 Zn4 -","4","1","OB6509","Yang, Jian-Kui; Zeng, Ming-Hua; Ng, Seik Weng","Aquabis[2-(2-pyridyl)-1<i>H</i>-benzimidazolato]zinc(II)","Acta Crystallographica Section E","2005","61","5","m992","m993","10.1107/S1600536805012614","","","0.71073","MoKα","","0.064","0.048","","","0.121","0.131","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205784","6.625","0.001","8.525","0.001","9.821","0.002","92.62","0.01","103.42","0.01","96.89","0.01","534.07","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Disodium 3-oxobutane-2,2-diylbis(diazeniumdiolate) dihydrate","","- C4 H10 N4 Na2 O7 -","- C4 H10 N4 Na2 O7 -","- C8 H20 N8 Na4 O14 -","2","1","OM6232","Arulsamy, Navamoney; Bohle, D. Scott","Disodium 3-oxobutane-2,2-diylbis(diazeniumdiolate) dihydrate","Acta Crystallographica Section E","2005","61","5","m838","m840","10.1107/S1600536805009803","","","0.71073","MoKα","","0.0455","0.0434","","","0.1146","0.1169","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205785","13.682","0.0002","9.732","0.0001","17.1014","0.0002","90","","104.964","0.001","90","","2199.89","0.05","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Fe(TTP)(THF)~2~]","Difuran(5,10,15,20-tetra-p-tolylporphyrinato)iron(II)","","- C56 H52 Fe N4 O2 -","- C56 H52 Fe N4 O2 -","- C112 H104 Fe2 N8 O4 -","2","0.5","OM6233","Hu, Chuan-Jiang; Noll, Bruce C.; Scheidt, W. Robert.","High-spin [Fe(TTP)(THF)~2~]","Acta Crystallographica Section E","2005","61","5","m830","m831","10.1107/S1600536805009633","","","0.71073","MoKα","","0.046","0.0375","","","0.0947","0.102","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205786","14.433","0.002","7.6395","0.0008","18.089","0.002","90","","111.527","0.002","90","","1855.4","0.4","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[cis-diaqua(2,2'-bipyridine)zinc(II)]-μ-5-sulfonatosalicylato]","","- C17 H16 N2 O8 S Zn -","- C17 H16 N2 O8 S Zn -","- C68 H64 N8 O32 S4 Zn4 -","4","1","OM6234","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping","<i>catena</i>-Poly[[<i>cis</i>-diaqua(2,2'-bipyridine)zinc(II)]-μ-5-sulfonatosalicylato]","Acta Crystallographica Section E","2005","61","5","m804","m806","10.1107/S1600536805009645","","","0.71073","MoKα","","0.0319","0.0301","","","0.0815","0.0829","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205787","19.2667","0.0017","11.1275","0.001","6.6484","0.0006","90","","90","","90","","1425.4","0.2","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","(μ-Formato-κ^2^O:O')aquachloro(1,10-phenanthroline-κ^2^N,N')manganese(II) monohydrate","","- C13 H13 Cl Mn N2 O4 -","- C13 H13 Cl Mn N2 O4 -","- C52 H52 Cl4 Mn4 N8 O16 -","4","1","OM6236","Jing Xiong; Wei-Dong Wang; Hong-Ping Xiao; Mao-Lin Hu","(μ-Formato-κ^2^<i>O</i>:<i>O</i>')aquachloro(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II) monohydrate","Acta Crystallographica Section E","2005","61","5","m901","m903","10.1107/S1600536805011311","","","0.71073","MoKα","","0.0501","0.0457","","","0.0894","0.0913","","","","","","1.104","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205788","16.0767","0.0012","11.2793","0.001","8.9528","0.0005","90","","90","","90","","1623.4","0.2","150","2","150","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","N,N-Bis-(3-methylphenyl)-N-(4-methylphenyl)amine","","- C21 H21 N -","- C21 H21 N -","- C84 H84 N4 -","4","0.5","RN6045","Manifar, Touraj; Rohani, Sohrab; Jennings, Michael, C.","<i>N</i>,<i>N</i>-Bis-(3-methylphenyl)-<i>N</i>-(4-methylphenyl)amine","Acta Crystallographica Section E","2005","61","5","o1297","o1299","10.1107/S1600536805010457","","","0.71073","MoKα","","0.101","0.0583","","","0.1468","0.1696","","","","","","1.058","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205789","7.642","0.005","10.1","0.007","15.25","0.01","90","","101.275","0.008","90","","1154.3","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Amino-1-(1,5-dimethyl-1H-pyrazol-4-ylcarbonyl)-3-methylsulfanyl- 1H-1,2,4-triazole","","- C9 H12 N6 O S -","- C9 H12 N6 O S -","- C36 H48 N24 O4 S4 -","4","1","RZ6057","Li-Rong Wen; Ming Li; Zi-Qin Ke; Xiao Wang","5-Amino-1-(1,5-dimethyl-1<i>H</i>-pyrazol-4-ylcarbonyl)-3-methylsulfanyl-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","5","o1231","o1232","10.1107/S1600536805010019","","","0.71073","MoKα","","0.048","0.0427","","","0.1331","0.1383","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205790","5.7572","0.0014","11.545","0.003","14.778","0.004","78.575","0.004","81.022","0.003","81.362","0.004","943.7","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","2-(1H-Benzo-1,2,3-triazol-1-yl)-4,4-dimethyl-3-oxo-N-phenylpentanethioamide monohydrate","","- C19 H22 N4 O2 S -","- C19 H22 N4 O2 S -","- C38 H44 N8 O4 S2 -","2","1","RZ6062","Liangzhong Xu; Shuanghua Yang; Yongqi Qin; Yaxun Yang; Yongwei Huang","2-(1<i>H</i>-Benzo-1,2,3-triazol-1-yl)-4,4-dimethyl-3-oxo-<i>N</i>-phenylpentanethioamide monohydrate","Acta Crystallographica Section E","2005","61","5","o1267","o1268","10.1107/S1600536805010238","","","0.71073","MoKα","","0.107","0.0617","","","0.1417","0.1513","","","","","","0.797","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205791","4.9278","0.0006","12.6217","0.0014","19.601","0.002","90","","90","","90","","1219.1","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Ethyl 3-oxo-1,2-benzoisothiazoline-2-acetate 1,1-dioxide","","- C11 H11 N O5 S -","- C11 H11 N O5 S -","- C44 H44 N4 O20 S4 -","4","1","RZ6064","Xu, Liang-Zhong; Si, Guo-Dong; Li, Zai-Feng; Yang, Shuang-Hua; Li, Kai","Ethyl 3-oxo-1,2-benzisothiazoline-2-acetate 1,1-dioxide","Acta Crystallographica Section E","2005","61","5","o1329","o1330","10.1107/S1600536805010949","","","0.71073","MoKα","","0.0354","0.0291","","","0.0732","0.0754","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205792","8.363","0.007","6.898","0.006","11.524","0.01","90","","96.879","0.012","90","","660","1","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","4-Phenyl-5-(1',5'-dimethyl-4'-pyrazolyl)-1,2,4-triazol-3-thione","","- C13 H13 N5 S -","- C13 H13 N5 S -","- C26 H26 N10 S2 -","2","0.5","RZ6065","Wen, Li-Rong; Ke, Zi-Qin; Li, Ming; Guo, Wei-Si","3-(1,5-Dimethylpyrazol-4-yl)-4-phenyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","5","o1436","o1438","10.1107/S1600536805011748","","","0.71073","MoKα","","0.0509","0.0368","","","0.0922","0.1002","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205793","9.109","0.001","9.2626","0.001","9.7553","0.0011","103.411","0.002","102.791","0.002","107.081","0.002","727.28","0.14","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","4-(4-nitrophenyl)-2,3,3a,4,5,9b-hexahydro furo[3,2-c]quinoline","","- C17 H16 N2 O3 -","- C17 H16 N2 O3 -","- C34 H32 N4 O6 -","2","1","RZ6066","K. Ravikumar; B. Sridhar; M. Mahesh; V. V. Narayana Reddy","4-(4-Nitrophenyl)-2,3,3a,4,5,9b-hexahydrofuro[3,2-<i>c</i>]quinoline","Acta Crystallographica Section E","2005","61","5","o1419","o1421","10.1107/S160053680501175X","","","0.71073","MoKα","","0.0687","0.056","","","0.1514","0.1633","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205794","16.859","0.009","5.667","0.003","12.58","0.007","90","","90.685","0.009","90","","1201.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-2-(2-(propan-2-ylidene)hydrazono)-3-phenylthiazolidin-4-one","","- C12 H13 N3 O S -","- C12 H13 N3 O S -","- C48 H52 N12 O4 S4 -","4","1","RZ6067","Xu, Liang-Zhong; Li, Kai; Song, Hai-Bin; Huang, Yong-Wei; Zhou, Kai","(<i>Z</i>)-3-Phenyl-2-(propan-2-ylidenehydrazono)thiazolidin-4-one","Acta Crystallographica Section E","2005","61","5","o1417","o1418","10.1107/S1600536805011815","","","0.71073","MoKα","","0.1152","0.0511","","","0.1131","0.1323","","","","","","0.891","","","","has coordinates,has disorder,has Fobs","201973","2020-10-21","18:00:00",""
"2205795","5.1151","0.0009","9.579","0.0018","18.426","0.003","87.292","0.003","83.782","0.003","87.021","0.004","895.5","0.3","292","1","292","1","","","","","","","","6","P -1","-P 1","2","","N-[5-(1E)-Styryl-1,3,4-thiadiazol-2-yl]-4-Bromophenoxy-acetamide","","- C18 H14 Br N3 O2 S -","- C18 H14 Br N3 O2 S -","- C36 H28 Br2 N6 O4 S2 -","2","1","RZ6068","Song, Xinjian; Tan, Xiaohong; Meng, Xianggao; Wang, Yangang","2-(4-Bromophenoxy)-<i>N</i>-[5-(<i>E</i>)-styryl-1,3,4-thiadiazol-2-yl]acetamide","Acta Crystallographica Section E","2005","61","5","o1422","o1423","10.1107/S1600536805011803","","","0.71073","MoKα","","0.1493","0.0678","","","0.1318","0.1849","","","","","","0.972","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205796","12.01","0.002","10.401","0.001","16.988","0.002","90","","108.178","0.002","90","","2016.2","0.5","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-(But-3-enyl)pyridinium-2-carboxylate‒5-butylpyridine-2-carboxylic acid (1/1)","","- C20 H24 N2 O4 -","- C19.999 H24 N2 O4 -","- C79.996 H96 N8 O16 -","4","1","RZ6069","Wang, Jun; Li, Guang-Wei; Lin, Yong-Cheng; Zhou, Shi-Ning; Ng, Seik Weng","5-(But-3-enyl)pyridinium-2-carboxylate‒5-butylpyridine-2-carboxylic acid (1/1), a co-crystal from <i>Fusarium moniliforme</i>","Acta Crystallographica Section E","2005","61","5","o1515","o1516","10.1107/S1600536805012675","","","0.71073","MoKα","","0.118","0.063","","","0.181","0.229","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205797","8.5277","0.0008","14.2285","0.0013","11.5972","0.0011","90","","93.59","0.002","90","","1404.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(o-Methoxyphenyl)-1,3,4,4a,5,6,7,8a-octahydro-2H-pyrano[2,3-d]pyrimidin- 2-thione","","- C14 H18 N2 O2 S -","- C14 H18 N2 O2 S -","- C56 H72 N8 O8 S4 -","4","1","SG6001","Lei Yan; Yu-Lin Zhu; Yuan-Jiang Pan","4-(<i>o</i>-Methoxyphenyl)-1,3,4,4a,5,6,7,8a-octahydro-2<i>H</i>-pyrano[2,3-<i>d</i>]pyrimidine-2-thione","Acta Crystallographica Section E","2005","61","5","o1228","o1230","10.1107/S1600536805010068","","","0.71073","MoKα","","0.0378","0.0303","","","0.0901","0.0931","","","","","","1.123","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205798","12.6304","0.0013","50.875","0.007","11.017","0.003","90","","112.5","0.01","90","","6540","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-[4-methylpiperdinemethyl]-2-[4-bromophenyl]- 6-methyl-8-trifluromethylimidazo[1,2-a][1,8]naphthyridinium picrate","","- C31 H27 Br F3 N7 O7 -","- C31 H27 Br F3 N7 O7 -","- C248 H216 Br8 F24 N56 O56 -","8","2","SG6002","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Krishnan SethuSankar; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar","1-(4-Methylpiperdinemethyl)-2-(4-bromophenyl)-6-methyl-8-trifluoromethylimidazo[1,2-<i>a</i>][1,8]naphthyridinium picrate","Acta Crystallographica Section E","2005","61","5","o1377","o1380","10.1107/S160053680501144X","","","1.54178","CuKα","","0.1594","0.0811","","","0.1918","0.2568","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205799","7.7118","0.0004","9.1503","0.0004","11.6969","0.0006","100.192","0.003","95.379","0.002","101.908","0.003","787.58","0.07","123","2","123","2","","","","","","","","4","P -1","-P 1","2","carbamazepine N,N-dimethylformamide solvate","carbamazepine N,N-dimethylformamide solvate","","- C18 H19 N3 O2 -","- C18 H19 N3 O2 -","- C36 H38 N6 O4 -","2","1","SG6004","Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","Carbamazepine <i>N,N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2005","61","5","o1509","o1511","10.1107/S1600536805012535","","","0.71073","MoKα","","0.0781","0.0477","","","0.1029","0.1167","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205800","11.887","0.002","11.775","0.002","19.293","0.003","90","","92.171","0.002","90","","2698.5","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H52 Cl4 N4 O10 Sn2 -","- C52 H52 Cl4 N4 O10 Sn2 -","- C104 H104 Cl8 N8 O20 Sn4 -","2","0.5","SG6005","Min Hong; Handong Yin; Daqi Wang; Gang Li","Bis(3-chlorobenzyl)tin(IV) ester of pyruvic acid 4-hydroxybenzoylhydrazone","Acta Crystallographica Section E","2005","61","5","m1006","m1008","10.1107/S1600536805012663","","","0.71073","MoKα","","0.043","0.0295","","","0.0718","0.0825","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205801","6.692","0.0013","7.647","0.0015","12.997","0.003","83.72","0.03","77.11","0.03","80.69","0.03","637.9","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Bis(3-nitrobenzoato)bis(3-pyridylmethanol-N,O)copper(II) complex","","- C26 H22 Cu N4 O10 -","- C26 H22 Cu N4 O10 -","- C26 H22 Cu N4 O10 -","1","0.5","SJ6056","Petra Stachová; Dušan Valigura; Marian Koman; Glowiak Tadeus","<i>catena</i>-Poly[[bis(2-nitrobenzoato-κ<i>O</i>)copper(II)]di-μ-3-pyridylmethanol-κ^2^<i>N</i>,<i>O</i>;κ^2^<i>O</i>:<i>N</i>]","Acta Crystallographica Section E","2005","61","5","m994","m996","10.1107/S1600536805011608","","","0.71073","MoKα","","0.0259","0.0247","","0.0656","","0.0649","","","1.086","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205802","7.726","0.0003","11.7276","0.0005","14.6536","0.0008","90","","90","","90","","1327.73","0.11","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-(5-Indanyloxy)phthalonitrile","","- C17 H12 N2 O -","- C17 H12 N2 O -","- C68 H48 N8 O4 -","4","1","SJ6060","Yazıcı, Serap; Akdemir, Nesuhi; Aǧar, Erbil; Özil, Musa; Şenel, İsmet","4-(5-Indanyloxy)phthalonitrile","Acta Crystallographica Section E","2005","61","5","o1304","o1305","10.1107/S1600536805010330","","","0.71073","MoKα","","0.0385","0.0345","","","0.0861","0.0878","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205803","8.37","0.002","11.847","0.003","14.825","0.004","90","","93.096","0.005","90","","1467.9","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Oxocrebanine","8H-Benzo[g][1,3]benzodioxolo[6,5,4-de]quinolin-8-one","","- C19 H13 N O5 -","- C19 H13 N O5 -","- C76 H52 N4 O20 -","4","1","SJ6062","Din, Laily Bin; Abdullah, Aryanti; Yamin, Bohari M.","8<i>H</i>-Benzo[<i>g</i>][1,3]benzodioxolo[6,5,4-<i>de</i>]quinolin-8-one (oxocrebanine)","Acta Crystallographica Section E","2005","61","5","o1450","o1452","10.1107/S1600536805012195","","","0.71073","MoKα","","0.0691","0.0507","","","0.1321","0.1436","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205804","11.6831","0.0013","11.8477","0.0013","12.9212","0.0014","111.911","0.002","111.296","0.002","92.437","0.002","1512.9","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","(E)-1-(2-hydroxy-3,4-dimethoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one","","- C17 H16 O5 -","- C17 H16 O5 -","- C68 H64 O20 -","4","2","SJ6064","J. Radha Krishna; N. Jagadeesh Kumar; M. Krishnaiah; C. Venkata Rao; Y. Koteswara Rao; Vedavati G. Puranik","(<i>E</i>)-1-(2-Hydroxy-3,4-dimethoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","5","o1323","o1325","10.1107/S1600536805010731","","","0.71073","MoKα","","0.047","0.0427","","","0.1131","0.1178","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205805","10.5756","0.0006","10.5907","0.0006","14.4795","0.0008","90","","107.548","0.001","90","","1546.28","0.15","293","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H14 O4 -","- C21 H14 O4 -","- C84 H56 O16 -","4","1","SJ6065","Zhi-Peng Chen; Duan-Ming Tan; Cheng-Yong Su; Zun-Le Xu","2,3-Epoxy-13c-methoxy-1,13c-dihydrodibenzo[<i>a</i>,<i>kl</i>]xanthan-1-one","Acta Crystallographica Section E","2005","61","5","o1308","o1309","10.1107/S1600536805010378","","","0.71073","MoKα","","","0.0443","","","","0.1368","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205806","5.207","0.0005","14.0918","0.0018","18.1737","0.0018","90","","90","","90","","1333.5","0.3","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-2-methoxy-6-[(2-trifluoromethylphenylimino)methyl]phenol","","- C15 H12 F3 N O2 -","- C15 H12 F3 N O2 -","- C60 H48 F12 N4 O8 -","4","1","SJ6066","Şahin, Onur; Büyükgüngör, Orhan; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa","(<i>E</i>)-2-Methoxy-6-[(2-trifluoromethylphenylimino)methyl]phenol","Acta Crystallographica Section E","2005","61","5","o1288","o1290","10.1107/S1600536805010342","","","0.71073","MoKα","","0.0779","0.0537","","","0.1146","0.1231","","","","","","0.891","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205807","14.5546","0.0006","11.5095","0.0004","13.9115","0.0006","90","","90.487","0.002","90","","2330.32","0.16","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 Cu N2 O14 -","- C22 H18 Cu N2 O14 -","- C88 H72 Cu4 N8 O56 -","4","0.5","SJ6068","Lei Wang; Dong-Hui Zhou; Jing-Ping Zhang","<i>catena</i>-Poly[[[bis(2-pyridinecarboxylato-κ^2^<i>N</i>,<i>O</i>)copper(II)]-μ-benzene-1,2,4,5-tetracarboxylic acid] dihydrate]","Acta Crystallographica Section E","2005","61","5","m958","m960","10.1107/S1600536805011979","","","0.71073","MoKα","","0.0369","0.0274","","","0.0699","0.0722","","","","","","0.951","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205808","7.4713","0.0012","7.7792","0.0007","13.3329","0.0012","85.785","0.006","86.057","0.009","82.954","0.009","765.59","0.16","296","2","296","1","","","","","","","","5","P -1","-P 1","2","","Dichlorobis(1H-benzimidazole-κN^3^)cobalt(II)","","- C14 H12 Cl2 Co N4 -","- C14 H12 Cl2 Co N4 -","- C28 H24 Cl4 Co2 N8 -","2","1","SJ6069","Yoe-Reyes, Francisco-Javier; Bernès, Sylvain; Barba-Behrens, Noráh","Dichlorobis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cobalt(II)","Acta Crystallographica Section E","2005","61","5","m875","m877","10.1107/S1600536805010718","","","0.71073","MoKα","","0.0467","0.0366","","","0.0917","0.0971","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205809","6.9836","0.0014","15.597","0.003","17.506","0.004","90","","90","","90","","1906.8","0.7","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Catena-poly[aqua(2,2'-bipyridine)copper(II)-μ-benzene-1,4-dioxyacetato]","","- C20 H18 Cu N2 O7 -","- C20 H18 Cu N2 O7 -","- C80 H72 Cu4 N8 O28 -","4","1","SJ6070","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Zhao, Hui","Catena-poly[aqua(2,2'-bipyridine)copper(II)-μ-benzene-1,4-dioxyacetato]","Acta Crystallographica Section E","2005","61","5","m895","m897","10.1107/S1600536805011372","","","0.71073","MoKα","","0.098","0.058","","","0.078","0.086","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205810","7.368","0.013","8.368","0.014","12.07","0.02","88.59","0.03","88.38","0.03","69.92","0.03","699","2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(aqua)bis(benzimidazole-κN)bis(5-fluorouracil-1-acetate-κO)cobalt(II)","","- C26 H24 Co F2 N8 O10 -","- C26 H24 Co F2 N8 O10 -","- C26 H24 Co F2 N8 O10 -","1","0.5","SJ6071","Mao-Lin Hu; Nan-Wen Zhu; Hong-Ping Xiao","Bis(aqua)bis(benzimidazole-κ<i>N</i>)bis(5-fluorouracil-1-acetate-κ<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2005","61","5","m898","m900","10.1107/S1600536805011323","","","0.71073","MoKα","","0.0585","0.0538","","","0.1378","0.1423","","","","","","1.062","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205811","12.686","0.002","8.588","0.001","15.422","0.003","90","","108","0.01","90","","1598","0.5","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 O5 -","- C18 H18 O5 -","- C72 H72 O20 -","4","1","SJ6072","Wu, Hui; Xu, Zhou; Liang, Yong-Min","(<i>E</i>)-1-(2-Hydroxyphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","5","o1434","o1435","10.1107/S1600536805011761","","","0.71073","MoKα","","0.1623","0.0398","","","0.0289","0.0354","","","","","","0.799","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205812","21.474","0.011","11.008","0.006","16.044","0.008","90","","90","","90","","3793","3","358","2","85","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","Bis[2,4-bis(2-pyridyl-κN)-6-(4-pyridyl)-1,3,5-triazine-κN^3^]ruthenium(II) bis(hexafluorophosphate)","","- C36 H24 F12 N12 P2 Ru -","- C36 H24 F12 N12 P2 Ru -","- C144 H96 F48 N48 P8 Ru4 -","4","0.5","SJ6074","Hartshorn, Richard M.; Zibaseresht, Ramin; Robinson, Ward T.","Bis[2,4-bis(2-pyridyl-κ<i>N</i>)-6-(4-pyridyl)-1,3,5-triazine-κ<i>N</i>^3^]ruthenium(II) bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","5","m981","m983","10.1107/S1600536805012420","","","0.71073","MoKα","","0.0797","0.0584","","","0.1295","0.1373","","","","","","1.156","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205813","41.91","0.02","3.952","0.003","28.84","0.013","90","","126.87","0.04","90","","3821","4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[Pyridine (2‒aniline‒N‒[‒(2‒oxyphenyl)methylene]‒2‒oxoethanehydrazonethionic acid)Ni(II)]","","- C20 H16 N4 Ni O2 S -","- C20 H16 N4 Ni O2 S -","- C160 H128 N32 Ni8 O16 S8 -","8","1","SU6171","Vladimir N. Yarovenko; Alexander V. Shirokov; Pavel A. Kondrashev; Victor B. Rybakov; Igor V. Zavarzin; Mikhail M. Krayushkin","{<i>N</i>-Anilino-2-[(2-oxidophenyl)methylenehydrazono]-2-sulfidoacetamide}pyridinenickel(II)","Acta Crystallographica Section E","2005","61","5","m964","m966","10.1107/S1600536805012134","","","0.71073","MoKα","","0.1081","0.0444","","","0.0673","0.0845","","","","","","0.968","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205814","5.18","0.0004","16.56","0.0014","10.2271","0.0008","90","","104.02","0.006","90","","851.16","0.12","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Acetyl-3-amino-1-benzofuran","","- C10 H9 N O2 -","- C10 H9 N O2 -","- C40 H36 N4 O8 -","4","1","SU6184","Ocak Ískeleli, Nazan; Kazak, Canan; Kırılmış, Cumhur; Koca, Murat","2-Acetyl-3-amino-1-benzofuran","Acta Crystallographica Section E","2005","61","5","o1212","o1213","10.1107/S1600536805009712","","","0.71073","MoKα","","0.0497","0.0353","","","0.0987","0.1028","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205815","8.8508","0.001","10.7516","0.0012","12.7592","0.0015","114.218","0.002","95.77","0.002","94.022","0.002","1093.4","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aquachloro[5-hydroxyisophthalato(1-)](1,10-phenanthroline)copper(II) 2.5-hydrate","","- C20 H20 Cl Cu N2 O8.5 -","- C20 H20 Cl Cu N2 O8.5 -","- C40 H40 Cl2 Cu2 N4 O17 -","2","1","SU6185","Hong-Ping Xiao; Wei-Dong Wang; Wei-Bing Zhang; Jia-Guo Wang","Aquachloro[5-hydroxyisophthalato(1{-})](1,10-phenanthroline)copper(II) 2.5-hydrate","Acta Crystallographica Section E","2005","61","5","m841","m843","10.1107/S1600536805009724","","","0.71073","MoKα","","0.0562","0.05","","","0.152","0.1557","","","","","","1.132","","","","has coordinates,has Fobs","199607","2020-10-21","18:00:00",""
"2205816","9.807","0.007","9.193","0.006","26.607","0.017","90","","90","","90","","2399","3","292","2","292","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-chloro-4,4'-dimethoxybiphenyl","","- C14 H13 Cl O2 -","- C14 H13 Cl O2 -","- C112 H104 Cl8 O16 -","8","1","TK6213","Ting-Feng, Tan; Jian-Xin, Zhang; Ji-Ben, Meng","An asymmetric biphenyl compound: 3-chloro-4,4'-dimethoxybiphenyl","Acta Crystallographica Section E","2005","61","5","o1210","o1211","10.1107/S1600536805009323","","","0.71073","MoKα","","0.114","0.063","","","0.109","0.131","","","","","","1.07","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205817","11.586","0.0012","11.82","0.0011","12.652","0.0013","96.5","0.003","107.03","0.002","101.69","0.004","1594.5","0.3","299","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C52 H78 N8 Ni3 O14 -","- C52 H78 N8 Ni3 O14 -","- C52 H78 N8 Ni3 O14 -","1","0.5","TK6216","Arıcı, Cengiz; Yüzer, Devrim; Atakol, Orhan; Fuess, Hartmut; Svoboda, Ingrid","A linear homotrinuclear nickel(II) complex with a reduced ONNO-type Schiff base","Acta Crystallographica Section E","2005","61","5","m919","m921","10.1107/S1600536805011396","","","0.71073","MoKα","","","0.05","","","","0.129","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205818","9.4122","0.0001","12.1852","0.0002","17.5851","0.0002","90","","105.44","0.0006","90","","1944.04","0.04","293","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tetrakis(μ-6-ammoniohexanoato-1kO:2κO')bis[chlorocopper(II)] dichloride tetrahydrate","","- C24 H60 Cl4 Cu2 N4 O12 -","- C24 H60 Cl4 Cu2 N4 O12 -","- C48 H120 Cl8 Cu4 N8 O24 -","2","0.5","TK6218","Lah, Nina; Leban, Ivan","Tetrakis(μ-6-ammoniohexanoato-1κ<i>O</i>:2κ<i>O</i>')bis[chlorocopper(II)] dichloride tetrahydrate","Acta Crystallographica Section E","2005","61","5","m835","m837","10.1107/S1600536805009992","","","0.71073","MoKα","","0.066","0.036","","","0.074","0.083","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205819","13.3335","0.0009","12.1528","0.0008","9.621","0.0006","90","","90","","90","","1558.98","0.18","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H28 Cl N O4 -","- C12 H28 Cl N O4 -","- C48 H112 Cl4 N4 O16 -","4","1","TK6220","Fujihara, Takashi; Kato, Masaru; Nagasawa, Akira","Tetra-<i>n</i>-propylammonium perchlorate","Acta Crystallographica Section E","2005","61","5","o1439","o1440","10.1107/S1600536805012006","","","0.71073","MoKα","","0.067","0.049","","","0.102","0.108","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205820","8.7325","0.0011","9.0677","0.0012","13.6287","0.0017","98.41","0.002","108.229","0.002","102.689","0.002","972.7","0.2","292","2","292","2","","","","","","","","3","P -1","-P 1","2","","Methyl 1-hydroxy-2-naphthoate","","- C12 H10 O3 -","- C12 H10 O3 -","- C48 H40 O12 -","4","2","TK6222","Jin, Long-Fei; Xiao, Feng-Ping","Methyl 1-hydroxy-2-naphthoate","Acta Crystallographica Section E","2005","61","5","o1520","o1522","10.1107/S1600536805012626","","","0.71073","MoKα","","0.106","0.068","","","0.179","0.216","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205821","10.236","0.002","12.937","0.002","13.614","0.002","62.419","0.002","88.218","0.002","84.286","0.002","1589.8","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Carbamazepine‒2,2,2-trifluoroethanol (1/1)","5H-dibenzo[b,f]azepine-5-carboxamide‒2,2,2-trifluoroethanol (1/1)","","- C17 H15 F3 N2 O2 -","- C17 H15 F3 N2 O2 -","- C68 H60 F12 N8 O8 -","4","2","WK6047","Lohani, Sachin; Zhang, Yuegang; Chyall, Leonard J.; Mougin-Andres, Patricia; Muller, Francis X.; Grant, David J. W.","Carbamazepine‒2,2,2-trifluoroethanol (1/1)","Acta Crystallographica, Section E","2005","61","5","o1312","o1310","10.1107/S1600536805010299","","","0.71073","MoKα","","0.0682","0.0464","","","0.1217","0.1403","","","","","","1.052","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2205822","9.9708","0.0005","13.0403","0.0007","19.3556","0.001","103.383","0.001","99.003","0.001","98.203","0.001","2375.9","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","μ-oxalato-1κ^2^O,O':2κ^2^O'',O'''tetrakis(phenylpyridine-κ^2^C,N)\- diiridium(III) acetone 1.974 solvate","","- C51.92 H43.85 Ir2 N4 O5.97 -","- C51.922 H43.844 Ir2 N4 O5.974 -","- C103.844 H87.688 Ir4 N8 O11.948 -","2","1","WM6056","DeRosa, Maria C.; Enright, Gary D.; Evans, Christopher E. B.; Crutchley, Robert J.","The photodecomposition product μ-oxalato-1κ^2^<i>O</i>,<i>O</i>':2κ^2^<i>O</i>'',<i>O</i>'''-bis{bis[2-(2-pyridyl)phenyl-κ^2^<i>C</i>,<i>N</i>]iridium(III)}‒acetone (1/1.974)","Acta Crystallographica Section E","2005","61","5","m967","m969","10.1107/S1600536805008809","","","0.71073","MoKα","","0.0628","0.0397","","","0.087","0.098","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205823","14.394","0.003","8.0685","0.0018","20.505","0.005","90","","90.53","0.004","90","","2381.3","0.9","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Ammonium antimony iodide","Triammonium nonaiododiantimonate(III)","","- H12 I9 N3 Sb2 -","- I9 N3 Sb2 -","- I36 N12 Sb8 -","4","1","WM6059","Zhang, Hui; Fang, Liang; Yuan, Run-Zhang","Triammonium nonaiododiantimonate(III), (NH~4~)~3~[Sb~2~I~9~]","Acta Crystallographica Section E","2005","61","5","i70","i72","10.1107/S1600536805011098","","","0.71073","MoKα","","0.0735","0.0406","","","0.0787","0.0892","","","","","","1.009","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205824","10.188","0.002","10.188","0.002","10.188","0.002","90","","90","","90","","1057.5","0.4","295","2","295","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","Ammonium manganese sulfate","Diammonium dimanganese(II) trissulfate(IV)","","- H8 Mn2 N2 O12 S3 -","- H8 Mn2 N2 O12 S3 -","- H32 Mn8 N8 O48 S12 -","4","0.333333","WM6061","Zhang, Xian-Ming; Hao, Zheng-Ming; Ng, Seik Weng","Langbeinite-type (NH~4~)~2~Mn~2~(SO~4~)~3~","Acta Crystallographica, Section E","2005","61","5","i82","i83","10.1107/S1600536805011736","","","0.71073","MoKα","","0.035","0.03","","","0.069","0.071","","","","","","1.05","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2205825","7.868","0.005","15.258","0.007","8.052","0.006","90","","90","","90","","966.6","1","120","2","120","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Ce20 Au1.72 Ge14.28","Pentacerium gold tetragermanium","","- Au0.43 Ce5 Ge3.58 -","- Au0.429 Ce5 Ge3.571 -","- Au1.716 Ce20 Ge14.284 -","4","0.5","WM6062","Bobev, Svilen; Bauer, Eric D.","Ce~5~Au~<i>x~</i>Ge~4{-~<i>x</i>} [<i>x</i> = 0.43(2)] with the orthorhombic Sm~5~Ge~4~ structure type","Acta Crystallographica Section E","2005","61","5","i73","i75","10.1107/S160053680501113X","","","0.71073","MoKα","","0.0317","0.0282","","","0.0545","0.0555","","","","","","1.101","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205826","8.1395","0.0009","6.9394","0.0008","6.6014","0.0007","90","","90","","90","","372.87","0.07","293","2","293","2","","","","","","","","4","P m n 21","P 2ac -2","31","silver cadmium gallium sulfide","silver dicadmium(II) gallium tetrasulfide","","- Ag Cd2 Ga S4 -","- Ag Cd2 Ga S4 -","- Ag2 Cd4 Ga2 S8 -","2","0.5","WM6063","Pervukhina, Natalie V.; Atuchin, Viktor V.; Parasyuk, Oleg V.","Redetermination of the quaternary phase silver dicadmium gallium tetrasulfide, AgCd~2~GaS~4~","Acta Crystallographica Section E","2005","61","5","i91","i93","10.1107/S1600536805012341","","","0.71073","MoKα","","0.0472","0.0376","","","0.108","0.1133","","","","","","1.077","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205827","6.7964","0.0003","6.7964","0.0003","24.7282","0.0014","90","","90","","90","","1142.22","0.1","153","2","153","2","","","","","","","","3","P 41","P 4w","76","Cerium disilicate","Dicerium disilicate","","- Ce4 O14 Si4 -","- Ce4 O14 Si4 -","- Ce16 O56 Si16 -","4","1","WM6067","Bin Deng; James A. Ibers","Dicerium disilicate, Ce~2~[Si~2~O~7~]","Acta Crystallographica Section E","2005","61","5","i76","i78","10.1107/S1600536805011049","","","0.71073","MoKα","","0.0258","0.0243","","","0.0548","0.0554","","","","","","1.153","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205828","10.1565","0.0011","18.879","0.002","14.2904","0.0015","90","","107.548","0.002","90","","2612.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-Ethyl 3-(4-methoxyphenyl)-2-[(triphenylphosphoranylidene)amino]prop- 2-enoate","","- C30 H28 N O3 P -","- C30 H28 N O3 P -","- C120 H112 N4 O12 P4 -","4","1","WN6341","Ding, Jin-Chang; Huang, Xiao-Bo; Wu, Hua-Yue; Liu, Miao-Chang; Hu, Mao-Lin","(<i>Z</i>)-Ethyl 3-(4-methoxyphenyl)-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","Acta Crystallographica Section E","2005","61","5","o1259","o1260","10.1107/S1600536805010275","","","0.71073","MoKα","","0.0858","0.0661","","","0.1427","0.153","","","","","","1.119","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205829","14.158","0.009","11.075","0.007","17.877","0.001","90","","108.776","0.001","90","","2654","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-morpholinyl{2-[1-(2-pyridinyl)ethylidene]diazan-2-iumylidene}methanethiolate","4-morpholinyl{2-[1-(2-pyridinyl)ethylidene]diazan-2-iumylidene}methanethiolate","","- C12 H16 N4 O S -","- C12 H16 N4 O S -","- C96 H128 N32 O8 S8 -","8","2","WN6344","Hoong-Kun Fun; Suchada Chantrapromma; V. Suni; A. Sreekanth; S. Sivakumar; M. R. Prathapachandra Kurup","4-Morpholinyl{2-[1-(2-pyridinyl)ethylidene]diazan-2-iumylidene}methanethiolate","Acta Crystallographica Section E","2005","61","5","o1337","o1339","10.1107/S1600536805010974","","","0.71073","MoKα","","0.0658","0.0442","","","0.1091","0.1249","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205830","19.7026","0.0015","11.2427","0.0008","12.2043","0.0009","90","","124.45","0.001","90","","2229.3","0.3","283","2","283","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 4,6-dichlorochroman-2-carboxylate","","- C11 H10 Cl2 O3 -","- C11 H10 Cl2 O3 -","- C88 H80 Cl16 O24 -","8","1","WN6345","Wei Huang; Zhongzhen Zhou; Peiliang Zhao; Qiong Chen; Deyou Teng; Guangfu Yang","Methyl 4,6-dichlorochroman-2-carboxylate","Acta Crystallographica Section E","2005","61","5","o1273","o1275","10.1107/S1600536805010421","","","0.71073","MoKα","","0.0358","0.0328","","","0.0888","0.0915","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205831","9.3158","0.0013","6.4393","0.0009","17.399","0.002","90","","92.022","0.002","90","","1043.1","0.2","283","2","283","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2,4-Dihydroxyphenyl)-N,N-dimethyl-2-oxoacetamide","","- C10 H11 N O4 -","- C10 H11 N O4 -","- C40 H44 N4 O16 -","4","1","WN6346","Wei Huang; Peiliang Zhao; Zhongzhen Zhou; Qiong Chen; Deyou Teng; Guangfu Yang","2-(2,4-Dihydroxyphenyl)-<i>N,N</i>-dimethyl-2-oxoacetamide","Acta Crystallographica Section E","2005","61","5","o1505","o1506","10.1107/S1600536805012699","","","0.71073","MoKα","","0.0661","0.0493","","","0.1356","0.1483","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205832","7.133","0.003","22.536","0.008","7.056","0.003","90","","90","","90","","1134.2","0.8","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C4 H16 Cu N10 O2 -","- C4 H16 Cu N10 O2 -","- C16 H64 Cu4 N40 O8 -","4","0.5","WN6348","Su, Ying-Lan; Lu, Li-Ping; Li, Xue-Mei; Zhu, Miao-Li","Bis(biguanido-κ^2^<i>N</i>,<i>N</i>')copper(II) dihydrate","Acta Crystallographica Section E","2005","61","5","m910","m912","10.1107/S160053680501127X","","","0.71073","MoKα","","0.0465","0.0403","","","0.0923","0.096","","","","","","1.195","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205833","6.2128","0.0007","10.0405","0.0011","17.4701","0.0019","90","","90","","90","","1089.8","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Ethyl 3,5-dinitro salicylate","","- C9 H8 N2 O7 -","- C9 H8 N2 O7 -","- C36 H32 N8 O28 -","4","1","WW6364","Jin, Long-Fei; Xiao, Feng-Ping","Ethyl 3,5-dinitrosalicylate","Acta Crystallographica Section E","2005","61","5","o1263","o1264","10.1107/S160053680501041X","","","0.71073","MoKα","","0.0699","0.0501","","","0.1164","0.1264","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205834","22.162","0.006","5.8941","0.0017","9.743","0.003","90","","91.12","0.004","90","","1272.4","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Morpholinomethyl-2-naphthol","","- C15 H17 N O2 -","- C15 H17 N O2 -","- C60 H68 N4 O8 -","4","1","WW6372","Ma, Shan-Shan; Zhang, Ming-Jie; Yuan, Dong-Yan; Qi, Zhao-Bin","1-Morpholinomethyl-2-naphthol","Acta Crystallographica Section E","2005","61","5","o1370","o1371","10.1107/S1600536805011384","","","0.71073","MoKα","","0.0778","0.0456","","","0.1189","0.1318","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205835","15.721","0.004","12.082","0.003","21.386","0.006","90","","104.346","0.006","90","","3935.4","1.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(3,4-Methylenedioxyphenyl)-1-(2-furyl)-3-(p-toluenesulfonylamino) propan-1-one","","- C21 H19 N O6 S -","- C21 H19 N O6 S -","- C168 H152 N8 O48 S8 -","8","2","WW6374","Yu, Zhifang; Liu, Yi; Gu, Xiuyan; Zhao, Bing","3-(3,4-Methylenedioxyphenyl)-1-(2-furyl)-3-(<i>p</i>-toluenesulfonylamino)propan-1-one","Acta Crystallographica Section E","2005","61","5","o1333","o1334","10.1107/S1600536805010779","","","0.71073","MoKα","","0.1314","0.0607","","","0.1478","0.1954","","","","","","0.999","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205836","7.235","0.0014","9.56","0.0019","15.454","0.003","90","","97.03","0.03","90","","1060.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[3-(Methoxyl)phenyl]-5-chloromethyl-1,2,4-oxadiazole","","- C10 H9 Cl N2 O2 -","- C10 H9 Cl N2 O2 -","- C40 H36 Cl4 N8 O8 -","4","1","WW6385","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","5-Chloromethyl-3-(3-methoxyphenyl)-1,2,4-oxadiazole","Acta Crystallographica Section E","2005","61","5","o1446","o1447","10.1107/S1600536805012067","","","0.71073","MoKα","","0.1908","0.0692","","","0.1678","0.2311","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205837","26.167","0.006","14.15","0.004","32.116","0.007","90","","97.91","0.02","90","","11778","5","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Bis[μ-bis(4-nitrophenyl) phosphato-κ^2^O:O']bis{[bis(2-pyridylmethyl)amine- κ^3^N,N',N''']copper(II)} diperchlorate acetonitrile hemisolvate","","- C49 H41.5 Cl2 Cu2 N10.5 O24 P2 -","- C49 H41.5 Cl2 Cu2 N10.5 O24 P2 -","- C392 H332 Cl16 Cu16 N84 O192 P16 -","8","1","XU6000","Butcher, Ray J.; Gultneh, Yilma; Allwar","Bis[μ-bis(4-nitrophenyl)phosphato-κ^2^<i>O</i>:<i>O</i>']bis{[bis(2-pyridylmethyl)amine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''']copper(II)} diperchlorate acetonitrile hemisolvate","Acta Crystallographica Section E","2005","61","5","m818","m821","10.1107/S160053680500992X","","","0.71073","MoKα","","0.16","0.065","","","0.128","0.168","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205838","7.165","0.002","9.709","0.003","13.999","0.005","92.878","0.005","102.008","0.004","102.174","0.005","926.6","0.5","293","","293","","","","","","","","","6","P -1","-P 1","2","","Bis[1-ferrocenyl-3-(2,6-dimethylphenyl)aminobut-2-en-1-onato]nickel(II)","","- C44 H44 Fe2 N2 Ni O2 -","- C44 H44 Fe2 N2 Ni O2 -","- C44 H44 Fe2 N2 Ni O2 -","1","0.5","XU6001","Shi, Yao-Cheng","Bis[1-ferrocenyl-3-(2,6-dimethylphenyl)aminobut-2-en-1-onato]nickel(II)","Acta Crystallographica Section E","2005","61","5","m873","m874","10.1107/S1600536805010962","","","0.71073","MoKα","","0.048","0.033","","","0.076","0.091","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205839","9.8745","0.0007","17.3467","0.0011","21.7544","0.0014","90","","90","","90","","3726.3","0.4","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Poly[(1,10-phenanthroline)(μ~4~-4-sulfonatobenzoato)lead(II) hydrate]","","- C19 H14 N2 O6 Pb S -","- C19 H12 N2 O6 Pb S -","- C152 H96 N16 O48 Pb8 S8 -","8","1","XU6002","Zhang, Li-Ping; Zhu, Long-Guan; Xiao, Hong-Ping","Poly[(1,10-phenanthroline-κ^2^<i>N,N</i>')lead(II) μ~4~-(4-sulfonatobenzoato-κ^4^<i>O,O</i>':O'',<i>O</i>''' hydrate]","Acta Crystallographica Section E","2005","61","5","m860","m862","10.1107/S1600536805010925","","","0.71073","MoKα","","0.047","0.032","","","0.066","0.071","","","","","","1.012","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205840","14.949","0.004","13.366","0.002","7.324","0.008","90","","101.214","0.008","90","","1435.5","1.6","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(2-hydroxy-4-isopropoxyphenyl)-2-phenylethanone","","- C17 H18 O3 -","- C17 H18 O3 -","- C68 H72 O12 -","4","1","YA6236","Zhang, Shu-Ping; Wang, Xiao-Bing; Zhang, Zun-Ting","1-(2-Hydroxy-4-isopropoxyphenyl)-2-phenylethanone","Acta Crystallographica Section E","2005","61","5","o1257","o1258","10.1107/S1600536805010408","","","0.71073","MoKα","","0.099","0.046","","","0.081","0.096","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205841","7.7657","0.0019","27.655","0.006","9.902","0.002","90","","102.526","0.004","90","","2075.9","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N,N'-bis{3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazol-5- yl}-1,4-benzenediamide bis(dimethylformamide) solvate","","- C36 H26 Cl4 F6 N10 O4 -","- C36 H26 Cl4 F6 N10 O4 -","- C72 H52 Cl8 F12 N20 O8 -","2","0.5","YA6241","Chen, Di-Mei; Zhong, Ping; Yang, Zhi-Ping; Hu, Mao-Lin","<i>N</i>,<i>N</i>'-Bis{3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazol-5-yl}-1,4-benzenediamide dimethylformamide disolvate<i></i>","Acta Crystallographica Section E","2005","61","5","o1362","o1363","10.1107/S1600536805011153","","","0.71073","MoKα","","0.145","0.098","","","0.268","0.248","","","","","","1.18","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205842","12.3011","0.0017","12.3846","0.0013","14.187","0.002","90","","114.338","0.011","90","","1969.2","0.5","293","1","293","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 O4 S7 -","- C15 H10 O4 S7 -","- C60 H40 O16 S28 -","4","1","YA6243","Wang, Yan-Ling; Yu, Wen-Tao; Xu, Dong; Wang, Xin-Qiang; Zhang, Guang-Hui; Feng, Lin","4,5-Bis(phenylsulfonylthio)-1,3-dithiolane-2-thione","Acta Crystallographica Section E","2005","61","5","o1432","o1433","10.1107/S1600536805011876","","","0.71073","MoKα","","0.171","0.066","","","0.124","0.185","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205843","10.2012","0.0006","26.7355","0.0015","11.0576","0.0006","90","","107.65","0.0009","90","","2873.8","0.3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tetrakis(trimethylsilyl) isocyanatomethylenebisphosphonate","","- C14 H37 N O7 P2 Si4 -","- C14 H37 N O7 P2 Si4 -","- C56 H148 N4 O28 P8 Si16 -","4","1","AC6169","Petrov, Petar Y.; McDonald, Robert; Lukowski, Robert D.; Cavell, Ronald G.; Angelov, Christo M.","Tetrakis(trimethylsilyl) isocyanatomethylenebisphosphonate","Acta Crystallographica Section E","2005","61","6","o1549","o1551","10.1107/S1600536805013735","","","0.71073","MoKα","","0.0417","0.0352","","","0.0969","0.1023","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205844","9.071","0.0003","10.0861","0.0005","10.1864","0.0003","100.147","0.001","115.39","0.001","108.728","0.001","741.78","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Tetraamminehydroxonitrosylruthenium(III) tetranitropalladate(II) monohydrate","","- H15 N9 O11 Pd Ru -","- H15 N9 O11 Pd Ru -","- H30 N18 O22 Pd2 Ru2 -","2","1","AC6171","Il'in, Maxim A.; Kuratieva, Natalia V.; Kirichenko, Olga A.; Baidina, Iraida A.; Naumov, Dmirty Yu.; Korolkow, Ilya V.; Emel'yanov, Vyacheslav A.","Tetraamminehydroxonitrosylruthenium(III) tetranitropalladate(II) monohydrate","Acta Crystallographica Section E","2005","61","6","i126","i128","10.1107/S1600536805016673","","","0.71073","MoKα","","0.0194","0.0175","","","0.0442","0.0449","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205845","8.274","0.003","9.125","0.002","10.623","0.002","76.31","0.02","81.34","0.02","66.51","0.03","713.3","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Methoxy-6-methyl-3-nitro-4-(2-nitroprop-1-enyl)phenyl acetate","","- C13 H14 N2 O7 -","- C13 H14 N2 O7 -","- C26 H28 N4 O14 -","2","1","AC6172","Evan G. Moore; Paul Meredith; Paul V. Bernhardt","2-Methoxy-6-methyl-3-nitro-4-(2-nitroprop-1-enyl)phenyl acetate","Acta Crystallographica Section E","2005","61","6","o1709","o1711","10.1107/S1600536805014212","","","0.71073","MoKα","","0.1231","0.0464","","","0.1143","0.1435","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205846","7.5119","0.0004","16.9551","0.0009","17.1127","0.0009","90","","90.821","0.001","90","","2179.3","0.2","295","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaqua(benzimidazole)(nitrato-κO)(1,10-phenanthroline)cadmium(II) nitrate","","- C19 H18 Cd N6 O8 -","- C19 H18 Cd N6 O8 -","- C76 H72 Cd4 N24 O32 -","4","1","AC6173","Xiong, Jing; Lei, Xin-Xiang; Ng, Seik Weng","Diaqua(benzimidazole)(nitrato-κ<i>O</i>)(1,10-phenanthroline)cadmium(II) nitrate","Acta Crystallographica Section E","2005","61","6","m1097","m1098","10.1107/S1600536805014388","","","0.71073","MoKα","","0.054","0.046","","","0.132","0.137","","","","","","1.13","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205847","11.1249","0.0006","21.926","0.001","14.6557","0.0007","90","","107.096","0.001","90","","3416.9","0.3","295","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aquabis(hexamethylenetetramine-κN)bis(2-hydroxy-trans-cinnamato- κ^2^O,O')cadmium trihydrate","","- C30 H46 Cd N8 O10 -","- C30 H46 Cd N8 O10.004 -","- C120 H184 Cd4 N32 O40.016 -","4","1","AC6174","Cheng, Ya-Qian; Shi, Qian; Dai, Lin-Li; Ng, Seik Weng","Aquabis(hexamethylenetetramine-κ<i>N</i>)bis(2-hydroxy-<i>trans</i>-cinnamato-κ^2^<i>O</i>,<i>O</i>')cadmium trihydrate","Acta Crystallographica Section E","2005","61","6","m1240","m1242","10.1107/S1600536805016545","","","0.71073","MoKα","","0.052","0.042","","","0.098","0.103","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205848","7.294","0.002","8.762","0.002","8.891","0.002","64.87","0.01","70.1","0.01","73.79","0.01","477.6","0.2","174","2","174","2","","","","","","","","4","P -1","-P 1","2","","2,3,5,6-tetrachlorodicyanobenzene‒anthracene (1/1)","","- C22 H10 Cl4 N2 -","- C22 H10 Cl4 N2 -","- C22 H10 Cl4 N2 -","1","0.5","AC6175","Britton, Doyle","2,3,5,6-Tetrachloro-1,4-dicyanobenzene‒anthracene (1/1)","Acta Crystallographica Section E","2005","61","6","o1707","o1708","10.1107/S1600536805014674","","","0.71073","MoKα","","0.056","0.043","","","0.113","0.121","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205849","8.666","0.002","10.125","0.003","4.7776","0.0012","90","","93.98","0.01","90","","418.19","0.19","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","2,6-Dibromo-4-chlorobenzonitrile","","- C7 H2 Br2 Cl N -","- C7 H2 Br2 Cl N -","- C14 H4 Br4 Cl2 N2 -","2","0.5","AC6176","Britton, Doyle","2,6-Dibromo-4-chlorobenzonitrile","Acta Crystallographica Section E","2005","61","6","o1726","o1727","10.1107/S1600536805014686","","","0.71073","MoKα","","0.023","0.022","","","0.056","0.057","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205850","10.0277","0.0002","7.9202","0.0002","23.2669","0.0006","90","","90.985","0.001","90","","1847.62","0.08","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[tetrakis(methylsulfanyl)tetrathiafulvalenium] oxalate dichloride","","- C22 H24 Cl2 O4 S16 -","- C22 H24 Cl2 O4 S16 -","- C44 H48 Cl4 O8 S32 -","2","0.5","AT6006","Lei Wang; Jing-Ping Zhang; Bin Zhang","Bis[tetrakis(methylsulfanyl)tetrathiafulvalenium] oxalate dichloride","Acta Crystallographica Section E","2005","61","6","o1674","o1676","10.1107/S1600536805014121","","","0.71073","MoKα","","0.111","0.039","","","0.081","0.093","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205851","3.8956","0.0003","11.3796","0.0014","18.3249","0.0018","90","","90","","90","","812.35","0.14","296","","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Acetamidobenzonitrile","","- C9 H8 N2 O -","- C9 H8 N2 O -","- C36 H32 N8 O4 -","4","1","AT6007","Burcu Arslan; Canan Kazak; Cumhur Kirilmis; Murat Koca; Orhan Büyükgüngör","2-Acetamidobenzonitrile","Acta Crystallographica Section E","2005","61","6","o1652","o1653","10.1107/S1600536805013152","","","0.71073","MoKα","","0.042","0.032","","","0.077","0.079","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205852","11.314","0.002","7.951","0.0016","19.598","0.004","90","","103.08","0.03","90","","1717.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-ylmethoxy]phenylacetate","","- C18 H15 Cl N2 O4 -","- C18 H15 Cl N2 O4 -","- C72 H60 Cl4 N8 O16 -","4","1","AT6008","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","Methyl 2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-ylmethoxy]phenylacetate","Acta Crystallographica Section E","2005","61","6","o1858","o1860","10.1107/S1600536805015138","","","0.71073","MoKα","","0.13","0.06","","","0.13","0.15","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205853","5.2868","0.0013","8.5968","0.0011","13.878","0.002","74.39","0.19","89.598","0.018","88.87","0.01","607.4","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1-(4-bromophenyl)-2-(2-propenylsulfonyl)ethanone","","- C11 H11 Br O3 S -","- C11 H11 Br O3 S -","- C22 H22 Br2 O6 S2 -","2","1","AT6009","David J. Young; Malcolm D. King; Peter C. Healy","1-(4-Bromophenyl)-2-(2-propenylsulfonyl)ethanone","Acta Crystallographica Section E","2005","61","6","o1668","o1669","10.1107/S1600536805014522","","","0.7107","MoKα","","0.111","0.034","","","0.071","0.088","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205854","8.0593","0.0003","8.4334","0.0003","9.8099","0.0004","111.688","0.002","91.079","0.002","99.634","0.002","608.44","0.04","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Bis(2,2'-dipyridylamine)dimethanolcopper(II) hexafluorosilicate","","- C22 H26 Cu F6 N6 O2 Si -","- C22 H26 Cu F6 N6 O2 Si -","- C22 H26 Cu F6 N6 O2 Si -","1","0.5","BD6002","Casellas, Helene; Pevec, Andrej; Kozlevcar, Bojan; Gamez, Patrick; Reedijk, Jan","Bis(2,2'-dipyridylamine)dimethanolcopper(II) hexafluorosilicate","Acta Crystallographica Section E","2005","61","6","m1120","m1122","10.1107/S1600536805014777","","","0.71073","MoKα","","0.0414","0.0319","","","0.0696","0.0742","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205855","6.0466","0.0018","19.314","0.006","11.452","0.003","90","","91.034","0.004","90","","1337.2","0.7","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,4-Dichlorobenzaldehyde (2-hydroxybenzoyl)hydrazone","","- C14 H10 Cl2 N2 O2 -","- C14 H10 Cl2 N2 O2 -","- C56 H40 Cl8 N8 O8 -","4","1","BD6005","Ma, Jian; Zhang, Shu-Ping; Sheng, Liang-Quan; Fan, Min; Yang, Ya-Li; Shao, Si-Chang","3,4-Dichlorobenzaldehyde (2-hydroxybenzoyl)hydrazone","Acta Crystallographica Section E","2005","61","6","o1747","o1748","10.1107/S1600536805014789","","","0.71073","MoKα","","0.0677","0.0393","","","0.0859","0.1024","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205856","16.823","0.004","7.179","0.002","19.847","0.005","90","","90","","90","","2397","1.1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-Allyl-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylic acid","","- C13 H15 N O4 -","- C13 H15 N O4 -","- C104 H120 N8 O32 -","8","1","BH6001","Shishkina, Svetlana V.; Shishkin, Oleg V.; Ukrainets, Igor V.; Kolesnik, Elena V.","1-Allyl-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylic acid","Acta Crystallographica Section E","2005","61","6","o1833","o1835","10.1107/S1600536805015175","","","0.71073","MoKα","","0.1559","0.0471","","","0.1099","0.1322","","","","","","0.846","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205857","13.3944","0.0005","13.6063","0.0006","26.354","0.001","90","","90","","90","","4803","0.3","295","2","295","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","catena-Poly-[[[triaquazinc(II)]-μ-chloro-[aquacucurbit[5]urilpotassium(I)]] tetrachlorozincate(II) pentahydrate]","","- C30 H48 Cl5 K N20 O19 Zn2 -","- C30 H48 Cl5 K N20 O19 Zn2 -","- C120 H192 Cl20 K4 N80 O76 Zn8 -","4","0.5","BH6002","Liu, Jing-Xin; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","<i>catena</i>-Poly[[[triaquazinc(II)]-μ-chloro-[aquacucurbit[5]urilpotassium(I)]] tetrachlorozincate(II) pentahydrate]","Acta Crystallographica Section E","2005","61","6","m1021","m1023","10.1107/S1600536805012845","","","0.71073","MoKα","","0.051","0.044","","","0.128","0.134","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205858","19.531","0.002","25.5","0.002","7.8777","0.0007","90","","104.847","0.002","90","","3792.4","0.6","295","2","295","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Bis(2-aminoethylaminium-κN^2^)bis(dimethylglyoximato-κ^2^N,N')cobalt(III) dichloro(dimethylglyoximato-κ^2^N,N')(dimethylglyoxime-κ^2^N,N')cobalt(III) dichloride 0.75-hydrate","","- C20 H47.5 Cl4 Co2 N12 O8.75 -","- C20 H47.5 Cl4 Co2 N12 O8.75 -","- C80 H190 Cl16 Co8 N48 O35 -","4","0.5","BH6003","Shen, Xu-Jie; Xiao, Li-Ping; Xu, Ru-Ren","Bis(2-aminoethylaminium-κ<i>N</i>^2^)bis(dimethylglyoximato-κ^2^<i>N,N</i>')cobalt(III) dichloro(dimethylglyoximato-κ^2^<i>N,N</i>')(dimethylglyoxime-κ^2^<i>N,N</i>')cobaltate(III) dichloride 0.75-hydrate","Acta Crystallographica Section E","2005","61","6","m1185","m1187","10.1107/S1600536805015552","","","0.71073","MoKα","","0.1067","0.0482","","","0.1261","0.1437","","","","","","1.044","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2205859","10.941","0.003","9.135","0.002","20.013","0.004","90","","103.605","0.004","90","","1944.1","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[aqua(1,10-phenanthroline)manganese(II)]-μ-endo-norbornene- cis-5,6-dicarboxylato] monohydrate]","","- C21 H20 Mn N2 O6 -","- C21 H20 Mn N2 O6 -","- C84 H80 Mn4 N8 O24 -","4","1","BH6004","Mao-Lin Hu; Nan-Wen Zhu","<i>catena</i>-Poly[[[aqua(1,10-phenanthroline)manganese(II)]-μ-<i>endo</i>-norbornene-<i>cis</i>-5,6-dicarboxylato] monohydrate]","Acta Crystallographica Section E","2005","61","6","m1105","m1107","10.1107/S1600536805014017","","","0.71073","MoKα","","0.0481","0.0403","","","0.0947","0.0992","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205860","6.26","0.001","7.248","0.001","9.451","0.002","105.29","0.03","100.19","0.03","106.27","0.03","382.23","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","catena-Poly[[bis(4-aminopyrimidine-κN^1^)copper(II)]-di-μ-dicyanamido- κ^4^N^1^:N^3^]","","- C12 H10 Cu N12 -","- C12 H10 Cu N12 -","- C12 H10 Cu N12 -","1","0.5","BH6005","Kožíšek, Jozef; García Díaz, Jesús; Fronc, Marek; Svoboda, Ingrid","<i>catena</i>-Poly[[bis(4-aminopyrimidine-κ<i>N</i>^1^)copper(II)]-di-μ-dicyanamido-κ^4^<i>N</i>^1^:<i>N</i>^3^]","Acta Crystallographica Section E","2005","61","6","m1150","m1152","10.1107/S160053680501514X","","","0.71073","MoKα","","0.0268","0.0251","","","0.0632","0.0639","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205861","54.925","0.011","5.8189","0.0012","21.628","0.004","90","","98.14","0.03","90","","6843","2","120","2","120","2","","","","","","","","4","C 1 2 1","C 2y","5","","10-Methoxy-5H-dibenz[b,f]azepine","","- C15 H13 N O -","- C15 H13 N O -","- C360 H312 N24 O24 -","24","6","BH6006","Basavegowda Nagaraj; Hemmige S. Yathirajan; Daniel E. Lynch","10-Methoxy-5<i>H</i>-dibenz[<i>b</i>,<i>f</i>]azepine","Acta Crystallographica Section E","2005","61","6","o1757","o1759","10.1107/S1600536805015059","","","0.71073","MoKα","","0.1101","0.0553","","","0.1242","0.1455","","","","","","1.182","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205862","9.3181","0.0012","11.6211","0.0015","13.9327","0.0018","87.052","0.002","76.227","0.002","77.46","0.002","1430.4","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","(4-Biphenylacetato)tricyclohexyltin(IV)","","- C32 H44 O2 Sn -","- C32 H44 O2 Sn -","- C64 H88 O4 Sn2 -","2","1","BH6007","Lai-Jin Tian; Yu-Xi Sun; Yi-Zhen Gao; Guo-Ming Yang","(4-Biphenylacetato)tricyclohexyltin(IV)","Acta Crystallographica Section E","2005","61","6","m1199","m1200","10.1107/S160053680501617X","","","0.71073","MoKα","","0.0322","0.0301","","","0.0789","0.0807","","","","","","1.051","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205863","7.2499","0.0004","9.4445","0.0006","20.8273","0.0012","90","","93.159","0.001","90","","1423.91","0.15","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[aqua(nitrato-κ^2^O,O')(1,10-phenanthroline)cadmium(II)]-μ- nitrato-κ^2^O:O']","","- C12 H10 Cd N4 O7 -","- C12 H10 Cd N4 O7 -","- C48 H40 Cd4 N16 O28 -","4","1","BR6190","Mao-Lin Hu; Fan Chen; Shun Wang","<i>catena</i>-Poly[[aqua(nitrato-κ^2^<i>O,O</i>')(1,10-phenanthroline)cadmium(II)]-μ-nitrato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","6","m1058","m1060","10.1107/S1600536805013899","","","0.71073","MoKα","","0.0273","0.0243","","","0.057","0.0585","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205864","11.332","0.005","9.519","0.005","23.514","0.008","90","","94.735","0.003","90","","2527.8","1.9","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(tetrahydrofuran-κO)lithium(I)]-μ-1,1,3,3- tetraphenyltriphosphane-κ^2^P^1^,P^3^:κP^2^]","","- C28 H28 Li O P3 -","- C28 H28 Li O P3 -","- C112 H112 Li4 O4 P12 -","4","1","BR6191","Wioleta Domanska; Jaroslaw Chojnacki; Jerzy Pikies","<i>catena</i>-Poly[[(tetrahydrofuran-κ<i>O</i>)lithium(I)]-μ-1,1,3,3-tetraphenyltriphosphane-κ^2^<i>P</i>^1^,<i>P</i>^3^:κ<i>P</i>^2^]","Acta Crystallographica Section E","2005","61","6","m1114","m1116","10.1107/S1600536805014613","","","0.71073","MoKα","","0.0741","0.0639","","","0.1325","0.1386","","","","","","1.144","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205865","20.863","0.004","10.7899","0.0019","7.363","0.0013","90","","90","","90","","1657.5","0.5","273","2","273","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Acetonitriledichloro(1,4,7-triazacyclodecane)cobalt(III) perchlorate","","- C9 H20 Cl3 Co N4 O4 -","- C9 H20 Cl3 Co N4 O4 -","- C36 H80 Cl12 Co4 N16 O16 -","4","0.5","BT6641","Guo, Hui; Ren Yan-Wei; Li, Jun; Zhang, Feng-Xing","Acetonitriledichloro(1,4,7-triazacyclodecane)cobalt(III) perchlorate","Acta Crystallographica Section E","2005","61","6","m1080","m1081","10.1107/S1600536805014042","","","0.71073","MoKα","","0.0659","0.0414","","","0.1098","0.1177","","","","","","1.055","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205866","21.382","0.004","7.407","0.0015","13.372","0.003","90","","125.34","0.03","90","","1727.6","0.9","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl indole-3-carboxylate","","- C10 H9 N O2 -","- C10 H9 N O2 -","- C80 H72 N8 O16 -","8","1","BT6646","Hu, Shen-Cai; Zhu, Hai-Liang; Hong, Kui; Yu, Zi-Niu; Tan, Ren-Xiang","Methyl indole-3-carboxylate","Acta Crystallographica Section E","2005","61","6","o1654","o1656","10.1107/S1600536805012109","","","0.71073","MoKα","","0.0789","0.0559","","","0.1357","0.152","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205867","13.6953","0.0014","9.0282","0.0015","16.302","0.002","90","","106.983","0.007","90","","1927.7","0.5","291","1","291","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E,E)-α-(Methoxyimino)-2-[({1-[3-(trifluoromethyl)phenyl]ethyl- idene}amino)oxymethyl]benzeneacetic acid","","- C19 H17 F3 N2 O4 -","- C19 H17 F3 N2 O4 -","- C76 H68 F12 N8 O16 -","4","1","BT6649","Banerjee, Kaushik; Ligon, Axel Patrick; Schürmann, Markus; Preut, Hans; Spiteller, Michael","(<i>E,E</i>)-α-(Methoxyimino)-2-[({1-[3-(trifluoromethyl)phenyl]ethylidene}amino)oxymethyl]benzeneacetic acid","Acta Crystallographica Section E","2005","61","6","o1528","o1529","10.1107/S1600536805012900","","","0.71073","MoKα","","0.1647","0.0363","","","0.0645","0.0937","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2205868","8.0652","0.0006","8.2977","0.0006","18.409","0.0013","80.057","0.001","84.796","0.001","69.754","0.001","1137.86","0.14","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","4'-(4-Methoxyphenyl)-1-methylchroman-3-spiro-3'-pyrrolidine-2'-spiro-2''- indan-4,1'',3''-trione","","- C28 H23 N O4 -","- C28 H23 N O4 -","- C56 H46 N2 O8 -","2","1","BT6653","S. Selvanayagam; D. Velmurugan; K. Ravikumar; J. Jayashankaran; R. Raghunathan","4'-(4-Methoxyphenyl)-1-methylchroman-3-spiro-3'-pyrrolidine-2'-spiro-2''-indan-4,1'',3''-trione","Acta Crystallographica Section E","2005","61","6","o1582","o1584","10.1107/S1600536805013206","","","0.71073","MoKα","","0.0593","0.0523","","","0.1461","0.1556","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205869","9.5561","0.0006","16.1035","0.0011","15.2631","0.001","90","","91.213","0.01","90","","2348.3","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7'-(4-Methoxyphenyl)-chroman-3-spiro-6'-hexahydro-1H-pyrrolo[1,2-c]thiazole- 5'-spiro-3''-1''H-indole-4,2''(3''H)-dione","","- C28 H24 N2 O4 S -","- C28 H24 N2 O4 S -","- C112 H96 N8 O16 S4 -","4","1","BT6657","S. Selvanayagam; Jasmin Paul; D. Velmurugan; K. Ravikumar; R. Rathna Durga; R. Raghunathan","7'-(4-Methoxyphenyl)chroman-3-spiro-6'-hexahydro-1<i>H</i>-pyrrolo[1,2-<i>c</i>]thiazole-5'-spiro-3''-1''<i>H</i>-indole-4,2''(3''<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","6","o1585","o1587","10.1107/S1600536805013218","","","0.71073","MoKα","","0.054","0.047","","","0.1207","0.1262","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205870","9.2614","0.0009","18.4306","0.0019","9.8602","0.001","90","","99.382","0.002","90","","1660.6","0.3","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-Butyl-N-o-tolyl-benzenesulfonamide","","- C17 H21 N O2 S -","- C17 H21 N O2 S -","- C68 H84 N4 O8 S4 -","4","1","BT6659","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; P. Jaisankar; P. C. Srinivasan","<i>N</i>-Butyl-<i>N</i>-<i>o</i>-tolylbenzenesulfonamide","Acta Crystallographica Section E","2005","61","6","o1916","o1918","10.1107/S160053680501562X","","","0.71073","MoKα","","0.0771","0.0611","","","0.1655","0.1794","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205871","7.147","0.0005","11.854","0.0008","15.456","0.001","106.45","0.02","95.17","0.01","91.02","0.02","1249.4","0.2","293","2","293","2","","","","","","","","4","P 1","P 1","1","L-Leucine L-leucinium picrate","L-Leucine L-leucinium picrate","","- C18 H29 N5 O11 -","- C18 H29 N5 O11 -","- C36 H58 N10 O22 -","2","2","BT6660","K. Anitha; S. Athimoolam; R. K. Rajaram","<small>L</small>-Leucine <small>L</small>-leucinium picrate","Acta Crystallographica Section E","2005","61","6","o1604","o1606","10.1107/S1600536805014030","","","0.71073","MoKα","","0.0719","0.0507","","","0.1353","0.1495","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205872","22.48","0.0014","22.1594","0.0015","7.7029","0.0006","90","","90","","90","","3837.1","0.5","173","1","173","1","","","","","","","","5","P n a 21","P 2c -2n","33","","Methyl (Z,E)-α-methoxyimino-α-(1-{[3- (trifluoromethyl)phenyl]ethylideneaminooxymethyl}benzene)acetate","","- C20 H19 F3 N2 O4 -","- C20 H19 F3 N2 O4 -","- C160 H152 F24 N16 O32 -","8","2","BT6661","Banerjee, Kaushik; Ligon, Axel Patrick; Schürmann, Markus; Preut, Hans; Spiteller, Michael","Methyl (<i>Z,E</i>)-α-(methoxyimino)-2-[({1-[3-(trifluoromethyl)phenyl]ethylidene}amino)oxymethyl]benzeneacetate","Acta Crystallographica Section E","2005","61","6","o1569","o1570","10.1107/S160053680501336X","","","0.71073","MoKα","","0.0867","0.0329","","","0.0458","0.0502","","","","","","0.864","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205873","7.5713","0.0003","10.9972","0.0004","20.0451","0.0006","90","","101.55","0.002","90","","1635.22","0.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E,E)-2-(4-Methylphenylmethylene)-6-(4-nitrophenylmethylene)cyclohexanone","","- C21 H19 N O3 -","- C21 H19 N O3 -","- C84 H76 N4 O12 -","4","1","BT6665","Quail, J. Wilson; Doroudi, Alireza; Pati, Hari N.; Das, Umashankar; Dimmock, Jonathan R.","(<i>E,E</i>)-2-(4-Methylphenylmethylene)-6-(4-nitrophenylmethylene)cyclohexanone","Acta Crystallographica Section E","2005","61","6","o1795","o1797","10.1107/S1600536805015102","","","0.71073","MoKα","","0.0815","0.0478","","","0.112","0.1297","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205874","15.5155","0.0007","13.6328","0.0009","7.7777","0.0006","90","","101.344","0.003","90","","1613","0.18","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E,E)-2-(4-Fluorophenylmethylene)-6-(4-nitrophenylmethylene)cyclohexanone","","- C20 H16 F N O3 -","- C20 H16 F N O3 -","- C80 H64 F4 N4 O12 -","4","1","BT6666","Quail, J. Wilson; Doroudi, Alireza; Pati, Hari N.; Das, Umashankar; Dimmock, Jonathan R.","(<i>E</i>,<i>E</i>)-2-(4-Fluorophenylmethylene)-6-(4-nitrophenylmethylene)cyclohexanone","Acta Crystallographica Section E","2005","61","6","o1774","o1776","10.1107/S160053680501490X","","","0.71073","MoKα","","0.1125","0.0585","","","0.1137","0.1353","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205875","8.7481","0.0008","19.0068","0.0018","12.494","0.0012","90","","95.891","0.002","90","","2066.4","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-(1H-indol-3-ylmethyl)-1,2,3,3a,4,11c- hexahydronaphtho[2',1':2,3]pyrano[4,5-b]pyrrole-2-carboxylate","","- C26 H24 N2 O3 -","- C26 H24 N2 O3 -","- C104 H96 N8 O12 -","4","1","BT6667","S. Karthick; S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Arumugam; R. Raghunathan","Methyl 2-(1<i>H</i>-indol-3-ylmethyl)-1,2,3,3a,4,11c-hexahydronaphtho[2',1':2,3]pyrano[4,5-<i>b</i>]pyrrole-2-carboxylate","Acta Crystallographica Section E","2005","61","6","o1780","o1782","10.1107/S1600536805015114","","","0.71073","MoKα","","0.0628","0.0504","","","0.1502","0.1623","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205876","8.0256","0.0012","33.58","0.005","8.0957","0.0011","90","","111.566","0.005","90","","2029.1","0.5","291","1","291","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl (E,Z)-α-(methoxyimino)-2-[({1-[3- (trifluoromethyl)phenyl]ethylidene}amino)oxymethyl]benzeneacetate","","- C20 H19 F3 N2 O4 -","- C20 H19 F3 N2 O4 -","- C80 H76 F12 N8 O16 -","4","1","BT6668","Banerjee, Kaushik; Ligon, Axel Patrick; Schürmann, Markus; Preut, Hans; Spiteller, Michael","Methyl (<i>E,Z</i>)-α-(methoxyimino)-2-[({1-[3-(trifluoromethyl)phenyl]ethylidene}amino)oxymethyl]benzeneacetate","Acta Crystallographica Section E","2005","61","6","o1752","o1753","10.1107/S1600536805014972","","","0.71073","MoKα","","0.0899","0.0361","","","0.0686","0.0728","","","","","","0.978","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205877","7.7602","0.0011","9.8884","0.0014","13.965","0.002","108.074","0.002","94.933","0.002","109.974","0.002","935.1","0.2","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","8,12-Dioxa-1,7,10(1,2)-tribenzenacyclododecaphane-2,5-dien-4-one","","- C25 H20 O3 -","- C25 H20 O3 -","- C50 H40 O6 -","2","1","BT6669","V. Vinodhkumar; S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Poornachandran; R. Raghunathan","8,12-Dioxa-1,7,10(1,2)-tribenzenacyclododecaphane-2,5-dien-4-one","Acta Crystallographica Section E","2005","61","6","o1839","o1841","10.1107/S1600536805015631","","","0.71073","MoKα","","0.0604","0.0513","","","0.1432","0.1523","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205878","10.006","0.002","10.801","0.002","17.705","0.004","89.63","0.03","83.97","0.03","69.75","0.03","1784.3","0.7","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","33,5,9,12-Tetra-tert-butyl-10,14-dicyclohexyl-2,8- dioxatetracyclo[5.4.0.2^1,9^.1^3,7^]tetradeca-4,12-diene-6,11-dione","","- C40 H62 O4 -","- C40 H62 O4 -","- C80 H124 O8 -","2","1","BT6670","Meindl, Kathrin; Maslovskaya, Lidiya A.; Noltemeyer, Mathias; Savchenko, Andrei I.","3,5,9,12-Tetra-<i>tert</i>-butyl-10,14-dicyclohexyl-2,8-dioxatetracyclo[5.4.0.2^1,9^.1^3,7^]tetradeca-4,12-diene-6,11-dione","Acta Crystallographica Section E","2005","61","6","o1950","o1952","10.1107/S1600536805016582","","","0.71073","MoKα","","0.0666","0.0525","","","0.1293","0.1428","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205879","7.329","0.003","10.168","0.005","10.66","0.005","67.126","0.005","80.663","0.008","71.7","0.008","694.2","0.6","130","2","130","2","","","","","","","","4","P -1","-P 1","2","diethylaminium 3,5-dinitrosalicylate","Diethylaminium 3,5-dinitrosalicylate","","- C11 H15 N3 O7 -","- C11 H15 N3 O7 -","- C22 H30 N6 O14 -","2","1","BT6671","Graham Smith; Urs D. Wermuth; Jonathan M. White","Diethylaminium 3,5-dinitrosalicylate at 130K","Acta Crystallographica Section E","2005","61","6","o1836","o1838","10.1107/S1600536805015199","","","0.71073","MoKα","","0.0757","0.0648","","","0.1868","0.1954","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205880","35.035","0.006","5.8335","0.001","16.049","0.003","90","","116.837","0.002","90","","2926.8","0.9","290","2","290","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[bis(benzotriazolato)di-μ-oxo-lead(II)]","","- C12 H8 N6 O2 Pb2 -","- C12 H8 N6 O2 Pb2 -","- C96 H64 N48 O16 Pb16 -","8","1","CF6406","V. C. Sharma; U. Lal; Tej Singh; Deepak Chopra; T. N. Guru Row","Poly[bis(benzotriazolato)di-μ-oxo-dilead(II)]","Acta Crystallographica Section E","2005","61","6","m1108","m1110","10.1107/S160053680501439X","","","0.71073","MoKα","","0.0605","0.0558","","","0.1823","0.188","","","","","","1.132","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205881","9.5847","0.0017","14.953","0.003","14.508","0.003","90","","99.694","0.004","90","","2049.6","0.7","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichlorobis(1,10-phenanthroline)mercury(II)","","- C24 H16 Cl2 Hg N4 -","- C24 H16 Cl2 Hg N4 -","- C96 H64 Cl8 Hg4 N16 -","4","1","CF6415","Ramezanipour, Farshid; Aghabozorg, Hossein; Soleimannejad, Janet","Dichlorobis(1,10-phenanthroline)mercury(II)","Acta Crystallographica Section E","2005","61","6","m1194","m1196","10.1107/S1600536805015813","","","0.71073","MoKα","","0.0394","0.0367","","","0.0877","0.0895","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205882","10.521","0.003","16.629","0.005","14.08","0.004","90","","105.315","0.005","90","","2375.9","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-{[(1Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4- ylidene)(phenyl)methyl]amino}-3-phenylpropanoate","","- C28 H27 N3 O3 -","- C28 H27 N3 O3 -","- C112 H108 N12 O12 -","4","1","CF6420","Xin Zhang; Hua-Ling Zhu; Hai-Zhen Xu; Mei Dong","Ethyl 2-{[(1<i>Z</i>)-(3-methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4-ylidene)(phenyl)methyl]amino}-3-phenylpropanoate","Acta Crystallographica Section E","2005","61","6","o1629","o1630","10.1107/S1600536805014182","","","0.71073","MoKα","","0.0948","0.0511","","","0.1097","0.1298","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205883","15.194","0.0015","15.908","0.003","13.227","0.002","90","","90","","90","","3197","0.8","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","calcium nitrate(15-crown-5)","Bis(nitrato-κ^2^O,O')(1,4,7,10,13-pentaoxacyclopentadecane)calcium(II)","","- C10 H20 Ca N2 O11 -","- C10 H20 Ca N2 O11 -","- C80 H160 Ca8 N16 O88 -","8","2","CF6421","Brown, Michael D.; Levason, William; Webster, Michael","Bis(nitrato-κ^2^<i>O,O</i>')(1,4,7,10,13-pentaoxacyclopentadecane)calcium(II)","Acta Crystallographica Section E","2005","61","6","m1015","m1017","10.1107/S1600536805012973","","","0.71073","MoKα","","0.0516","0.0402","","","0.0832","0.0887","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205884","11.979","0.002","5.202","0.001","19.773","0.003","90","","92.22","0.02","90","","1231.2","0.4","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(3-Chlorophenyl)chroman-4-one","","- C15 H11 Cl O2 -","- C15 H11 Cl O2 -","- C60 H44 Cl4 O8 -","4","1","CF6422","Hui Wu; Zhou Xu; Yu Wan; Yongmin Liang; Kaibei Yu","2-(3-Chlorophenyl)chroman-4-one","Acta Crystallographica Section E","2005","61","6","o1692","o1693","10.1107/S1600536805014637","","","0.71073","MoKα","","0.0757","0.0366","","","0.0739","0.0832","","","","","","0.872","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205885","9.2012","0.0001","16.9571","0.0003","26.3555","0.0004","90","","90","","90","","4112.13","0.11","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Acetamido-N-benzyl-1,4-imino-1,2,4-trideoxy-L-arabinitol","","- C14 H20.67 N2 O3.33 -","- C14 H20.6667 N2 O3.33333 -","- C168 H248 N24 O40 -","12","3","CF6423","Christopher C. Harding; J.S Shane Rountree; David J. Watkin; Andrew R. Cowley; Terry D. Butters; Mark R. Wormald; Raymond A. Dwek; George W. J. Fleet","2-Acetamido-<i>N</i>-benzyl-1,4-imino-1,2,4-trideoxy-<small>L</small>-arabinitol 0.33-hydrate","Acta Crystallographica Section E","2005","61","6","o1683","o1685","10.1107/S1600536805014455","","","0.71073","MoKα","","0.0893","0.0464","","0.1116","0.0961","0.1116","","","","","","0.8135","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205886","6.6195","0.0002","10.4127","0.0003","16.3294","0.0007","90","","90","","90","","1125.53","0.07","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2R,3R,4R)-Methyl 2-bromo-3,4-dihydroxy-3,4-O-isopropylidenetetrahydrofuran- 2-carboxylate","","- C9 H13 Br O5 -","- C9 H13 Br O5 -","- C36 H52 Br4 O20 -","4","1","CF6424","Probert, Michael R.; Watkin, David J.; Stewart, Alistair J.; Storer, Richard; Fleet, George W. J.","(2<i>R</i>,3<i>R</i>,4<i>R</i>)-Methyl 2-bromo-3,4-dihydroxy-3,4-<i>O</i>-isopropylidenetetrahydrofuran-2-carboxylate","Acta Crystallographica Section E","2005","61","6","o1718","o1720","10.1107/S1600536805014467","","","0.71073","MoKα","","0.0501","0.0501","","0.097","0.097","0.097","","","","","","0.9731","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205887","10.0697","0.0013","12.7025","0.0017","10.7016","0.0014","90","","94.706","0.002","90","","1364.2","0.3","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(ethyldiphenylphosphino)ethylenediamine P,P'-dioxide","","- C30 H34 N2 O2 P2 -","- C30 H34 N2 O2 P2 -","- C60 H68 N4 O4 P4 -","2","0.5","CF6425","Sevil Irisli; Ayten Sen","<i>N</i>,<i>N</i>'-Bis(ethyldiphenylphosphino)ethylenediamine <i>P</i>,<i>P</i>'-dioxide","Acta Crystallographica Section E","2005","61","6","o1939","o1941","10.1107/S160053680501665X","","","0.71073","MoKα","","0.0741","0.0584","","","0.1342","0.1433","","","","","","1.084","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205888","12.07","0.002","7.7088","0.0015","7.3332","0.0015","90","","91.42","0.03","90","","682.1","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Poly[[dimethanolmagnesium(II)]-μ-p-phenylenedioxydiacetato]","","- C12 H16 Mg O8 -","- C12 H16 Mg O8 -","- C24 H32 Mg2 O16 -","2","0.5","CF6426","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","Poly[[dimethanolmagnesium(II)]-μ-<i>p</i>-phenylenedioxydiacetato]: a three-dimensional magnesium(II) coordination polymer","Acta Crystallographica Section E","2005","61","6","m1117","m1119","10.1107/S1600536805014625","","","0.71073","MoKα","","0.0765","0.0628","","","0.1591","0.1664","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205889","13.819","0.002","21.354","0.003","21.991","0.003","90","","128.931","0.006","90","","5048.1","1.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Diisopropyl {(4-methylbenzothiazol-2-ylamino)[4-(trifluoromethyl)phenyl]methyl}phosphonate","","- C22 H26 F3 N2 O3 P S -","- C22 H26 F3 N2 O3 P S -","- C176 H208 F24 N16 O24 P8 S8 -","8","2","CI6544","Song, Yang; Baoan, Song; Guoping, Zhang; Linhong, Jin; Deyu, Hu; Wei, Xue","Diisopropyl {(4-methylbenzothiazol-2-ylamino)[4-(trifluoromethyl)phenyl]methyl}phosphonate","Acta Crystallographica Section E","2005","61","6","o1662","o1664","10.1107/S1600536805014327","","","0.71073","MoKα","","0.2144","0.0615","","","0.1565","0.228","","","","","","0.934","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205890","16.244","0.002","7.767","0.0008","15.3043","0.0019","90","","90","","90","","1930.9","0.4","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","poly[bis(N-methylformamide)tetra-μ-thiocyanato-cadmium(II)mercury(II)]","","- C8 H10 Cd Hg N6 O2 S4 -","- C8 H10 Cd Hg N6 O2 S4 -","- C32 H40 Cd4 Hg4 N24 O8 S16 -","4","1","CI6548","Wang, Xin Qiang; Yu, Wen Tao; Xu, Dong; Zhang, Guang Hui","Polymeric bis(<i>N</i>-methylformamide)tetrathiocyanatocadmium(II)mercury(II)","Acta Crystallographica Section E","2005","61","6","m1147","m1149","10.1107/S1600536805015394","","","0.71069","MoKα","","0.0716","0.0409","","","0.0713","0.0807","","","","","","0.969","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205891","13.9158","0.0007","14.8078","0.0008","26.3807","0.0014","90","","90","","90","","5436.1","0.5","291","2","293","2","","","","","","","","3","C 2 2 21","C 2c 2","20","Incanilin","(20S,24R)-Incanilin","","- C30 H48 O4 -","- C30 H48 O4 -","- C240 H384 O32 -","8","1","CI6569","Hernández-Ortega, Simón; Parra Delgado, Hortensia; Martínez, Mariano","Incaniline (isoargentatin A) from <i>Parthenium argentatum</i>","Acta Crystallographica Section E","2005","61","6","o1921","o1923","10.1107/S1600536805016429","","","0.71073","MoKα","","0.0618","0.0494","","","0.1114","0.1166","","","","","","1.024","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205892","10.6759","0.0006","6.9487","0.0004","16.4346","0.0006","90","","102.164","0.003","90","","1191.81","0.11","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl (E)-4-(2-formylphenoxy)but-2-enoate","","- C13 H14 O4 -","- C13 H14 O4 -","- C52 H56 O16 -","4","1","CI6571","Williamson, Craig; Storey, John M. D.; Harrison, William T. A.","Ethyl (<i>E</i>)-4-(2-formylphenoxy)but-2-enoate","Acta Crystallographica Section E","2005","61","6","o1566","o1568","10.1107/S1600536805013164","","","0.71073","MoKα","","0.0847","0.0478","","","0.1091","0.1262","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205893","13.905","0.002","17.965","0.003","20.505","0.004","90","","101.026","0.007","90","","5027.7","1.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(4-Bromophenyl)-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridine- 6(7H)-one","","- C19 H16 Br N3 O -","- C19 H16 Br N3 O -","- C228 H192 Br12 N36 O12 -","12","3","CI6572","Feng Shi; Shu-Jiang Tu; Song-Lei Zhu","4-(4-Bromophenyl)-3-methyl-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridin-6(7<i>H</i>)-one","Acta Crystallographica Section E","2005","61","6","o1601","o1603","10.1107/S1600536805014029","","","0.7107","MoKα","","0.0905","0.0788","","","0.1517","0.1568","","","","","","1.13","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205894","25.429","0.009","8.209","0.005","10.502","0.006","90","","95.595","0.009","90","","2182","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-phenyl-3-(1H-1,2,4-triazol-1-yl)propan-1-one hemihydrate","","- C11 H12 N3 O1.5 -","- C11 H12 N3 O1.5 -","- C88 H96 N24 O12 -","8","1","CI6573","Jun Wan; Chun-Li Li; Xue-Mei Li; Shu-Sheng Zhang; Hong Xu; Ping-Kai Ouyang","1-Phenyl-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one hemihydrate","Acta Crystallographica Section E","2005","61","6","o1641","o1642","10.1107/S1600536805013358","","","0.71073","MoKα","","0.0552","0.0451","","","0.1155","0.1231","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205895","14.979","0.003","13.609","0.003","25.164","0.005","90","","90","","90","","5129.7","1.8","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis(5-bromo-N-cyclohexylsalicylideneaminato)nickel(II)","","- C26 H30 Br2 N2 Ni O2 -","- C26 H30 Br2 N2 Ni O2 -","- C208 H240 Br16 N16 Ni8 O16 -","8","1","CI6575","Sun, Yu-Xi; Yang, Guang; Chen, Guang; Sun, Min; Zhang, Hong-Lin","Bis(5-bromo-<i>N</i>-cyclohexylsalicylideneaminato)nickel(II): an orthorhombic polymorph","Acta Crystallographica Section E","2005","61","6","m1103","m1104","10.1107/S1600536805014339","","","0.71073","MoKα","","0.0977","0.0488","","","0.1155","0.138","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205896","14.4737","0.0005","14.6771","0.0005","15.1822","0.0006","90","","106.877","0.001","90","","3086.28","0.19","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Tetrakis(4-amino-3-methylpyridine)diisothiocyanatocadmium(II)","Tetrakis(4-amino-3-methylpyridine)diisothiocyanatocadmium(II)","","- C26 H32 Cd N10 S2 -","- C26 H32 Cd N10 S2 -","- C104 H128 Cd4 N40 S8 -","4","0.5","CI6576","Xiao-Jun Feng; Suchada Chantrapromma; Hoong-Kun Fun; Yu-Peng Tian","Tetrakis(4-amino-3-methylpyridine)diisothiocyanatocadmium(II)","Acta Crystallographica Section E","2005","61","6","m1077","m1079","10.1107/S1600536805013978","","","0.71073","MoKα","","0.0238","0.0213","","","0.0564","0.0586","","","","","","1.116","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205897","8.1669","0.0008","24.11","0.002","14.4666","0.0014","90","","104.057","0.002","90","","2763.2","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","3β-hydroxylupan-29-oic acid","2-(9-hydroxy-3a,5a,5b,8,8,11a-(hexamethylicosahydro-1H-cyclopenta[a]chrysen- 1-yl)propanoic acid","","- C30 H50 O3 -","- C30 H50 O3 -","- C120 H200 O12 -","4","2","CI6578","Pakakrong Thongdeeying; Suchada Chantrapromma; Hoong-Kun Fun; Shazia Anjum; Shamsher Ali; Chanita Ponglimanont","2-(9-Hydroxy-3a,5a,5b,8,8,11a-hexamethylicosahydro-1<i>H</i>-cyclopenta[<i>a</i>]chrysen-1-yl)propanoic acid (3β-hydroxylupan-29-oic acid)","Acta Crystallographica Section E","2005","61","6","o1861","o1863","10.1107/S1600536805015606","","","0.71073","MoKα","","0.0936","0.0531","","","0.0996","0.1168","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205898","8.5129","0.0013","30.047","0.004","11.1308","0.0018","90","","90","","90","","2847.1","0.7","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-[(4-Phenylthiazol-2-yl)hydrazonomethyl]phenol","","- C16 H13 N3 O S -","- C16 H13 N3 O S -","- C128 H104 N24 O8 S8 -","8","1","CI6579","Dinçer, Muharrem; Özdemir, Namık; Çukurovalı, Alaaddin; Yılmaz, İbrahim","2-[(4-Phenylthiazol-2-yl)hydrazonomethyl]phenol","Acta Crystallographica Section E","2005","61","6","o1712","o1714","10.1107/S1600536805014418","","","0.71073","MoKα","","0.1699","0.0494","","","0.0707","0.0965","","","","","","0.905","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205899","20.1618","0.0004","11.9426","0.0003","11.3334","0.0002","90","","92.08","0.001","90","","2727.11","0.1","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(4-methoxylbenzoato)phenyl(trimethylsilylmethyl)tin(IV)","","- C26 H30 O6 Si Sn -","- C26 H30 O6 Si Sn -","- C104 H120 O24 Si4 Sn4 -","4","1","CI6580","Lin, Sen; Fu, Zhi-Fei; Fang, Xiao-Niu; Liu, Huan-Yu","Bis(4-methoxylbenzoato)phenyl(trimethylsilylmethyl)tin(IV)","Acta Crystallographica Section E","2005","61","6","m1161","m1162","10.1107/S1600536805015370","","","0.71073","MoKα","","0.0418","0.03","","","0.0827","0.0912","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205900","13.66","0.0007","6.5247","0.0003","17.5754","0.0009","90","","111.726","0.001","90","","1455.18","0.13","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,7-Dihydroxy-6,2'-dimethoxyisoflavone","","- C17 H14 O6 -","- C17 H14 O6 -","- C68 H56 O24 -","4","1","CI6582","Nighat Sultana; M. Iqbal Choudhary; Shamsher Ali; Shazia Anjum; Hoong-Kun Fun; Atta-ur-Rahman","5,7-Dihydroxy-6,2'-dimethoxyisoflavone","Acta Crystallographica Section E","2005","61","6","o1812","o1814","10.1107/S1600536805015187","","","0.71073","MoKα","","0.0499","0.0385","","","0.099","0.1082","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205901","5.6753","0.0011","7.795","0.0016","16.368","0.003","93.02","0.03","96","0.03","90.52","0.03","719.1","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1,4-Bis(phenylsulfanyl)butane","","- C16 H18 S2 -","- C16 H18 S2 -","- C32 H36 S4 -","2","1","CI6585","Chen, Wei; Hou, Bao-Hong; Zhou, Li-Na; Wang, Jing-Kang; Li, Hong","1,4-Bis(phenylsulfanyl)butane","Acta Crystallographica Section E","2005","61","6","o1890","o1891","10.1107/S1600536805016120","","","0.71073","MoKα","","0.0929","0.0595","","","0.1661","0.2008","","","","","","0.959","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205902","7.806","0.002","9.901","0.003","29.307","0.008","90","","90","","90","","2265.1","1.1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(2-Nitrophenyl)-1H-benzimidazole","","- C13 H9 N3 O2 -","- C13 H9 N3 O2 -","- C104 H72 N24 O16 -","8","1","CI6588","Xue-Mei Li; Li-Ping Du; Ying Li; Shu-Sheng Zhang","2-(2-Nitrophenyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","6","o1902","o1903","10.1107/S1600536805016417","","","0.71073","MoKα","","0.0567","0.0438","","","0.1047","0.1129","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205903","7.0484","0.0015","10.3371","0.0019","22.174","0.004","90","","98.547","0.006","90","","1597.7","0.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-4-(4-chlorophenyl)-6-morpholinopyridine-3,5-dicarbonitrile","","- C17 H14 Cl N5 O -","- C17 H14 Cl N5 O -","- C68 H56 Cl4 N20 O4 -","4","1","CI6589","Shu-Jiang Tu; Tuan-Jie Li; Song-Lei Zhu; Xiang Zou; Qian Wang","2-Amino-4-(4-chlorophenyl)-6-morpholinopyridine-3,5-dicarbonitrile","Acta Crystallographica Section E","2005","61","6","o1883","o1884","10.1107/S1600536805016296","","","0.7107","MoKα","","0.0502","0.0409","","","0.0901","0.0952","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205904","12.857","0.003","7.066","0.0012","13.541","0.0012","90","","109.56","0.017","90","","1159.2","0.4","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Prop-2-ynyl 3-(3,4-dihydroxyphenyl)prop-2-enoate monohydrate","","- C12 H12 O5 -","- C12 H12 O5 -","- C48 H48 O20 -","4","1","CV6482","Chun-Nian Xia; Wei Zhou; Wei-Xiao Hu","Prop-2-ynyl 3-(3,4-dihydroxyphenyl)prop-2-enoate monohydrate","Acta Crystallographica Section E","2005","61","6","o1783","o1784","10.1107/S1600536805014340","","","0.71073","MoKα","","0.0606","0.0338","","","0.0863","0.1009","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205905","25.564","0.001","4.141","0.002","15","0.002","90","","103.08","0.02","90","","1546.7","0.8","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-Hydroxy-4,5-dimethylthiazole-2(3H)-thione hemihydrate","","- C5 H8 N O1.5 S2 -","- C5 H8 N O1.5 S2 -","- C40 H64 N8 O12 S16 -","8","1","CV6486","Hartung, Jens; Daniel, Kristina; Gottwald, Thomas; Svoboda, Ingrid; Fuess, Hartmut","<i>N</i>-Hydroxy-4,5-dimethylthiazole-2(3<i>H</i>)-thione hemihydrate","Acta Crystallographica Section E","2005","61","6","o1741","o1743","10.1107/S1600536805013851","","","0.71073","MoKα","","0.0461","0.0426","","","0.1157","0.1192","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205906","29.4926","0.0015","10.1678","0.0003","19.7293","0.0003","90","","115.389","0.002","90","","5344.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(dimethylformamide)-2κ^2^O-dipyridine-1κN,3κN-bis(μ-2'-salicylbenzohydrazidato)-1κ^4^O,N,N',O':2κ^2^N,O'';2κ^2^N,O'':3κ^4^O,N,N',O'-trinickel(II) dimethylformamide disolvate hemihydrate","","- C50 H57 N10 Ni3 O10.5 -","- C50 H57 N10 Ni3 O10.5 -","- C200 H228 N40 Ni12 O42 -","4","0.5","CV6487","Ming-Xing Yang; Shen Lin","Bis(dimethylformamide-2κ<i>O</i>)dipyridine-1κ<i>N</i>,3κ<i>N</i>-bis(μ-2'-salicylbenzohydrazidato)-1κ^3^<i>O</i>,<i>N</i>,<i>O</i>':2κ^2^<i>N</i>,<i>O</i>'';2κ^2^<i>N</i>,<i>O</i>'':3κ^3^<i>O</i>,<i>N</i>,<i>O</i>'-trinickel(II) dimethylformamide disolvate hemihydrate","Acta Crystallographica Section E","2005","61","6","m1095","m1096","10.1107/S1600536805013875","","","0.71073","MoKα","","0.0729","0.0471","","","0.1245","0.1371","","","","","","0.981","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205907","6.227","0.001","8.36","0.001","11.624","0.003","76","0.02","78.4","0.02","75.05","0.02","561","0.2","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","4-Methyl-5-(p-methoxyphenyl)thiazole-2(3H)-thione","","- C11 H11 N O S2 -","- C11 H11 N O S2 -","- C22 H22 N2 O2 S4 -","2","1","CV6488","Hartung, Jens; Daniel, Kristina; Svoboda, Ingrid; Fuess, Hartmut","5-(4-Methoxyphenyl)-4-methylthiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","6","o1744","o1746","10.1107/S1600536805013863","","","0.71073","MoKα","","0.1196","0.0413","","","0.07","0.0877","","","","","","0.856","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205908","10.8255","0.0003","17.9119","0.0005","15.0647","0.0004","90","","90.423","0.001","90","","2921.05","0.14","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium bis(benzene-1,2-dithiolato)(2-disulfanylbenzenethiolato)niobate","","- C26 H32 N Nb S7 -","- C26 H32 N Nb S7 -","- C104 H128 N4 Nb4 S28 -","4","1","CV6492","Petrov, Pavel A.; Kuratieva, Natalia V.; Naumov, Dmitry Yu.; Konchenko, Sergei N.","Tetraethylammonium bis(benzene-1,2-dithiolato)(2-disulfanylbenzenethiolato)niobate","Acta Crystallographica Section E","2005","61","6","m1138","m1139","10.1107/S1600536805012869","","","0.71073","MoKα","","0.0404","0.0307","","","0.0777","0.0815","","","","","","1.04","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205909","7.656","0.003","10.707","0.005","10.933","0.005","73.065","0.006","84.573","0.007","86.058","0.007","852.7","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Chloro(pyridine-4-carbonitrile-κN^1^)(1,4,7-triazacyclononane- κ^3^N,N',N'')copper(II) perchlorate","","- C12 H19 Cl2 Cu N5 O4 -","- C12 H19 Cl2 Cu N5 O4 -","- C24 H38 Cl4 Cu2 N10 O8 -","2","1","CV6493","Yu-Hu Wang; Zhao-Dong Wang; Bin Li; Jie Qu; Xin Liu; Wen Gu; Wen-Zhen Wang","Chloro(pyridine-4-carbonitrile-κ<i>N</i>^1^)(1,4,7-triazacyclononane-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')copper(II) perchlorate","Acta Crystallographica Section E","2005","61","6","m1101","m1102","10.1107/S1600536805012870","","","0.71073","MoKα","","0.0466","0.0331","","","0.0799","0.0863","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205910","10.8458","0.0006","17.0539","0.0009","25.9179","0.0013","90","","90","","90","","4793.9","0.4","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","catena-Poly[[diaqua(1,4,7,10,13,16-hexaoxacyclooctadecane)barium(II)]- μ-cyano-[dicyanoplatinum(II)]-μ-cyano]","","- C16 H28 Ba N4 O8 Pt -","- C16 H28 Ba N4 O8 Pt -","- C128 H224 Ba8 N32 O64 Pt8 -","8","1","CV6494","Olmstead, Marilyn M.; Lee, Moses A.; Stork, Jay R.","<i>catena</i>-Poly[[diaqua(1,4,7,10,13,16-hexaoxacyclooctadecane)barium(II)]-μ-cyano-[dicyanoplatinum(II)]-μ-cyano]","Acta Crystallographica Section E","2005","61","6","m1048","m1050","10.1107/S1600536805013887","","","0.71073","MoKα","","0.0291","0.018","","","0.0356","0.0394","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205911","7.5517","0.0007","11.3022","0.0012","13.4646","0.0013","90","","95.186","0.008","90","","1144.5","0.2","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Hydroxy-6-[(2-methoxyphenyl)aminomethylene]cyclohexa-2,4-dienone","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C56 H52 N4 O12 -","4","1","CV6500","Şahin, Onur; Büyükgüngör, Orhan; Albayrak, Çiğdem; Odabaşoğlu, Mustafa","2-Hydroxy-6-[(2-methoxyphenyl)aminomethylene]cyclohexa-2,4-dienone","Acta Crystallographica Section E","2005","61","6","o1579","o1581","10.1107/S160053680501319X","","","0.71073","MoKα","","0.0792","0.0379","","","0.0844","0.0958","","","","","","0.846","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205912","12.267","0.003","13.083","0.003","20.919","0.006","90","","92.423","0.005","90","","3354.3","1.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis{5-amino-3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazol-4- yl}disulfide acetonitrile disolvate","","- C26 H14 Cl4 F6 N10 S2 -","- C26 H14 Cl4 F6 N10 S2 -","- C104 H56 Cl16 F24 N40 S8 -","4","0.5","CV6501","Tang, Ri-Yuan; Zhong, Ping; Li, Shu-Yan; Hu, Mao-Lin","Bis{5-amino-3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazol-4-yl} disulfide acetonitrile disolvate","Acta Crystallographica Section E","2005","61","6","o1564","o1565","10.1107/S1600536805013085","","","0.71073","MoKα","","0.0687","0.06","","","0.1634","0.1709","","","","","","1.038","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205913","9.5674","0.0002","11.702","0.0003","22.2785","0.0004","90","","90","","90","","2494.25","0.09","150","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(10,11-Dihydrodibenz[b,f]azepin-5-yl)ethanone","","- C16 H15 N O -","- C16 H15 N O -","- C128 H120 N8 O8 -","8","2","CV6502","Basavegowda Nagaraj; Hemmige S. Yathirajan; Daniel E. Lynch","1-(10,11-Dihydrodibenz[<i>b</i>,<i>f</i>]azepin-5-yl)ethanone","Acta Crystallographica Section E","2005","61","6","o1609","o1610","10.1107/S1600536805013115","","","0.71073","MoKα","","0.0386","0.0314","","","0.0726","0.0763","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205914","9.357","0.004","12.439","0.002","13.103","0.003","116.8","0.017","108.38","0.02","80.91","0.02","1291.6","0.7","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Diphenyl 3,6-bis(4-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine-1,2-dicarboxylate","","- C28 H18 Cl2 N4 O4 -","- C28 H18 Cl2 N4 O4 -","- C56 H36 Cl4 N8 O8 -","2","1","CV6503","Guang-Xiang Zhong; Lu-Ping Lv; Guo-Wu Rao; Weixiao Hu","Diphenyl 3,6-bis(4-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine-1,2-dicarboxylate","Acta Crystallographica Section E","2005","61","6","o1552","o1553","10.1107/S1600536805013607","","","0.71073","MoKα","","0.0978","0.0347","","","0.0867","0.107","","","","","","1.02","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205915","24.083","0.003","7.784","0.003","24.461","0.004","90","","90.7","0.01","90","","4585","2","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,6-Dipropyl-N,N'-di-o-tolyl-1,2,4,5-tetrazine-1,4-dicarboxamide","","- C24 H30 N6 O2 -","- C24 H30 N6 O2 -","- C192 H240 N48 O16 -","8","1","CV6504","Luping Lv; Guan-Xiang Zhong; Wei-Xiao Hu; Wei Zhou; Hai-Bo Shi","3,6-Dipropyl-<i>N,N</i>'-di-<i>o</i>-tolyl-1,2,4,5-tetrazine-1,4-dicarboxamide","Acta Crystallographica Section E","2005","61","6","o1622","o1623","10.1107/S1600536805013930","","","0.71073","MoKα","","0.1613","0.0674","","","0.2269","0.261","","","","","","1.189","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205916","6.952","0.002","8.522","0.003","30.12","0.009","90","","90","","90","","1784.5","1","292","","292","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Carboxymethyl-2-(hydroxyquinolin-4-ylmethyl)-5-vinyl-1- azoniabicyclo[2.2.2]octane","","- C21 H24 N2 O3 -","- C21 H24 N2 O3 -","- C84 H96 N8 O12 -","4","1","CV6507","Li-Ping Zhang; Jian Lv; Yi , Li; Yong-Mei Wang","1-Carboxylatomethyl-2-(hydroxyquinolin-4-ylmethyl)-5-vinyl-1-azoniabicyclo[2.2.2]octane, a zwitterion of the Cinchona alkaloid complex","Acta Crystallographica Section E","2005","61","6","o1855","o1857","10.1107/S1600536805015709","","","0.71073","MoKα","","0.093","0.0605","","","0.1075","0.117","","","","","","1.084","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205917","8.6112","0.0009","21.669","0.002","8.1152","0.0008","90","","106.82","0.002","90","","1449.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(1H-1,2,3-Benzotriazol-1-yl)-1-(4-methoxyphenyl)propan-1-one","","- C16 H15 N3 O2 -","- C16 H15 N3 O2 -","- C64 H60 N12 O8 -","4","1","CV6508","Shu-Sheng Zhang; Jun Wan; Ying Li; Xue-Mei Li; Hong Xu; Ping-Kai Ouyang","3-(1<i>H</i>-1,2,3-Benzotriazol-1-yl)-1-(4-methoxyphenyl)propan-1-one","Acta Crystallographica Section E","2005","61","6","o1793","o1794","10.1107/S1600536805015126","","","0.71073","MoKα","","0.0519","0.0419","","","0.1078","0.1149","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205918","9.1761","0.0008","9.5962","0.0008","11.9113","0.001","72.526","0.001","78.339","0.002","82.942","0.002","977.63","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N,N-Diphenyl-2-(quinolin-8-yloxy)acetamide monohydrate","","- C23 H20 N2 O3 -","- C23 H20 N2 O3 -","- C46 H40 N4 O6 -","2","1","CV6509","Yong-Hong Wen; Shu-Sheng Zhang; Mao-Jie Li; Xue-Mei Li","<i>N</i>,<i>N</i>-Diphenyl-2-(quinolin-8-yloxy)acetamide monohydrate","Acta Crystallographica Section E","2005","61","6","o1807","o1809","10.1107/S1600536805015357","","","0.71073","MoKα","","0.064","0.0463","","","0.108","0.1202","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205919","11.0566","0.0016","11.3596","0.0017","11.4916","0.0017","117.554","0.002","99.937","0.003","102.83","0.002","1182.7","0.3","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","Propyl 3,5-dinitrobenzoate","","- C10 H10 N2 O6 -","- C10 H10 N2 O6 -","- C40 H40 N8 O24 -","4","2","CV6511","Jin Longfei; Xiao Fengping","Propyl 3,5-dinitrobenzoate","Acta Crystallographica Section E","2005","61","6","o1826","o1827","10.1107/S160053680501528X","","","0.71073","MoKα","","0.0833","0.0557","","","0.1325","0.1515","","","","","","0.973","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205920","10.074","0.002","5.6289","0.0012","13.969","0.003","90","","110.074","0.004","90","","744","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2-(3-Benzoylthioureido)ethanoic acid dimethyl sulfoxide solvate","","- C12 H16 N2 O4 S2 -","- C12 H16 N2 O4 S2 -","- C24 H32 N4 O8 S4 -","2","1","CV6512","Ngah, Nurziana; Shah, Nabihah M.; Kassim, Mohammad B.; Yamin, Bohari M.","2-(3-Benzoylthioureido)ethanoic acid dimethyl sulfoxide solvate","Acta Crystallographica Section E","2005","61","6","o1910","o1912","10.1107/S1600536805016491","","","0.71073","MoKα","","0.037","0.033","","","0.076","0.077","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205921","8.822","0.0011","11.641","0.002","21.504","0.003","75.865","0.011","87.731","0.01","72.474","0.012","2040.7","0.5","120","2","120","2","","","","","","","","3","P -1","-P 1","2","Osajin","5-hydroxy-3-(3-hydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-enyl)- 4H,8H-pyrano[2,3-h]chromen-4-one","","- C25 H24 O5 -","- C25 H24 O5 -","- C100 H96 O20 -","4","2","CV6513","Lišková, Margita; Marek, Jaromír; Jankovská, Dagmar; Sukupová, Lada; Žemlička, Milan; Vančo, Jan","Osajin","Acta Crystallographica Section E","2005","61","6","o1848","o1850","10.1107/S1600536805015667","","","0.71073","MoKα","","0.1057","0.0486","","","0.109","0.1247","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205922","8.996","0.005","9.387","0.005","14.137","0.005","96.55","0.005","103.623","0.005","101.722","0.005","1119.5","0.9","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Carbonyl(triphenylarsine)(tropolonato)rhodium(I).","","- C26 H20 As O3 Rh -","- C26 H20 As O3 Rh -","- C52 H40 As2 O6 Rh2 -","2","1","CV6514","Steyl, Gideon; Roodt, Andreas","Carbonyl(triphenylarsine)(tropolonato)rhodium(I)","Acta Crystallographica Section E","2005","61","6","m1212","m1214","10.1107/S1600536805015679","","","0.71069","MoKα","","0.136","0.07","","","0.1612","0.1863","","","","","","0.921","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205923","5.5952","0.0005","7.1862","0.0006","30.882","0.003","90","","94.108","0.002","90","","1238.52","0.19","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,4'-Dinonyl-2,2'-bipyridine","","- C28 H44 N2 -","- C28 H44 N2 -","- C56 H88 N4 -","2","0.5","CV6517","Fujihara, Takashi; Suzuki, Hajime; Nagasawa, Akira","4,4'-Dinonyl-2,2'-bipyridine","Acta Crystallographica Section E","2005","61","6","o1867","o1868","10.1107/S1600536805015849","","","0.71073","MoKα","","0.0718","0.0606","","","0.1471","0.154","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205924","35.937","0.002","8.3365","0.0004","25.432","0.001","90","","126.076","0.001","90","","6158.1","0.5","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(8-hydroxyquinolinato-κ^2^N,O) lead(II)","","- C18 H12 N2 O2 Pb -","- C18 H12 N2 O2 Pb -","- C288 H192 N32 O32 Pb16 -","16","2","DN6216","Zhu, Li-Hong; Zeng, Ming-Hua; Ng, Seik Weng","Bis(quinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)lead(II)","Acta Crystallographica Section E","2005","61","6","m1082","m1084","10.1107/S1600536805011852","","","0.71073","MoKα","","0.051","0.03","","","0.065","0.075","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205925","15.327","0.002","12.436","0.002","8.543","0.002","90","","113.5","0.02","90","","1493.3","0.5","173","2","446","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","2,2':6',2'':6'',2'''-quaterpyridine","2-(6-(6-(pyridin-2-yl)pyridin-2-yl)pyridin-2-yl)pyridine","","- C20 H14 N4 -","- C20 H14 N4 -","- C80 H56 N16 -","4","0.5","DN6221","M. Rolland; A. van der Lee; M. Barboiu","Dimorphism of 2,2':6',2'':6'',2'''-quaterpyridine","Acta Crystallographica Section E","2005","61","6","o1880","o1882","10.1107/S1600536805015618","","","0.71073","MoKα","","0.1087","0.0762","","","0.2145","0.2464","","","","","","1.141","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205926","15.256","0.002","5.8527","0.0005","15.751","0.0019","90","","95.373","0.01","90","","1400.2","0.3","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Hydroxy-2-[4-(2-hydroxyethyl)piperazin-1-ylmethyl]-6-methylpyran-4-one","","- C13 H20 N2 O4 -","- C13 H20 N2 O4 -","- C52 H80 N8 O16 -","4","1","DN6223","Ocak Ískeleli, Nazan; Işık, Şamil; Dilsiz Aytemir, Mutlu","3-Hydroxy-2-[4-(2-hydroxyethyl)piperazin-1-ylmethyl]-6-methylpyran-4-one","Acta Crystallographica Section E","2005","61","6","o1947","o1949","10.1107/S1600536805016697","","","0.71073","MoKα","","0.0699","0.0329","","","0.0681","0.0735","","","","","","0.783","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205927","5.7208","0.0009","7.9144","0.0008","17.447","0.002","90","","101.682","0.013","90","","773.58","0.17","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","sarcosine ammonium nitrate","N-methylglycine ammonium nitrate","","- C3 H11 N3 O5 -","- C3 H11 N3 O5 -","- C12 H44 N12 O20 -","4","1","ER6009","Rodrigues, V. H.; Ramos Silva, M.; Matos Beja, A.; Paixão, J. A.; Costa, M.M.R.R.","Sarcosine ammonium nitrate","Acta Crystallographica Section E","2005","61","6","o1631","o1633","10.1107/S1600536805012031","","","0.71074","MoKα","","0.0901","0.0413","","","0.1102","0.1298","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205928","15.096","0.003","6.1108","0.0012","32.164","0.006","90","","90","","90","","2967.1","1","296","2","296","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","catena-Poly[[aquacadmium(II)]bis(μ-4,5-diphenyl-1H-imidazole-1-acetate- κ^3^N:O,O')]","","- C34 H28 Cd N4 O5 -","- C34 H28 Cd N4 O5 -","- C136 H112 Cd4 N16 O20 -","4","1","ER6011","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua","<i>catena</i>-Poly[[aquacadmium(II)]bis(μ-4,5-diphenyl-1<i>H</i>-imidazole-1-acetate)-κ^3^<i>N</i>:<i>O</i>,<i>O</i>';κ^3^<i>O</i>,<i>O</i>':<i>N</i>]","Acta Crystallographica Section E","2005","61","6","m1012","m1014","10.1107/S160053680501295X","","","0.71073","MoKα","","0.039","0.0342","","","0.0889","0.0914","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205929","7.5645","0.0008","12.2332","0.0012","13.5558","0.0014","90","","102.867","0.002","90","","1222.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[2-(3-Chlorophenyl)ethyl]pyridine-2-carbonitrile","","- C14 H11 Cl N2 -","- C14 H11 Cl N2 -","- C56 H44 Cl4 N8 -","4","1","ER6014","Xiangping, Li; Haiyong, Chen; Xiaomin, Wang; Changxin Zhou; Yu Zhao","3-[2-(3-Chlorophenyl)ethyl]pyridine-2-carbonitrile","Acta Crystallographica Section E","2005","61","6","o1810","o1811","10.1107/S1600536805013681","","","0.71073","MoKα","","0.0659","0.0483","","","0.1186","0.1273","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205930","10.353","0.003","6.107","0.001","10.882","0.002","90","","102.23","0.02","90","","672.4","0.3","303","2","303","2","","","","","","","","5","P 1 21 1","P 2yb","4","","4-(4-Chlorophenyl)-2-(trichloromethylsulfanyl)-1,3-thiazole","","- C10 H5 Cl4 N S2 -","- C10 H5 Cl4 N S2 -","- C20 H10 Cl8 N2 S4 -","2","1","FL6158","Hartung, Jens; Schmidt, Philipp; Svoboda, Ingrid; Fuess, Hartmut","4-(4-Chlorophenyl)-2-(trichloromethylsulfanyl)-1,3-thiazole","Acta Crystallographica Section E","2005","61","6","o1736","o1737","10.1107/S160053680501305X","","","0.71073","MoKα","","0.0502","0.0321","","","0.0768","0.0847","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205931","7.3037","0.0005","15.287","0.001","14.985","0.001","90","","92.735","0.007","90","","1671.19","0.19","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(4-Methoxyphenyl)-4-methyl-2-thioxo-2,3-dihydro-1,3-thiazol-3-yl benzoate","","- C18 H15 N O3 S2 -","- C18 H15 N O3 S2 -","- C72 H60 N4 O12 S8 -","4","1","FL6159","Hartung, Jens; Altermann, Sabine; Svoboda, Ingrid; Fuess, Hartmut","5-(4-Methoxyphenyl)-4-methyl-2-thioxo-2,3-dihydro-1,3-thiazol-3-yl benzoate at 100K","Acta Crystallographica Section E","2005","61","6","o1738","o1740","10.1107/S1600536805013061","","","0.71073","MoKα","","0.0474","0.0368","","","0.0856","0.09","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205932","13.939","0.005","6.878","0.005","19.533","0.004","90","","114.279","0.017","90","","1707","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[(2-chloro-3,4-dimethoxybenzylidene)amino]adamantane","","- C19 H24 Cl N O2 -","- C19 H24 Cl N O2 -","- C76 H96 Cl4 N4 O8 -","4","1","FL6162","Şamil Işık; Yavuz Köysal; Ebubekir Septiog̃lu; Ünsal Çalış","1-[(2-Chloro-3,4-dimethoxybenzylidene)amino]adamantane","Acta Crystallographica Section E","2005","61","6","o1851","o1852","10.1107/S1600536805015680","","","0.71069","MoKα","","0.0638","0.0451","","","0.1137","0.1224","","","","","","1.03","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205933","14.2591","0.0011","9.9334","0.0005","12.7325","0.001","90","","107.61","0.006","90","","1718.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(2-chloro-3,4-dimethoxybenzylidene)amino]adamantane","","- C19 H24 Cl N O2 -","- C19 H24 Cl N O2 -","- C76 H96 Cl4 N4 O8 -","4","1","FL6163","Şamil Işık; Yavuz Köysal; Ebubekir Septiog̃lu; Ünsal Çalış","2-[(2-Chloro-3,4-dimethoxybenzylidene)amino]adamantane","Acta Crystallographica Section E","2005","61","6","o1853","o1854","10.1107/S1600536805015692","","","0.71073","MoKα","","0.0557","0.0432","","","0.1179","0.1254","","","","","","1.048","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205934","16.0203","0.0009","7.5367","0.0004","11.1773","0.0006","90","","103.597","0.001","90","","1311.73","0.12","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,12-Diferrocenyldodecane","","- C32 H42 Fe2 -","- C32 H42 Fe2 -","- C64 H84 Fe4 -","2","0.5","FL6164","Bequeath, Danielle M.; Porter, Richard L.; Lufaso, Michael W.; Wagner, Timothy R.; Kusnic, Rachel L.; Zeller, Matthias; Curtin, Larry S.","1,12-Diferrocenyldodecane at 100K","Acta Crystallographica Section E","2005","61","6","m1070","m1072","10.1107/S160053680501367X","","","0.71073","MoKα","","0.0272","0.026","","","0.0738","0.0748","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205935","5.668","0.001","11.549","0.001","13.743","0.002","91.95","0.01","101.74","0.01","100.64","0.01","863.3","0.2","293","2","","","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-4-chlorophenoxyacetato-κ^2^O,O')dimolybdenum(II)","","- C32 H24 Cl4 Mo2 O12 -","- C32 H24 Cl4 Mo2 O12 -","- C32 H24 Cl4 Mo2 O12 -","1","0.5","FL6166","Liwporncharoenvong, Teerayuth; Luck, Rudy L.","Tetrakis(μ-4-chlorophenoxyacetato-κ^2^<i>O</i>,<i>O</i>')dimolybdenum(II)","Acta Crystallographica Section E","2005","61","6","m1191","m1193","10.1107/S1600536805015795","","","0.71069","MoKα","","","0.0259","","","","0.0632","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205936","6.3265","0.0013","11.047","0.002","9.003","0.0018","90","","109.14","0.03","90","","594.4","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-Methoxy-2-methyl-N-phenylaniline","","- C14 H15 N O -","- C14 H15 N O -","- C28 H30 N2 O2 -","2","1","FL6168","Si-Qian Wang; Zhen-Feng Zhang; Xin Wang; Mei-Yu Huang; Ying-Yan Jiang","4-Methoxy-2-methyl-<i>N</i>-phenylaniline","Acta Crystallographica Section E","2005","61","6","o1872","o1874","10.1107/S1600536805015783","","","0.71073","MoKα","","0.0376","0.0337","","","0.0955","0.0973","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205937","5.723","0.0013","3.6965","0.0009","10.244","0.002","90","","97.689","0.007","90","","214.76","0.08","158","","158","","","","","","","","","3","P 1 c 1","P -2yc","7","","1H-Imidazole-4-carbonitrile","","- C4 H3 N3 -","- C4 H3 N3 -","- C8 H6 N6 -","2","1","GH6011","Less, Gregory B.; Rasmussen, Paul G.; Kampf, Jeff W.","1<i>H</i>-Imidazole-4-carbonitrile","Acta Crystallographica Section E","2005","61","6","o1704","o1706","10.1107/S1600536805014509","","","0.71073","MoKα","","0.0326","0.0315","","","0.0786","0.0794","","","","","","1.131","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205938","3.726","0.002","7.511","0.005","29.983","0.018","90","","91.937","0.012","90","","838.6","0.9","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-nitrophenylpropiolic acid","4-nitrophenylpropynoic acid","","- C9 H5 N O4 -","- C9 H5 N O4 -","- C36 H20 N4 O16 -","4","1","GH6020","Dinabandhu Das; Gautam R. Desiraju; Ram K. R. Jetti; Ronald Boese","A rare <i>syn</i>‒<i>anti</i> catemer in 4-nitrophenylpropiolic acid","Acta Crystallographica Section E","2005","61","6","o1588","o1589","10.1107/S1600536805013310","","","0.71073","MoKα","","0.1127","0.0584","","","0.1405","0.1632","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205939","6.8221","0.0003","23.023","0.001","7.6719","0.0003","90","","107.176","0.002","90","","1151.25","0.09","293","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","8-Chloro-10,11-dihydro-4-aza-5H-dibenzo[a,d]cyclohepten-5-one","","- C14 H10 Cl N O -","- C14 H10 Cl N O -","- C56 H40 Cl4 N4 O4 -","4","1","GH6021","Wenyan Lin; Xinyue Zhang; Hongxiang Sun; Changxin Zhou; Yu Zhao","8-Chloro-10,11-dihydro-4-aza-5<i>H</i>-dibenzo[<i>a</i>,<i>d</i>]cyclohepten-5-one","Acta Crystallographica Section E","2005","61","6","o1762","o1763","10.1107/S1600536805014492","","","0.7107","MoKα","","","0.041","","","","0.142","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205940","21.1211","0.0006","15.0486","0.0004","15.5611","0.0005","90","","97.181","0.001","90","","4907.2","0.2","150","1","150","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(μ-2,6-diformyl-4-methylphenolato)bis[bis(2,6-diformyl-4- methylphenolato)neodymium(III)]","","- C54 H42 Nd2 O18 -","- C54 H42 Nd2 O18 -","- C216 H168 Nd8 O72 -","4","0.5","HB6156","Singh-Wilmot, Marvadeen A.; Kahwa, Ishenkumba A.; Lough, Alan J.","Bis(μ-2,6-diformyl-4-methylphenolato)bis[bis(2,6-diformyl-4-methylphenolato)neodymium(III)]","Acta Crystallographica Section E","2005","61","6","m1009","m1011","10.1107/S160053680500591X","","","0.71073","MoKα","","0.0625","0.0401","","","0.0839","0.094","","","","","","1.074","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205941","9.295","0.004","10.639","0.005","11.258","0.005","114.603","0.008","112.54","0.008","95.065","0.008","893.2","0.7","298","2","293","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-hydroxo-bis[aqua(1,10-phenanthroline-κ^2^N,N')copper(II)] terephthalate octahydrate","","- C32 H42 Cu2 N4 O16 -","- C32 H42 Cu2 N4 O16 -","- C32 H42 Cu2 N4 O16 -","1","0.5","HB6188","Zhang, Hong-Mei; Lu, Li-Ping; Feng, Si-Si; Qin, Shi-Dong; Zhu, Miao-Li","Di-μ-hydroxo-bis[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)] terephthalate octahydrate","Acta Crystallographica Section E","2005","61","6","m1027","m1029","10.1107/S160053680501322X","","","0.71073","MoKα","","0.1805","0.0984","","","0.1936","0.2533","","","","","","0.835","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205942","11.8707","0.0004","21.2746","0.0006","11.2385","0.0004","90","","117.639","0.008","90","","2514.3","0.2","295","3","295","3","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(4-hydroxybenzoato-κO)(1,10-phenanthroline-κ^2^N,N')cobalt(II) monohydrate","","- C26 H24 Co N2 O9 -","- C26 H24 Co N2 O9 -","- C104 H96 Co4 N8 O36 -","4","1","HB6189","Jian-Rong Su; Jian-Ming Gu; Duan-Jun Xu","Diaquabis(4-hydroxybenzoato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N,N</i>')cobalt(II) monohydrate","Acta Crystallographica Section E","2005","61","6","m1033","m1035","10.1107/S1600536805013000","","","0.71069","MoKα","","0.037","0.03","","","0.073","0.076","","","","","","1.02","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2205943","10.3822","0.0006","17.6359","0.001","11.4516","0.0007","90","","105.191","0.001","90","","2023.5","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triaqua(2,2'-bipyridine)(4-sulfonatobenzoato)manganese(II) monohydrate","","- C17 H20 Mn N2 O9 S -","- C17 H20 Mn N2 O9 S -","- C68 H80 Mn4 N8 O36 S4 -","4","1","HB6190","Zhang, Li-Ping; Zhu, Long-Guan","Triaqua(2,2'-bipyridine)(4-sulfonatobenzoato)manganese(II) monohydrate containing seven-coordinate manganese","Acta Crystallographica Section E","2005","61","6","m1036","m1038","10.1107/S1600536805013243","","","0.71073","MoKα","","0.0788","0.0765","","","0.1383","0.1394","","","","","","1.299","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205944","8.6773","0.001","11.585","0.002","12.068","0.002","77.137","0.014","79.072","0.014","79.279","0.014","1148.1","0.3","150","","150","","","","","","","","","8","P -1","-P 1","2","","μ-Oxo-bis{chloro[N-(2-methoxyethyl)-N,N-bis(pyridin-2-ylmethyl)amine- κ^4^-N,N',N'',O]iron(III)} bis(trifluoromethanesulfonate) acetonitrile disolvate","","- C36 H44 Cl2 F6 Fe2 N8 O9 S2 -","- C36 H44 Cl2 F6 Fe2 N8 O9 S2 -","- C36 H44 Cl2 F6 Fe2 N8 O9 S2 -","1","0.5","HB6191","Kooijman, Huub; Son, Martin van; Tanase, Stefania; Bouwman, Elisabeth; Reedijk, Jan; Spek, Anthony L.","μ-Oxo-bis{chloro[<i>N</i>-(2-methoxyethyl)-<i>N</i>,<i>N</i>-bis(pyridin-2-ylmethyl)amine-κ^4^-<i>N</i>,<i>N</i>',<i>N</i>'',<i>O</i>]iron(III)} bis(trifluoromethanesulfonate) acetonitrile disolvate","Acta Crystallographica Section E","2005","61","6","m1042","m1044","10.1107/S1600536805013553","","","0.71073","MoKα","","0.0876","0.0643","","","0.1669","0.1845","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205945","10.568","0.007","18.258","0.013","5.025","0.004","90","","90","","90","","969.5","1.2","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","cobalt zinc phosphate tetrahydrate","","- Co H8 O12 P2 Zn2 -","- Co H8 O12 P2 Zn2 -","- Co4 H32 O48 P8 Zn8 -","4","0.5","HB6192","Wu, Wen-Yuan; Liang, Xiao-Qiang; Li, Yi-Zhi","CoZn~2~(PO~4~)~2~.4H~2~O, a cobalt-doped modification of hopeite","Acta Crystallographica, Section E","2005","61","6","i105","i107","10.1107/S1600536805014078","","","0.71073","MoKα","","0.0398","0.0322","","","0.0761","0.0772","","","","","","1.075","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2205946","10.562","0.003","18.224","0.005","5.0133","0.0015","90","","90","","90","","965","0.5","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","nickel zinc phosphate tetrahydrate","","- H8 Ni O12 P2 Zn2 -","- H8 Ni O12 P2 Zn2 -","- H32 Ni4 O48 P8 Zn8 -","4","0.5","HB6193","Wu, Wen-Yuan; Liang, Xiao-Qiang; Li, Yi-Zhi","NiZn~2~(PO~4~)~2~.4H~2~O, a nickel-doped modification of hopeite","Acta Crystallographica, Section E","2005","61","6","i108","i110","10.1107/S160053680501408X","","","0.71073","MoKα","","0.0361","0.0273","","","0.0561","0.0571","","","","","","1.079","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2205947","7.9951","0.001","8.1835","0.0011","9.6545","0.0013","69.312","0.015","69.676","0.015","86.164","0.016","553.03","0.15","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","di-μ-chloro-bis[(η^6^-benzene)chlororuthenium(II)] chloroform disolvate","","- C14 H14 Cl10 Ru2 -","- C14 H14 Cl10 Ru2 -","- C14 H14 Cl10 Ru2 -","1","0.5","HB6194","Canivet, Jérôme; Therrien, Bruno; Süss-Fink, Georg","Di-μ-chloro-bis[(η^6^-benzene)chlororuthenium(II)] chloroform disolvate","Acta Crystallographica Section E","2005","61","6","m1090","m1091","10.1107/S1600536805014157","","","0.71073","MoKα","","0.0272","0.0229","","","0.0607","0.0794","","","","","","1.204","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205948","23.432","0.007","16.752","0.005","16.134","0.005","90","","94.372","0.005","90","","6315","3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis{chloro[tris(1H-benzimidazol-2-ylmethyl)amine]cobalt(II)} tetrachlorocobalt(II) methanol tetrasolvate","","- C52 H58 Cl6 Co3 N14 O4 -","- C52 H58 Cl6 Co3 N14 O4 -","- C208 H232 Cl24 Co12 N56 O16 -","4","0.5","HB6195","Li, Xue-Mei; Feng, Si-Si; Zhang, Hong-Mei; Su, Ying-Lan; Qin, Shi-Dong; Lu, Li-Ping; Xue, Wan-Hua; Zhu, Miao-Li","Bis{[tris(1<i>H</i>-benzimidazol-2-ylmethyl)amine]chlorocobalt(II)} tetrachlorocobaltate(II) methanol tetrasolvate","Acta Crystallographica Section E","2005","61","6","m1067","m1069","10.1107/S1600536805014066","","","0.71073","MoKα","","0.1973","0.0917","","","0.2237","0.2593","","","","","","0.941","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205949","22.075","0.003","22.075","0.003","22.075","0.003","90","","90","","90","","10757","3","100","2","100","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","sodium tris(acetylacetonato-κ^2^O,O')manganese(II)","","- C15 H21 Mn Na O6 -","- C15 H21 Mn Na O6 -","- C360 H504 Mn24 Na24 O144 -","24","1","HB6197","Saha, Amrita; Musie, Ghezai; Powell, Douglas R.","Sodium tris(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')manganese(II)","Acta Crystallographica Section E","2005","61","6","m1144","m1146","10.1107/S1600536805015205","","","0.71073","MoKα","","0.0438","0.0386","","","0.1079","0.1129","","","","","","1.007","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205950","11.5641","0.0005","10.2592","0.0005","12.7556","0.0006","90","","90.3721","0.0012","90","","1513.27","0.12","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaqua(5-nitro-1H-benzimidazole-κN^3^)(oxydiacetato-κO,O',O'')cobalt(II) monohydrate","","- C11 H15 Co N3 O10 -","- C11 H15 Co N3 O10 -","- C44 H60 Co4 N12 O40 -","4","1","HB6199","Bing-Yu Zhang; Jia-Geng Liu; Duan-Jun Xu","Diaqua(5-nitro-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)(oxydiacetato-κ<i>O</i>,<i>O</i>',<i>O</i>'')cobalt(II) monohydrate","Acta Crystallographica Section E","2005","61","6","m1128","m1130","10.1107/S1600536805014947","","","0.71073","MoKα","","0.053","0.042","","","0.106","0.11","","","","","","1.097","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2205951","8.2904","0.0006","14.2195","0.0008","16.955","0.0007","90","","90.615","0.004","90","","1998.6","0.2","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Chlorobis(dimethylglyoximato)(isonicotinic acid)cobalt(III) monohydrate","","- C14 H21 Cl Co N5 O7 -","- C14 H20 Cl Co N5 O7 -","- C56 H80 Cl4 Co4 N20 O28 -","4","2","HB6201","Shen, Xu-Jie; Xiao, Li-Ping; Xu, Ru-Ren","Chlorobis(dimethylglyoximato)(isonicotinic acid)cobalt(III) monohydrate","Acta Crystallographica Section E","2005","61","6","m1156","m1158","10.1107/S1600536805015424","","","0.71073","MoKα","","0.0701","0.0442","","","0.0771","0.0846","","","","","","0.896","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205952","15.8286","0.0011","21.2483","0.0016","6.7247","0.0009","90","","90","","90","","2261.7","0.4","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","poly[[aquatri-μ~3~-iminodiacetato-cadmium(III)] trihydrate]","","- C12 H23 Cd3 N3 O16 -","- C12 H21 Cd3 N3 O16 -","- C48 H84 Cd12 N12 O64 -","4","0.5","HB6206","Bing-Xin Liu; Duan-Jun Xu","A two-dimensional cadmium(II)‒iminodiacetate polymer","Acta Crystallographica Section E","2005","61","6","m1218","m1220","10.1107/S1600536805015801","","","0.71073","MoKα","","0.034","0.033","","","0.061","0.061","","","","","","1.266","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2205953","22.2083","0.0002","12.8446","0.0001","33.9272","0.0005","90","","107.568","0.0005","90","","9226.57","0.18","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorotris(triphenylphosphine)ruthenium(II) dichloromethane hemisolvate","","- C54.5 H46 Cl3 P3 Ru -","- C54.5 H46 Cl3 P3 Ru -","- C436 H368 Cl24 P24 Ru8 -","8","1","HB6207","Cowley, Andrew R.; Dilworth, Jonathan R.; Maresca von Beckh W., Carlo A.","Dichlorotris(triphenylphosphine)ruthenium(II) dichloromethane hemisolvate","Acta Crystallographica Section E","2005","61","6","m1237","m1239","10.1107/S1600536805016272","","","0.71073","MoKα","","0.0825","0.0387","","0.0777","0.0412","0.0412","","","","","","1.113","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2205954","6.47","0.002","7.814","0.002","12.035","0.002","97.7","0.03","101.9","0.03","104.88","0.03","564.1","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-cyclohexyliminomethylphenolato)zinc(II)","","- C26 H32 N2 O2 Zn -","- C26 H32 N2 O2 Zn -","- C26 H32 N2 O2 Zn -","1","0.5","HB6208","Hou, Han-Na","Bis[2-(cyclohexyliminomethyl)phenolato]zinc(II)","Acta Crystallographica Section E","2005","61","6","m1197","m1198","10.1107/S1600536805015990","","","0.71073","MoKα","","0.0396","0.0387","","","0.104","0.105","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205955","6.1837","0.0011","15.147","0.002","17.536","0.002","90","","90","","90","","1642.5","0.4","133","2","133","2","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","2,5,2'',5''-Tetramethyl-p-terphenyl","","- C22 H22 -","- C22 H22 -","- C88 H88 -","4","1","HB6209","Jones, Peter G.; Kuś, Piotr; Pasewicz, Anna","2,5,2'',5''-Tetramethyl-<i>p</i>-terphenyl","Acta Crystallographica Section E","2005","61","6","o1895","o1896","10.1107/S1600536805016259","","","0.71073","MoKα","","0.0545","0.045","","","0.1167","0.1222","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205956","9.016","0.002","11.1672","0.0014","13.243","0.003","78.47","0.01","80.58","0.03","84.82","0.01","1286.5","0.5","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Benzimidazolium bis(1H-benzimidazole-κN^3^)chloro(oxydiacetato-κ^3^O,O',O'')cadium(II)","","- C25 H23 Cd Cl N6 O5 -","- C25 H23 Cd Cl N6 O5 -","- C50 H46 Cd2 Cl2 N12 O10 -","2","1","HB6210","Gaduo; Jian-Rong Su; Duan-Jun Xu","Benzimidazolium bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)chloro(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')cadmium(II)","Acta Crystallographica Section E","2005","61","6","m1231","m1233","10.1107/S1600536805016478","","","0.71073","MoKα","","0.024","0.021","","","0.052","0.053","","","","","","1.08","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205957","6.4667","0.0002","10.5817","0.0005","17.1328","0.0008","90","","96.411","0.002","90","","1165.04","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[NH3(CH2)2NH(CH2)2NH3].(AlF6).2H2O","diethylenetriamine hexafluoroaluminate dihydrate","","- C4 H20 Al F6 N3 O2 -","- C4 H20 Al F6 N3 O2 -","- C16 H80 Al4 F24 N12 O8 -","4","1","HG6160","K. Adil; J. Marrot; M. Leblanc; V. Maisonneuve","Diethylenetriaminium hexafluoroaluminate dihydrate","Acta Crystallographica Section E","2005","61","6","m1178","m1180","10.1107/S160053680501559X","","","0.71073","MoKα","","0.0755","0.0629","","","0.1949","0.207","","","","","","1.121","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205958","18.2331","0.0017","15.3467","0.0014","9.5134","0.0009","90","","90","","90","","2662","0.4","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","3,10,18,25,31,32-hexaazapentacyclo[25.3.1.1^12,16^.0^4,9^.0^19,24^]dotriconta- 1(30),4,6,8,12,14,16(32),19,21,23,27(31),28-dodecaene-2,11,17,26-tetrone dimethylformamide solvate","","- C29 H25 N7 O5 -","- C29 H25 N7 O5 -","- C116 H100 N28 O20 -","4","0.5","HG6173","Jun Lin; Hao Lin; Jing-Wen Chen; Zi-Jian Guo","Bis[<i>N</i>,<i>N</i>'-<i>o</i>-phenylenebis(pyridine-2,6-dicarboxamide)] dimethylformamide solvate","Acta Crystallographica Section E","2005","61","6","o1592","o1594","10.1107/S1600536805013322","","","0.71073","MoKα","","0.0914","0.0465","","","0.0891","0.0977","","","","","","0.963","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205959","15.5003","0.0004","6.4005","0.0001","20.1552","0.0005","90","","110.04","0.0011","90","","1878.53","0.07","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(cycloheptylaminium) hydrogenarsenate monohydrate","","- C14 H35 As N2 O5 -","- C14 H35 As N2 O5 -","- C56 H140 As4 N8 O20 -","4","1","HG6174","Todd, Malcolm J.; Harrison, William T. A.","Bis(cycloheptylaminium) hydrogenarsenate monohydrate","Acta Crystallographica Section E","2005","61","6","m1024","m1026","10.1107/S1600536805012912","","","0.71073","MoKα","","0.0394","0.0284","","","0.063","0.0681","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205960","11.5494","0.0007","6.1399","0.0004","11.6601","0.0006","90","","92.213","0.003","90","","826.23","0.08","120","2","120","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Propane-1,2-diaminium selenite monohydrate","","- C3 H14 N2 O4 Se -","- C3 H14 N2 O4 Se -","- C12 H56 N8 O16 Se4 -","4","1","HG6175","Todd, Malcolm J.; Harrison, William T. A.","Propane-1,2-diaminium selenite monohydrate","Acta Crystallographica Section E","2005","61","6","o1538","o1540","10.1107/S160053680501278X","","","0.71073","MoKα","","0.039","0.0299","","","0.0644","0.068","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205961","9.4575","0.0008","21.398","0.002","7.1568","0.0006","90","","110.639","0.001","90","","1355.4","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[bis[aquacopper(I)-μ-4,4'-bipyridine-κ^2^N:N'] terephthalate dihydrate]","","- C28 H28 Cu2 N4 O8 -","- C28 H28 Cu2 N4 O8 -","- C56 H56 Cu4 N8 O16 -","2","0.5","HG6176","Zhang, Xue-Li; Lu, Yu-Juan; Li, Ji-Zhen; Ng, Seik Weng","<i>catena</i>-Poly[bis[aquacopper(I)-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] terephthalate dihydrate]","Acta Crystallographica Section E","2005","61","6","m1061","m1062","10.1107/S1600536805013929","","","0.71073","MoKα","","0.054","0.042","","","0.106","0.113","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205962","11.568","0.001","9.78","0.001","7.6255","0.0007","90","","91.286","0.003","90","","862.49","0.14","295","2","295","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Hexaaquazinc(II) bis(6-hydroxypyridine-3-carboxylate)","","- C12 H20 N2 O12 Zn -","- C12 H20 N2 O12 Zn -","- C24 H40 N4 O24 Zn2 -","2","0.25","HG6177","Zhang, Xue-Li; Lu, Yu-Juan; Li, Ji-Zhen; Ng, Seik Weng","Hexaaquazinc(II) bis(6-hydroxypyridine-3-carboxylate)","Acta Crystallographica Section E","2005","61","6","m1063","m1064","10.1107/S1600536805013917","","","0.71073","MoKα","","0.038","0.038","","","0.106","0.107","","","","","","1.12","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205963","7.0588","0.0006","8.3638","0.0006","10.569","0.0008","112.301","0.001","94.096","0.001","104.93","0.001","547.73","0.07","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[bis(μ-1,10-phenanthrolin-2-olato- κ^3^N,N':O)dicopper(I,II)(Cu—Cu)]-μ-chloro-copper(I)-μ-chloro]","","- C24 H14 Cl2 Cu3 N4 O2 -","- C24 H14 Cl2 Cu3 N4 O2 -","- C24 H14 Cl2 Cu3 N4 O2 -","1","0.5","HG6178","Zheng, Yan-Zhen; Ng, Seik Weng","<i>catena</i>-Poly[[bis(μ-1,10-phenanthrolin-2-olato-κ^3^<i>N,N</i>':<i>O</i>)dicopper(I,II)(<i>Cu{—</i>Cu})]-μ-chlorocopper(I)-μ-chloro]","Acta Crystallographica Section E","2005","61","6","m1030","m1032","10.1107/S1600536805013632","","","0.71073","MoKα","","0.035","0.032","","","0.088","0.091","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205964","7.38","0.003","8.139","0.003","13.781","0.005","78.224","0.005","87.913","0.006","68.28","0.005","752.1","0.5","298","2","298","2","","","","","","","","3","P -1","-P 1","2","Methyl linderone","4,5-Dimethoxy-2-(1-methoxy-3-phenylallylidine)cyclcopent-4-ene-1,3-dione","","- C17 H16 O5 -","- C17 H16 O5 -","- C34 H32 O10 -","2","1","HG6179","Syah, Yana M.; Suastri, Nyoman S.; Latip, Jalifah; Yamin, Bohari M.","4,5-Dimethoxy-2-(1-methoxy-3-phenylallylidene)cyclopent-4-ene-1,3-dione (methyl linderone)","Acta Crystallographica Section E","2005","61","6","o1530","o1531","10.1107/S1600536805012833","","","0.71073","MoKα","","0.062","0.054","","","0.143","0.149","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205965","8.2148","0.0008","14.31","0.002","16.816","0.0017","90","","90","","90","","1976.8","0.4","296","1","296","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(2R,3S,4R)-1,2,4,5-Tetraacetoxy-3-methoxypentyl acetate","","- C16 H24 O11 -","- C16 H24 O11 -","- C64 H96 O44 -","4","1","HG6181","V. Valdivia, Verónica; Sosa-Rivadeneyra, Martha; Quintero, Leticia; Bernès, Sylvain","(2<i>R</i>,3<i>S</i>,4<i>R</i>)-1,2,4,5-Tetraacetoxy-3-methoxypentyl acetate","Acta Crystallographica Section E","2005","61","6","o1643","o1645","10.1107/S1600536805013036","","","0.71073","MoKα","","0.0584","0.0395","","","0.098","0.1079","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205966","5.8352","0.0011","8.0741","0.0014","34.311","0.007","90","","90","","90","","1616.5","0.5","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-[3-(1,2,4-Triazol-1-yl)propionyl]phenyl 4-fluorobenzoate","","- C18 H14 F N3 O3 -","- C18 H14 F N3 O3 -","- C72 H56 F4 N12 O12 -","4","1","HG6182","Wei-Hua Li; Guo-Dong Si; Bao-Rong Hou; Zhi-Gang Yu; Fa-Qian Liu; Yong-Qi Qin","4-[3-(1,2,4-Triazol-1-yl)propionyl]phenyl 4-fluorobenzoate","Acta Crystallographica Section E","2005","61","6","o1788","o1789","10.1107/S1600536805014881","","","0.71073","MoKα","","0.0783","0.0365","","","0.0754","0.0925","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205967","4.516","0.001","11.618","0.002","11.481","0.002","90","","91.43","0.02","90","","602.2","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-[Bis(4,5-hydroxymethyl)-1,2,3-triazol-1-ylmethyl]thymine","","- C10 H13 N5 O4 -","- C10 H13 N5 O4 -","- C20 H26 N10 O8 -","2","1","HG6184","Stash, Adam I.; Zavodnik, Valery E.; Zavgorodny, Sergei G.; Gurskaya, Galina V.; Tsirelson, Vladimir G.","1-[4,5-Bis(hydroxymethyl)-1,2,3-triazol-1-ylmethyl]thymine","Acta Crystallographica Section E","2005","61","6","o1721","o1723","10.1107/S1600536805014650","","","0.71073","MoKα","","0.0389","0.0303","","","0.0835","0.0864","","","","","","1.036","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205968","6.572","0.0009","14.3913","0.0002","30.5468","0.0003","90","","90","","90","","2889.1","0.4","295","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl 3,5-O-bis(4-chlorobenzoyl)-2-deoxy-α-D-erythro-ribofuranoside","","- C29 H34 Cl2 O6 -","- C29 H34 Cl2 O6 -","- C116 H136 Cl8 O24 -","4","1","HG6185","Guo-Ming Yang; Zhi-Cai Shang; Yun Wang; Qin-Sen Yu","(1<i>R</i>,2<i>S</i>,5<i>R</i>)-2-Isopropyl-5-methylcyclohexyl 3,5-bis-<i>O</i>-(4-chlorobenzoyl)-2-deoxy-α-<small>D</small>-<i>erythro</i>-ribofuranoside","Acta Crystallographica Section E","2005","61","6","o1963","o1964","10.1107/S1600536805015503","","","0.71073","MoKα","","","0.0368","","","","0.0725","","","","","","0.991","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205969","9.854","0.001","12.316","0.001","12.488","0.001","79.928","0.01","77.248","0.01","66.719","0.01","1351.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","12-Bromo-1,2,3,4-tetrahydro-1,4-ethanoantracen-11-ol","","- C16 H15 Br O -","- C16 H15 Br O -","- C64 H60 Br4 O4 -","4","2","HG6187","Çoruh, Ufuk; Altundaş, Aliye; Menzek, Abdullah; García-Granda, Santiago","12-Bromo-1,2,3,4-tetrahydro-1,4-ethanoanthracen-11-ol","Acta Crystallographica Section E","2005","61","6","o1869","o1871","10.1107/S160053680501576X","","","0.71073","MoKα","","0.0418","0.0376","","","0.1006","0.1038","","","","","","1.098","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205970","7.336","0.004","6.607","0.004","10.092","0.006","90","","96.387","0.009","90","","486.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","2-chloro-4-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidine","","- C9 H9 Cl N4 -","- C9 H9 Cl N4 -","- C18 H18 Cl2 N8 -","2","0.5","HG6189","Wei-Min Liu; You-Quan Zhu; Yi-Feng Wang; Gong-Chun Li; Hua-Zheng Yang","2-Chloro-4-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)pyrimidine","Acta Crystallographica Section E","2005","61","6","o1821","o1822","10.1107/S160053680501531X","","","0.71073","MoKα","","0.0519","0.0358","","","0.0947","0.106","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205971","10.2654","0.0015","13.515","0.002","17.23","0.003","90","","90","","90","","2390.4","0.6","294","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,3-Dihydro-2,2-dimethylbenzofuran-7-yl N-methylcarbamate","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C96 H120 N8 O24 -","8","2","HG6190","Liang-Zhong Xu; Guan-Ping Yu; Shuang-Hua Yang","2,3-Dihydro-2,2-dimethylbenzofuran-7-yl <i>N</i>-methylcarbamate","Acta Crystallographica Section E","2005","61","6","o1924","o1926","10.1107/S1600536805016387","","","0.71073","MoKα","","0.0796","0.0407","","","0.0899","0.1085","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205972","11.028","0.002","10.4955","0.0009","11.116","0.005","90","","90.37","0.03","90","","1286.6","0.6","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis[μ-N-(2,6-dimethylphenyl)acetamidato]bis[dimethylaluminium","","- C24 H36 Al2 N2 O2 -","- C24 H36 Al2 N2 O2 -","- C48 H72 Al4 N4 O4 -","2","0.5","HG6191","John Fawcett; Gregory A. Solan","Bis[μ-<i>N</i>-(2,6-dimethylphenyl)acetamidato]bis(dimethylaluminium)","Acta Crystallographica Section E","2005","61","6","m1210","m1211","10.1107/S1600536805015941","","","0.71073","MoKα","","0.1046","0.0641","","","0.1485","0.1897","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205973","18.856","0.004","9.311","0.0019","5.183","0.001","90","","101.04","0.03","90","","893.1","0.3","120","2","120","2","","","","","","","","4","C 1 2 1","C 2y","5","(1R*,2R*)-Di-tert-butyl N,N'-(cyclohexane-1,2-diyl)dicarbamate","(1R*,2R*)-Di-tert-butyl N,N'-(cyclohexane-1,2-diyl)dicarbamate","","- C16 H30 N2 O4 -","- C16 H30 N2 O4 -","- C32 H60 N4 O8 -","2","0.5","HG6193","Light, Mark E.; Andrea Ragusa; Jeremy D. Kilburn","(1<i>R</i>*,2<i>R</i>*)-Di-<i>tert</i>-butyl <i>N</i>,<i>N</i>'-(cyclohexane-1,2-diyl)dicarbamate","Acta Crystallographica Section E","2005","61","6","o1956","o1958","10.1107/S1600536805016715","","","0.71073","MoKα","","0.0413","0.0354","","","0.0758","0.0781","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205974","12.3563","0.0002","8.32","0.0002","11.6818","0.0003","90","","106.275","0.001","90","","1152.82","0.05","90","0.2","90","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2,5-Dichlorophenyl)-N'-[(E)-3-thienylmethylene]hydrazine","","- C11 H8 Cl2 N2 S -","- C11 H8 Cl2 N2 S -","- C44 H32 Cl8 N8 S4 -","4","1","HG6195","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","<i>N</i>-(2,5-Dichlorophenyl)-<i>N</i>'-[(<i>E</i>)-3-thienylmethylene]hydrazine","Acta Crystallographica Section E","2005","61","6","o1907","o1909","10.1107/S160053680501634X","","","0.71073","MoKα","","0.0547","0.0377","","","0.1002","0.1089","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205975","9.3172","0.0007","11.5055","0.0009","16.3424","0.0013","104.677","0.006","105.307","0.006","103.098","0.006","1551.6","0.2","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","1,3,5-Tris(2-isopropylphenoxymethyl)benzene","","- C36 H42 O3 -","- C36 H42 O3 -","- C72 H84 O6 -","2","1","HK6003","Deveci, Özlem; Işık, Şamil; Akdemir, Nesuhi; Kantar, Cihan; Ağar, Erbil","1,3,5-Tris(2-isopropylphenoxymethyl)benzene","Acta Crystallographica Section E","2005","61","6","o1724","o1725","10.1107/S1600536805014406","","","0.71073","MoKα","","0.1135","0.0463","","","0.1184","0.1406","","","","","","0.845","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205976","5.1815","0.0004","26.045","0.0019","20.5735","0.0015","90","","91.302","0.002","90","","2775.7","0.4","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","carbamazepine furfural hemisolvate","[5H-dibenz[b,f]azepine-5-carboxamide]2-furan carboxaldehyde hemisolvate","","- C17.5 H14 N2 O2 -","- C17.5 H14 N2 O2 -","- C140 H112 N16 O16 -","8","2","HK6007","Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","Carbamazepine furfural hemisolvate","Acta Crystallographica Section E","2005","61","6","o1777","o1779","10.1107/S1600536805014984","","","0.6902","synchrotron","","0.0947","0.0565","","","0.1315","0.1507","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205977","7.346","0.002","14.306","0.004","8.396","0.002","90","","113.447","0.004","90","","809.5","0.4","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Chloro-2,6-bis(hydroxymethyl)phenol","","- C8 H9 Cl O3 -","- C8 H9 Cl O3 -","- C32 H36 Cl4 O12 -","4","1","HK6008","Chu, Zhao-Lian; Huang, Wei; Gou, Shao-Hua","4-Chloro-2,6-bis(hydroxymethyl)phenol","Acta Crystallographica Section E","2005","61","6","o1624","o1626","10.1107/S1600536805014054","","","0.71073","MoKα","","0.055","0.0391","","","0.0831","0.0886","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205978","10.17","0.003","14.934","0.004","29.568","0.008","90","","90","","90","","4491","2","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","bis[(+)-(1R,4R)-3-(trifluoroacetyl)camphorato- κ^2^O,O'][bis(trimethylsilyl)amido-κN](1,3,5-trimethyl-1,3,5- triazacyclohexane-κ^3^N,N',N'')cerium(III)","","- C36 H61 Ce F6 N4 O4 Si2 -","- C36 H61 Ce F6 N4 O4 Si2 -","- C144 H244 Ce4 F24 N16 O16 Si8 -","4","1","HK6011","Niemeyer, Mark; Cristoffers, Jens; Michael Rössle","An optically active heteroleptic cerium camphorate: [bis(trimethylsilyl)amido-κ<i>N</i>]bis[(+)-(1<i>R</i>,4<i>R</i>)-3-(trifluoroacetyl)camphorato-κ^2^<i>O</i>,<i>O</i>'](1,3,5-trimethyl-1,3,5-triazacyclohexane-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')cerium(III)","Acta Crystallographica Section E","2005","61","6","m1207","m1209","10.1107/S1600536805016193","","","0.71073","MoKα","","0.053","0.041","","","0.097","0.103","","","","","","1.47","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205979","10.0617","0.0004","14.6001","0.0006","7.5491","0.0003","90","","98.045","0.001","90","","1098.06","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[dimethyltin(IV)]-μ-benzene-1,4-dicarboxylato]","","- C10 H10 O4 Sn -","- C10 H10 O4 Sn -","- C40 H40 O16 Sn4 -","4","1","HK6012","Gong, Ya-Qiong; Wang, Rui-Hu; Lou, Ben-Yong; Hong, Mao-Chun","<i>catena</i>-Poly[[dimethyltin(IV)]-μ-benzene-1,4-dicarboxylato]","Acta Crystallographica Section E","2005","61","6","m1226","m1227","10.1107/S1600536805016466","","","0.71073","MoKα","","0.0411","0.0315","","","0.0761","0.0802","","","","","","0.983","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205980","18.033","0.005","39.553","0.005","7.265","0.005","90","","90","","90","","5182","4","295","","295","","","","","","","","","6","F d d 2","F 2 -2d","43","Bis(adeninium) hexachlorostannate(IV) hydrochloride hydrate","","","- C10 H22 Cl8 N10 O4 Sn -","- C10 H22 Cl8 N10 O4 Sn -","- C80 H176 Cl64 N80 O32 Sn8 -","8","0.5","IS6062","Bouacida, Sofiane; Hocine, Merazig; Beghidja, Adel; Beghidja, Chahrazed","Bis(adeninium) hexachlorostannate(IV) dichloride tetrahydrate","Acta Crystallographica Section E","2005","61","6","m1153","m1155","10.1107/S1600536805015163","","","0.71073","MoKα","","0.0291","0.0266","","","0.0597","0.061","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205981","13.9","0.002","13.9","0.002","16.809","0.003","90","","90","","120","","2812.6","0.8","293","2","293","2","","","","","","","","5","P 64","P 64","172","","Tris(4,4',5,5'-tetramethyl-2,2'-biimidazole)zinc(II) dinitrate","","- C30 H42 N14 O6 Zn -","- C30 H42 N14 O6 Zn -","- C90 H126 N42 O18 Zn3 -","3","0.5","IS6066","Ru-Qiang Zou; Qiang Xu","Tris(4,4',5,5'-tetramethyl-2,2'-biimidazole)zinc(II) dinitrate","Acta Crystallographica Section E","2005","61","6","m1075","m1076","10.1107/S1600536805013954","","","0.71073","MoKα","","0.0592","0.0428","","","0.1034","0.111","","","","","","0.963","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205982","6.0329","0.0005","9.4215","0.001","33.796","0.004","90","","90","","90","","1920.9","0.3","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(6R,7aS)-1,3,5,6,7,7a-Hexahydro-3-(2-hydroxyphenyl)-1,1- diphenylpyrrolo[1,2-c][1,3]oxazol-6-ol","","- C24 H23 N O3 -","- C24 H23 N O3 -","- C96 H92 N4 O12 -","4","1","IS6069","Zongxuan Shen; Ding Yi; Yawen Zhang; De-Chun Zhang","(6<i>R</i>,7a<i>S</i>)-1,3,5,6,7,7a-Hexahydro-3-(2-hydroxyphenyl)-1,1-diphenylpyrrolo[1,2-<i>c</i>][1,3]oxazol-6-ol","Acta Crystallographica Section E","2005","61","6","o1715","o1717","10.1107/S1600536805014303","","","0.7107","MoKα","","0.0444","0.0413","","","0.0909","0.0924","","","","","","1.15","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205983","9.7934","0.001","8.4835","0.0009","20.509","0.002","90","","91.098","0.002","90","","1703.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,6-Dibenzoyl-1,3-dimethylbenzene","","- C22 H18 O2 -","- C22 H18 O2 -","- C88 H72 O8 -","4","1","IS6070","Wu, Wen-Yuan; Li, Yong-Xiu; Li, Yi-Zhi","4,6-Dibenzoyl-1,3-dimethylbenzene","Acta Crystallographica Section E","2005","61","6","o1828","o1829","10.1107/S1600536805015497","","","0.71073","MoKα","","0.086","0.0547","","","0.1171","0.125","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205984","10.8281","0.0019","10.8281","0.0019","19.043","0.004","90","","90","","90","","2232.7","0.7","293","2","293","2","","","","","","","","6","P 43","P 4cw","78","","Sodium [1,2-bis(2-methyl-2-oxopropanamido)benzene](tetrahydrofuran)manganese(III) methanol solvate","","- C19 H28 Mn N2 Na O6 -","- C19 H28 Mn N2 Na O6 -","- C76 H112 Mn4 N8 Na4 O24 -","4","1","IS6072","Berggren, Gustav; Anderlund, Magnus F.; Magnuson, Ann; Åkermark, Björn; Eriksson, Lars","Sodium [1,2-bis(2-methyl-2-oxopropanamido)benzene](tetrahydrofuran)manganese(III) methanol solvate","Acta Crystallographica Section E","2005","61","6","m1169","m1171","10.1107/S1600536805015230","","","0.71073","MoKα","","0.048","0.0363","","","0.0778","0.082","","","","","","0.976","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205985","10.536","0.002","19.225","0.005","9.5","0.002","90","","97.67","0.02","90","","1907.1","0.7","298","","298","","","","","","","","","5","P 1 21 1","P 2yb","4","","(+)-(4aR,9aS)-O-(4-Bromobenzoyl)-N-(3-methylanthracen-9-ylidene)hydroxylamine","","- C22 H20 Br N O2 -","- C22 H20 Br N O2 -","- C88 H80 Br4 N4 O8 -","4","2","IS6073","Ohba, Shigeru; Ishida, Naoyuki; Kato, Dai-ichiro; Miyamoto, Kenji; Ohta, Hiromichi","(+)-(4a<i>R</i>,9a<i>S</i>)-<i>O</i>-(4-Bromobenzoyl)-<i>N</i>-(3-methylanthracen-9-ylidene)hydroxylamine","Acta Crystallographica Section E","2005","61","6","o1620","o1621","10.1107/S1600536805013966","","","0.71073","MoKα","","","0.0626","","","","0.2314","","","","","","0.983","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205986","5.2223","0.0013","11.781","0.003","22.738","0.005","90","","90","","90","","1398.9","0.6","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(9S)-2-(3-Benzoylthioureido)-3-methylbutyric acid","","- C13 H16 N2 O3 S -","- C13 H16 N2 O3 S -","- C52 H64 N8 O12 S4 -","4","1","IS6074","Ngah, Nurziana; Shah, Nabihah M.; Kassim, Mohammad B.; Yamin, Bohari M.","(2<i>S</i>)-2-(3-Benzoylthioureido)-3-methylbutyric acid","Acta Crystallographica Section E","2005","61","6","o1767","o1768","10.1107/S1600536805014662","","","0.71073","MoKα","","0.037","0.035","","","0.088","0.09","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205987","9.429","0.002","13.055","0.003","13.51","0.003","95.995","0.004","100.673","0.004","96.272","0.004","1611.2","0.6","203.2","","","","","","","","","","","10","P -1","-P 1","2","","Carbonyl(η^5^-cyclopentadienyl)(trimethylsilyl isocyanide)(triphenylphosphine)iron(II) trifluoromethanesulfonate dichloromethane hemisolvate","","- C29.5 H30 Cl F3 Fe N O4 P S Si -","- C29.5 H30 Cl F3 Fe N O4 P S Si -","- C59 H60 Cl2 F6 Fe2 N2 O8 P2 S2 Si2 -","2","1","IS6075","Hiroshi Nakazawa; Masumi Itazaki; Mari Owaribe","Carbonyl(η^5^-cyclopentadienyl)(trimethylsilyl isocyanide)(triphenylphosphine)iron(II) trifluoromethanesulfonate dichloromethane hemisolvate","Acta Crystallographica Section E","2005","61","6","m1172","m1173","10.1107/S1600536805015308","","","0.7107","MoKα","","","0.061","","","","0.154","","","","","","1.037","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205988","15.1206","0.0006","18.5827","0.0008","24.89","0.001","90","","90.033","0.002","90","","6993.6","0.5","203.2","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Carbonyl(η^5^-cyclopentadienyl)(isocyanotriphenylborate- κC)(triphenylphosphine-κP)iron(II)","","- C43 H35 B Fe N O P -","- C43 H35 B Fe N O P -","- C344 H280 B8 Fe8 N8 O8 P8 -","8","2","IS6076","Hiroshi Nakazawa; Masumi Itazaki; Mari Owaribe","Carbonyl(η^5^-cyclopentadienyl)(isocyanotriphenylborato-κ<i>C</i>)(triphenylphosphine-κ<i>P</i>)iron(II)","Acta Crystallographica Section E","2005","61","6","m1166","m1168","10.1107/S1600536805015369","","","0.7107","MoKα","","","0.0704","","","","0.1165","","","","","","1.161","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205989","8.436","0.001","10.8759","0.0012","12.1904","0.0014","73.9052","0.0018","85.9455","0.0019","81.3899","0.0019","1062","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","4-TPST","2,4,6-Tris(4-pyridylmethylsulfanyl)-1,3,5-triazine monohydrate","","- C21 H20 N6 O S3 -","- C21 H20 N6 O S3 -","- C42 H40 N12 O2 S6 -","2","1","IS6077","Amoore, Jarrod J. M.; Kepert, Cameron J.","2,4,6-Tris(4-pyridylmethylsulfanyl)-1,3,5-triazine monohydrate","Acta Crystallographica Section E","2005","61","6","o1900","o1901","10.1107/S1600536805016132","","","0.71073","MoKα","","0.04","0.0325","","","0.0783","0.0856","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205990","5.549","0.002","17.097","0.007","12.606","0.005","90","","92.647","0.01","90","","1194.7","0.8","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Sulfachloropyridazine","4-amino-N-(6-chloro-3-pyridazinyl)-benzenesulfnamide","","- C10 H9 Cl N4 O2 S -","- C10 H9 Cl N4 O2 S -","- C40 H36 Cl4 N16 O8 S4 -","4","1","IS6078","Yan-Shu Tan; Zhen-Feng Chen; Hong Liang; Yong Zhang","Sulfachloropyridazine","Acta Crystallographica Section E","2005","61","6","o1842","o1844","10.1107/S1600536805015576","","","0.7107","MoKα","","0.0491","0.0433","","","0.0965","0.0997","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205991","7.1738","0.0014","6.3367","0.0013","14.782","0.003","90","","90","","90","","672","0.2","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","3,4-Methylenedioxy-benzaldehyde","3,4-Methylenedioxybenzaldehyde","","- C8 H6 O3 -","- C8 H6 O3 -","- C32 H24 O12 -","4","0.5","IS6080","Wang, Shui; Wang, Jing-Kang; Chen, Dong-Xiu","3,4-Methylenedioxybenzaldehyde","Acta Crystallographica Section E","2005","61","6","o1888","o1889","10.1107/S160053680501593X","","","0.71073","MoKα","","0.0535","0.0433","","","0.1131","0.1187","","","","","","0.987","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205992","8.4419","0.0004","8.5266","0.0002","22.3912","0.0004","90","","90.584","0.0011","90","","1611.65","0.09","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(1H-imidazole-κN^3^)(D,L-malato-κ^3^O,O',O'')nickel(II)","","- C13 H16 N6 Ni O5 -","- C13 H16 N6 Ni O5 -","- C52 H64 N24 Ni4 O20 -","4","1","IS6082","Dong-Dong Lin; Duan-Jun Xu","Tris(1<i>H</i>-imidazole-κ<i>N</i>^3^)(<small>DL</small>-malato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')nickel(II)","Acta Crystallographica Section E","2005","61","6","m1215","m1217","10.1107/S1600536805016004","","","0.71073","MoKα","","0.044","0.037","","","0.086","0.089","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205993","8.9283","0.0012","7.4852","0.0012","20.273","0.003","90","","97.032","0.011","90","","1344.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Acetyl-3-(benzoylamino)-1-benzofuran","","- C17 H13 N O3 -","- C17 H13 N O3 -","- C68 H52 N4 O12 -","4","1","JH6004","Ocak Ískeleli, Nazan; Kazak, Canan; Kırılmış, Cumhur; Koca, Murat","2-Acetyl-3-(benzoylamino)-1-benzofuran","Acta Crystallographica Section E","2005","61","6","o1571","o1573","10.1107/S1600536805013073","","","0.71073","MoKα","","0.1803","0.0728","","","0.1572","0.1954","","","","","","0.835","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205994","5.4773","0.0015","11.326","0.003","13.726","0.004","86.366","0.004","78.985","0.004","88.921","0.004","834.1","0.4","298","2","273","2","","","","","","","","6","P -1","-P 1","2","","Diaquadiisothiocyanatobis(pyridine N-oxide)cobalt(II)","","- C12 H14 Co N4 O4 S2 -","- C12 H14 Co N4 O4 S2 -","- C24 H28 Co2 N8 O8 S4 -","2","1","JH6006","Shi, Jing Min; Liu Zhe; Lu, Jian Jun; Liu, Lian Dong","Diaquadiisothiocyanatobis(pyridine <i>N</i>-oxide)cobalt(II)","Acta Crystallographica Section E","2005","61","6","m1133","m1134","10.1107/S1600536805014832","","","0.71073","MoKα","","0.0489","0.0432","","","0.115","0.1238","","","","","","1.142","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205995","8.124","0.001","7.2832","0.0005","16.3599","0.0019","90","","101.298","0.009","90","","949.24","0.18","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Benzyl 2-(2-chloro-4,5-dicyanophenoxy)benzoate","","- C22 H13 Cl N2 O3 -","- C22 H13 Cl N2 O3 -","- C44 H26 Cl2 N4 O6 -","2","1","JH6007","Ocak Ískeleli, Nazan; Ag̃ar, Ayşen","Benzyl 2-(2-chloro-4,5-dicyanophenoxy)benzoate","Acta Crystallographica Section E","2005","61","6","o1942","o1943","10.1107/S1600536805016648","","","0.71073","MoKα","","0.0621","0.0373","","","0.0978","0.1053","","","","","","0.922","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205996","8.168","0.003","10.933","0.003","28.446","0.008","90","","90","","90","","2540.2","1.4","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","24-Methylenecholest-4-ene-3β,6β-diol","","- C28 H46 O2 -","- C28 H46 O2 -","- C112 H184 O8 -","4","1","JH6008","Hui Lin; Shi-Hai Xu; Xiang-Chao Zeng; Xiao-Jian Liao","24-Methylenecholest-4-ene-3β,6β-diol","Acta Crystallographica Section E","2005","61","6","o1959","o1960","10.1107/S1600536805016740","","","0.71073","MoKα","","0.1019","0.0613","","","0.1777","0.2153","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205997","7.491","0.003","23.458","0.008","14.302","0.005","90","","104.803","0.006","90","","2429.8","1.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(2,2'-bipyridine-κ^2^N,N')chlorocopper(II) tetrafluoroborate dichloromethane solvate","","- C21 H18 B Cl3 Cu F4 N4 -","- C21 H18 B Cl3 Cu F4 N4 -","- C84 H72 B4 Cl12 Cu4 F16 N16 -","4","1","KP6047","Linfang Jia; Wenfu Fu; Qi Yin; Mingming Yu; Junfeng Zhang; Zhanxian Li","Bis(2,2'-bipyridine-κ^2^<i>N,N</i>')chlorocopper(II) tetrafluoroborate dichloromethane solvate","Acta Crystallographica Section E","2005","61","6","m1039","m1041","10.1107/S1600536805013760","","","0.71073","MoKα","","0.1307","0.0737","","","0.1883","0.2227","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205998","9.171","0.003","9.428","0.002","16.783","0.002","77.19","0.01","75.44","0.01","75.11","0.01","1338.1","0.6","294","2","294","2","","","","","","","","5","P -1","-P 1","2","Nafimidone hemihydrate hemihydrochloride","3-methyl-1-[2-(2-naphthyloxy)ethyl]-1H-pyrazol-5-ol hydrochloride monohydrate","","- C30 H27 Cl N4 O3 -","- C30 H27 Cl N4 O3 -","- C60 H54 Cl2 N8 O6 -","2","1","LH6407","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Nafimidone hemihydrate hemihydrochloride","Acta Crystallographica Section E","2005","61","6","o1532","o1533","10.1107/S160053680501158X","","","1.54178","CuKα","","0.0642","0.0525","","","0.1554","0.1623","","","","","","1.18","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205999","11.2668","0.001","16.4542","0.0012","10.8049","0.0009","90","","111.798","0.002","90","","1859.9","0.3","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","10-Cyclopropyl-9-(4-methoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine- 1,8-dione","","- C23 H25 N O3 -","- C23 H25 N O3 -","- C92 H100 N4 O12 -","4","1","LH6409","Shu-Jiang Tu; Yan Zhang; Xiao-Jing Zhang","10-Cyclopropyl-9-(4-methoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2005","61","6","o1885","o1887","10.1107/S1600536805016168","","","0.7107","MoKα","","0.0678","0.0562","","","0.1341","0.1415","","","","","","1.113","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206000","7.1306","0.0014","16.417","0.003","10.2","0.002","90","","99.74","0.03","90","","1176.8","0.4","295","3","295","3","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[triaquacadmium(II)]-μ-4-carboxylatophenoxyacetato- κ^4^O,O':O'',O''']","","- C9 H12 Cd O8 -","- C9 H12 Cd O8 -","- C36 H48 Cd4 O32 -","4","1","LH6410","Gao, Shan; Gu, Chang-Sheng; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Jing-Gui","<i>catena</i>-Poly[[triaquacadmium(II)]-μ-4-carboxylatophenoxyacetato-κ^4^<i>O,O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2005","61","6","m1092","m1094","10.1107/S1600536805012572","","","0.71073","MoKα","","0.0332","0.0306","","","0.0808","0.0825","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206001","28.83","0.005","10.896","0.002","8.879","0.002","90","","90","","90","","2789.2","0.9","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Nafazatrom","3-methyl-1-[2-(2-naphthyloxy)ethyl]-1H-pyrazol-5-ol","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C128 H128 N16 O16 -","8","1","LH6412","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","The enol form of nafazatrom","Acta Crystallographica Section E","2005","61","6","o1544","o1545","10.1107/S1600536805012766","","","1.54178","CuKα","","0.1502","0.0469","","","0.1135","0.1759","","","","","","1.133","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206002","10.331","0.003","11.628","0.004","11.64","0.004","90","","116.034","0.005","90","","1256.4","0.7","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-(2,4-Dihydroxybenzoyl)benzoic acid","","- C14 H10 O5 -","- C14 H10 O5 -","- C56 H40 O20 -","4","1","LH6413","Li, Yang; Ge, Feng-Yan; Chen, Li-Gong; Dong, Chuan-Ming; Yan, Xi-Long; Duan, Er-Hong; Zeng, Tao; Zhang, Yue-Cheng; Bai, Guo-Yi","2-(2,4-Dihydroxybenzoyl)benzoic acid","Acta Crystallographica Section E","2005","61","6","o1769","o1770","10.1107/S1600536805014844","","","0.71073","MoKα","","0.0785","0.0485","","","0.1225","0.1459","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206003","5.739","0.002","33.684","0.005","6.003","0.002","90","","106.79","0.04","90","","1111","0.6","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","Pargyline","N-benzyl-N-methylprop-2-yn-1-aminium chloride","","- C11 H14 Cl N -","- C11 H14 Cl N -","- C44 H56 Cl4 N4 -","4","2","LH6414","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Pargyline hydrochloride: a monoclinic form","Acta Crystallographica Section E","2005","61","6","o1595","o1597","10.1107/S1600536805013309","","","1.54178","CuKα","","0.087","0.0718","","","0.196","0.2064","","","","","","1.522","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206004","5.958","0.002","11.039","0.003","33.596","0.005","90","","90","","90","","2209.6","1","294","2","294","2","","","","","","","","4","P b c 21","P 2c -2b","29","Pargyline","N-benzyl-N-methylprop-2-yn-1-aminium chloride","","- C11 H14 Cl N -","- C11 H14 Cl N -","- C88 H112 Cl8 N8 -","8","2","LH6415","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Pargyline hydrochloride, a monoamine oxidase inhibitor: an orthorhombic form","Acta Crystallographica Section E","2005","61","6","o1598","o1600","10.1107/S1600536805013292","","","1.54178","CuKα","","0.0789","0.0647","","","0.1609","0.1669","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206005","19.6924","0.0004","6.2383","0.0001","23.4415","0.0007","90","","112.474","0.001","90","","2661.01","0.11","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(Anthracen-9-ylmethyl)dimethylamine","","- C17 H17 N -","- C17 H17 N -","- C136 H136 N8 -","8","2","LH6418","Howie, R. Alan; Wardell, Solange M. S. V.","(Anthracen-9-ylmethyl)dimethylamine at 120 K","Acta Crystallographica Section E","2005","61","6","o1686","o1688","10.1107/S1600536805014200","","","0.71073","MoKα","","0.0977","0.0554","","","0.1219","0.14","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206006","9.7305","0.0009","10.5319","0.001","10.4759","0.001","90","","90.475","0.011","90","","1073.54","0.18","193","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H9 Cl N2 -","- C2 H9 Cl N2 -","- C16 H72 Cl8 N16 -","8","2","LH6419","Merkoulov, Alexei; Harms, Klaus; Sundermeyer, Jörg","1,1-Dimethylhydrazinium chloride","Acta Crystallographica Section E","2005","61","6","o1800","o1801","10.1107/S1600536805014856","","","0.71073","MoKα","","","0.0271","","","","0.0618","","","","","","0.945","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206007","11.4352","0.0015","6.1405","0.0005","11.5469","0.0014","90","","97.785","0.015","90","","803.33","0.16","193","2","","","","","","","","","","5","P 1 21 1","P 2yb","4","","Methyl (1R,3R)-6-tert-butoxycarbonylamino-1,5-dioxo-2,3-dihydro-5H-1,3- thiazolo[3,2-a]pyridine-3-carboxylate","","- C14 H18 N2 O6 S -","- C14 H18 N2 O6 S -","- C28 H36 N4 O12 S2 -","2","1","LH6420","Seger, Harald; Marsch, Michael; Geyer, Armin; Harms, Klaus","(1<i>R</i>,3<i>R</i>)-Methyl 6-<i>tert</i>-butoxycarbonylamino-1,5-dioxo-2,3-dihydro-5<i>H</i>-1,3-thiazolo[3,2-<i>a</i>]pyridine-3-carboxylate","Acta Crystallographica Section E","2005","61","6","o1798","o1799","10.1107/S1600536805014868","","","0.71073","MoKα","","","0.0242","","","","0.0574","","","","","","0.989","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206008","10.2706","0.0001","12.5577","0.0002","13.3708","0.0002","90","","90","","90","","1724.5","0.04","123","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","O^1^,O^2^:O^3^,O^5^-Bis(phenylboranediyl)-α-D-glucofuranose","","- C18 H18 B2 O6 -","- C18 H18 B2 O6 -","- C72 H72 B8 O24 -","4","1","LH6421","Draffin, Scott P.; Duggan, Peter J.; Fallon, Gary D.; Tyndall, Edward M.","<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^3^,<i>O</i>^5^-Bis(phenylboranediyl)-α-<small>D</small>-glucofuranose","Acta Crystallographica Section E","2005","61","6","o1733","o1735","10.1107/S1600536805014480","","","0.71073","MoKα","","","0.0318","","","","0.07","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206009","52.275","0.003","5.3605","0.0002","14.0209","0.0008","90","","104.952","0.002","90","","3795.9","0.3","120","2","120","2","","","","","","","","4","C 1 2 1","C 2y","5","","(1R,2R)-N,N'-bis(4-nitrophenylmethylene)cyclohexane-1,2-diamine","","- C20 H20 N4 O4 -","- C20 H20 N4 O4 -","- C160 H160 N32 O32 -","8","2","LH6422","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","(1<i>R</i>,2<i>R</i>)-<i>N,N</i>'-Bis(4-nitrophenylmethylene)cyclohexane-1,2-diamine","Acta Crystallographica Section E","2005","61","6","o1699","o1701","10.1107/S1600536805014248","","","0.71073","MoKα","","0.1205","0.0602","","","0.1051","0.1243","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206010","14.118","0.002","9.1179","0.0014","16.756","0.003","90","","98.839","0.002","90","","2131.3","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(4-aminopyridinium) tetrathiocyanatocobalt(II)","","- C14 H14 Co N8 S4 -","- C14 H14 Co N8 S4 -","- C56 H56 Co4 N32 S16 -","4","1","LH6423","Shi, Jing Min; Zhang, Feng Xia; Lu, Jian Jun; Liu, Lian Dong","Bis(4-aminopyridinium) tetrathiocyanatocobaltate(II)","Acta Crystallographica Section E","2005","61","6","m1181","m1182","10.1107/S1600536805015540","","","0.71073","MoKα","","0.0924","0.0633","","","0.1379","0.1493","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206011","7.0237","0.0003","12.8964","0.0007","13.3517","0.0007","106.63","0.003","101.423","0.003","102.274","0.003","1088.18","0.1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","11-(4-bromophenyl)-10-methyl-8-phenyl-6,8-dihydro-5H- benzo[f]pyrazolo[3,4-b]quinoline","","- C27 H20 Br N3 -","- C27 H20 Br N3 -","- C54 H40 Br2 N6 -","2","1","LH6424","Serrano, Hugo; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","11-(4-Bromophenyl)-10-methyl-8-phenyl-6,8-dihydro-5<i>H</i>-benzo[<i>f</i>]pyrazolo[3,4-<i>b</i>]quinoline","Acta Crystallographica Section E","2005","61","6","o1702","o1703","10.1107/S1600536805014479","","","0.71073","MoKα","","0.102","0.0469","","","0.0878","0.1023","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206012","12.4441","0.0002","12.7433","0.0002","14.5723","0.0002","73.504","0.001","81.836","0.001","85.061","0.001","2190.74","0.06","100","2","100","2","","","","","","","","7","P -1","-P 1","2","[Fe(TPP)(4-MeHIm)~2~]2(K(222)Cl)","(5-methyl-4H-imidazole)(5,10,15,20-tetraphenylporphyrinato)iron(II) bis[(222-cryptand)potassium(I)] dichloride","","- C88 H112 Cl2 Fe K2 N12 O12 -","- C88 H112 Cl2 Fe K2 N12 O12 -","- C88 H112 Cl2 Fe K2 N12 O12 -","1","0.5","LH6425","Silvernail, Nathan J.; Noll, Bruce C.; Scheidt, W. Robert","A cytochrome b model, [Fe(TPP)(4-MeHIm)~2~][K(222-cryptand)]~2~Cl~2~","Acta Crystallographica Section E","2005","61","6","m1201","m1203","10.1107/S1600536805015989","","","0.71073","MoKα","","0.0563","0.0435","","","0.1199","0.128","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206013","6.506","0.003","9.294","0.004","18.822","0.008","90","","94.781","0.006","90","","1134.1","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","catena-Poly[[[tetraaquazinc(II)]-μ-[(2E)-N,N'-bis(pyridin-4-ylmethyl)but-2- enediamide]] dinitrate]","catena-Poly[[[tetraaquazinc(II)]-μ-[(2E)-N,N'-bis(pyridin-4-ylmethyl)but-2- enediamide]] dinitrate]","","- C16 H24 N6 O12 Zn -","- C16 H24 N6 O12 Zn -","- C32 H48 N12 O24 Zn2 -","2","0.5","LH6427","Gareth O. Lloyd","<i>catena</i>-Poly[[[tetraaquazinc(II)]-μ-[(2<i>E</i>)-<i>N,N</i>'-bis(pyridin-4-ylmethyl)but-2-enediamide]] dinitrate]","Acta Crystallographica Section E","2005","61","6","m1204","m1206","10.1107/S1600536805015291","","","0.71073","MoKα","","0.0389","0.031","","","0.0767","0.0806","","","","","","1.031","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206014","6.946","0.002","10.204","0.002","12.088","0.004","90","","90","","90","","856.8","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-Acetoxy-1-acetyl-3-pyrrolin-2-one","","- C8 H9 N O4 -","- C8 H9 N O4 -","- C32 H36 N4 O16 -","4","1","LH6429","Tooke, Duncan M.; Lutz, Martin; Spek, Anthony L.","5-Acetoxy-1-acetyl-3-pyrrolin-2-one","Acta Crystallographica Section E","2005","61","6","o1877","o1879","10.1107/S160053680501545X","","","0.71073","MoKα","","0.0699","0.0415","","","0.0795","0.0897","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206015","9.4952","0.0002","13.2026","0.0003","31.5269","0.0006","90","","90","","90","","3952.25","0.14","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","cyclo-tetrakis{μ~2~-[(dimethylamino)methyl]phenyl-κ^3^C^2^:C^2^,N}copper tetrahydrofuran solvate","cyclo-tetrakis{μ~2~-[(dimethylamino)methyl]phenyl-κ^3^C^2^:C^2^,N}copper tetrahydrofuran solvate","","- C40 H56 Cu4 N4 O -","- C40 H56 Cu4 N4 O -","- C160 H224 Cu16 N16 O4 -","4","1","LH6430","Tooke, Duncan M.; Lutz, Martin; Spek, Anthony L.","A second polymorph of <i>cyclo</i>-tetrakis{μ~2~-[(dimethylamino)methyl]phenyl-κ^3^<i>C</i>^2^:<i>C</i>^2^,<i>N</i>}copper tetrahydrofuran solvate","Acta Crystallographica Section E","2005","61","6","m1245","m1247","10.1107/S1600536805016685","","","0.71073","MoKα","","0.0201","0.0187","","","0.0438","0.0448","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206016","8.7413","0.0004","9.0199","0.0005","12.8984","0.0005","93.027","0.003","98.039","0.003","90.032","0.002","1005.55","0.08","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","2-(2,4-Dimethylphenyl)-4-isopropyl-1-methylisoquinolinium hexafluorophosphate","","- C21 H24 F6 N P -","- C21 H24 F6 N P -","- C42 H48 F12 N2 P2 -","2","1","LH6431","Tooke, Duncan M.; Lutz, Martin; Spek, Anthony L.","2-(2,4-Dimethylphenyl)-4-isopropyl-1-methylisoquinolinium hexafluorophosphate","Acta Crystallographica Section E","2005","61","6","o1875","o1876","10.1107/S1600536805015461","","","0.71073","MoKα","","0.0855","0.0481","","","0.111","0.1241","","","","","","0.992","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206017","10.707","0.006","12.103","0.008","10.8","0.006","90","","91.25","0.05","90","","1399.2","1.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4',5',6',7'-Tetrachlorospiro[cyclohex-2-ene-1,2'-indan]-1',3'-dione","","- C14 H8 Cl4 O2 -","- C14 H8 Cl4 O2 -","- C56 H32 Cl16 O8 -","4","1","LH6435","McSweeney, Nigel; Pratt, Albert C.; Long, Conor; Howie, R. Alan","4',5',6',7'-Tetrachlorospiro[cyclohex-2-ene-1,2'-indan]-1',3'-dione","Acta Crystallographica Section E","2005","61","6","o1904","o1906","10.1107/S1600536805015904","","","0.71073","MoKα","","0.141","0.0704","","","0.1691","0.1977","","","","","","0.987","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206018","14.6729","0.0005","17.8962","0.0006","16.2619","0.0003","90","","90","","90","","4270.2","0.2","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","3-(5-Chloro-3-methyl-1-phenylpyrazol-4-yl)-1,5-di-2-thienylpentane-1,5-dione","","- C23 H19 Cl N2 O2 S2 -","- C23 H19 Cl N2 O2 S2 -","- C184 H152 Cl8 N16 O16 S16 -","8","1","LH6436","Trilleras, Jorge; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","3-(5-Chloro-3-methyl-1-phenylpyrazol-4-yl)-1,5-di-2-thienylpentane-1,5-dione: centrosymmetric dimers formed by C—H···π(thiophene) hydrogen bonds","Acta Crystallographica Section E","2005","61","6","o1892","o1894","10.1107/S1600536805015886","","","0.71073","MoKα","","0.0886","0.0456","","","0.1006","0.1172","","","","","","1.034","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206019","9.4722","0.0004","6.9227","0.0002","11.7322","0.0003","90","","103.203","0.003","90","","748.98","0.04","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","saccharin","Saccharin","","- C7 H5 N O3 S -","- C7 H5 N O3 S -","- C28 H20 N4 O12 S4 -","4","1","LH6438","Wardell, James L.; Low, John N.; Glidewell, Christopher","Saccharin, redetermined at 120K: a three-dimensional hydrogen-bonded framework","Acta Crystallographica Section E","2005","61","6","o1944","o1946","10.1107/S1600536805016600","","","0.71073","MoKα","","0.0461","0.0387","","","0.089","0.092","","","","","","1.107","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206020","21.8382","0.0008","21.8382","0.0008","21.8382","0.0008","90","","90","","90","","10414.8","0.7","291","2","291","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","cerium palladium indide","cerium palladium indide","","- Ce20 In67 Pd36 -","- Ce20 In67 Pd36 -","- Ce80 In268 Pd144 -","4","0.0416667","MG6031","Tursina, Anna I.; Nesterenko, Sergei N.; Noël, Henri; Seropegin, Yuri D.","A new ternary indide, Ce~20~Pd~36~In~67~","Acta Crystallographica Section E","2005","61","6","i99","i101","10.1107/S1600536805013048","","","0.71073","MoKα","","0.0395","0.0339","","","0.0724","0.0792","","","","","","1.256","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206021","11.6495","0.0006","11.6495","0.0006","4.5128","0.0008","90","","90","","90","","612.44","0.12","291","2","291","2","","","","","","","","5","I -4","I -4","82","cadmium mercury selenocyanate","cadmium mercury selenocyanate","","- C4 Cd Hg N4 Se4 -","- C4 Cd Hg N4 Se4 -","- C8 Cd2 Hg2 N8 Se8 -","2","0.25","MG6034","Sun, Hai-Qing; Yu, Wen-Tao; Yuan, Duo-Rong; Wang, Xin-Qiang; Xue, Gang","Cadmium mercury selenocyanate, CdHg(SeCN)~4~","Acta Crystallographica Section E","2005","61","6","i111","i112","10.1107/S1600536805015771","","","0.71073","MoKα","","0.0522","0.047","","","0.1144","0.1187","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206022","6.9463","0.0008","7.2563","0.0009","15.0697","0.0018","90","","94.791","0.002","90","","756.93","0.16","293","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","cadmium polysilicate","tricadmium trisilicate","","- Cd3 O9 Si3 -","- Cd3 O9 Si3 -","- Cd12 O36 Si12 -","4","1","MG6035","Weil, Matthias","Parawollastonite-type Cd~3~[Si~3~O~9~]","Acta Crystallographica Section E","2005","61","6","i102","i104","10.1107/S1600536805015278","","","0.71073","MoKα","","0.0281","0.0235","","","0.0583","0.0639","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206023","12.2953","0.0008","5.0596","0.0003","15.9134","0.0009","90","","106.202","0.007","90","","950.64","0.11","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","lutetium oxotellurate","lutetium(III) oxotellurate(IV)","","- Lu2 O11 Te4 -","- Lu2 O11 Te4 -","- Lu8 O44 Te16 -","4","0.5","MG6036","Höss, Patrick; Starkulla, Gundula; Schleid, Thomas","Lutetium(III) oxotellurate(IV), Lu~2~Te~4~O~11~","Acta Crystallographica Section E","2005","61","6","i113","i115","10.1107/S1600536805016090","","","0.71069","MoKα","","0.0618","0.0336","","","0.0643","0.0739","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206024","8.845","0.003","13.335","0.005","5.5203","0.001","90","","95.1","0.02","90","","648.5","0.3","295","","295","","","","","","","","","5","P 1 21 1","P 2yb","4","","N-(2-nitrobenzenesulfonyl)-L-alanine methyl ester","","- C10 H12 N2 O6 S -","- C10 H12 N2 O6 S -","- C20 H24 N4 O12 S2 -","2","1","NC6028","Laurent F. Bornaghi; Sally-Ann Poulsen; Peter C. Healy; Alan R. White","<i>N</i>-(2-Nitrobenzenesulfonyl)-<small>L</small>-alanine methyl ester","Acta Crystallographica Section E","2005","61","6","o1665","o1667","10.1107/S1600536805014315","","","0.7107","MoKα","","0.0549","0.0357","","","0.0962","0.1055","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206025","7.388","0.002","9.2652","0.0015","15.117","0.004","90","","100.37","0.03","90","","1017.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1-Ethyl-2,3-dimethylimidazoliumbromide*H~2~O","1-Ethyl-2,3-dimethylimidazolium bromide monohydrate","","- C7 H15 Br N2 O -","- C7 H15 Br N2 O -","- C28 H60 Br4 N8 O4 -","4","1","NC6030","Babai, Arash; Mudring, Anja","1-Ethyl-2,3-dimethylimidazolium bromide monohydrate","Acta Crystallographica Section E","2005","61","6","o1534","o1535","10.1107/S1600536805012948","","","0.71073","MoKα","","0.0893","0.0541","","","0.1477","0.1681","","","","","","1.046","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206026","8.8003","0.0002","9.2012","0.0002","9.3735","0.0003","64.6999","0.0016","76.052","0.0015","83.7398","0.0018","665.95","0.03","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","10-Methoxydibenz[b,f]azepine-5-carboxamide","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C32 H28 N4 O4 -","2","1","NC6031","Basavegowda Nagaraj; Hemmige S. Yathirajan; Rajenahally S. Narasegowda; Padmarajaiah Nagaraja; Daniel E. Lynch","10-Methoxydibenz[<i>b</i>,<i>f</i>]azepine-5-carboxamide","Acta Crystallographica Section E","2005","61","6","o1760","o1761","10.1107/S1600536805014601","","","0.71073","MoKα","","0.0604","0.0497","","","0.1287","0.136","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206027","7.0452","0.0003","11.2345","0.0004","11.7627","0.0005","91.838","0.002","96.23","0.002","98.71","0.001","913.72","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","ethylenediaminium‒3,5-dinitrobenzoate‒3,5-dinitrobenzoic acid (1/2/2), C~2~H~10~N~2~^2+^.2C~7~H~3~N~2~O~6~^-^.2C~7~H~4~N~2~O~6~","","- C30 H24 N10 O24 -","- C30 H24 N10 O24 -","- C30 H24 N10 O24 -","1","0.5","NG6162","Jones, Helen P.; Gillon, Amy L.; Davey, Roger J.","A co-crystal of ethylenediammonium bis(3,5-dinitrobenzoate) and 3,5-dinitrobenzoic acid","Acta Crystallographica Section E","2005","61","6","o1823","o1825","10.1107/S1600536805015333","","","0.71073","MoKα","","0.072","0.0458","","","0.1196","0.1355","","","","","","1.011","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2206028","9.58","0.003","9.552","0.002","13.677","0.004","90","","99.489","0.004","90","","1234.4","0.6","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-amino-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate","","- C12 H17 N O2 S -","- C12 H17 N O2 S -","- C48 H68 N4 O8 S4 -","4","1","OB6500","K. A. Nirmala; Vasu; Deepak Chopra; S. Mohan; M. Raghu Prasad","Ethyl 2-amino-5,6,7,8-tetrahydro-4<i>H</i>-cyclohepta[<i>b</i>]thiophene-3-carboxylate","Acta Crystallographica Section E","2005","61","6","o1541","o1543","10.1107/S1600536805012808","","","0.71073","MoKα","","0.0428","0.0383","","","0.0981","0.1016","","","","","","1.098","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206029","10.618","0.003","16.224","0.004","6.9661","0.0015","90","","90","","90","","1200","0.5","296","2","296","2","","","","","","","","3","P n a 21","P 2c -2n","33","(4aS*,7aR*)-2,10-Dioxoperhydrobenzo[d]naphthalene","(4aS*,7aR*)-2,10(3H,11H)-Dioxooctahydro-1H-benzo[d]naphthalene","","- C14 H20 O2 -","- C14 H20 O2 -","- C56 H80 O8 -","4","1","OB6505","Thompson, Hugh W.; Lalancette, Roger A.","(4a<i>S</i>*,7a<i>R</i>*)-2,10-Dioxoperhydrobenzo[<i>d</i>]naphthalene","Acta Crystallographica Section E","2005","61","6","o1614","o1616","10.1107/S1600536805013759","","","0.71073","MoKα","","0.09","0.045","","","0.074","0.086","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206030","13.973","0.003","11.203","0.002","12.83","0.003","90","","102.367","0.004","90","","1961.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[diaqua(6-carboxypyridine-2-carboxylato- κ^3^N,O,O')samarium(III)]-μ-pyridine-2,6-dicarboxylato-κ^4^N,O,O':O''] tetrahydrate]","","- C14 H19 N2 O14 Sm -","- C14 H19 N2 O14 Sm -","- C56 H76 N8 O56 Sm4 -","4","1","OB6508","Liu, San-Hui; Li, Yi-Zhi; Meng, Qing-Jin","<i>catena</i>-Poly[[[diaqua(6-carboxypyridine-2-carboxylato-κ^3^<i>N,O,O</i>')samarium(III)]-μ-pyridine-2,6-dicarboxylato-κ^4^<i>N,O,O</i>':<i>O</i>''] tetrahydrate]","Acta Crystallographica Section E","2005","61","6","m1111","m1113","10.1107/S1600536805012894","","","0.71073","MoKα","","0.0842","0.0622","","","0.149","0.156","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206031","8.762","0.001","6.7707","0.0008","19.841","0.002","90","","96.515","0.002","90","","1169.5","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triaqua(2-carboxylatophenoxyactetato)cobalt(II)","","- C9 H12 Co O8 -","- C9 H12 Co O8 -","- C36 H48 Co4 O32 -","4","1","OB6510","Meng, Fa-Yan; Zhu, Li-Hong; Zeng, Ming-Hua; Ng, Seik Weng","<i>mer</i>-Triaqua(2-carboxylatophenoxyacetato)cobalt(II)","Acta Crystallographica Section E","2005","61","6","m1126","m1127","10.1107/S1600536805012961","","","0.71073","MoKα","","0.037","0.028","","","0.074","0.078","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206032","5.1003","0.0013","9.244","0.003","15.274","0.004","102.2","0.5","90.64","0.02","99.87","0.02","692.6","1.4","298","","298","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H14 N2 O4 -","- C16 H14 N2 O4 -","- C32 H28 N4 O8 -","2","1","OB6511","Shunsuke Ueda; Takeo Fukunaga; Hiroyuki Ishida","Benzimidazolium hydrogen phenylmalonate","Acta Crystallographica Section E","2005","61","6","o1845","o1847","10.1107/S1600536805013656","","","0.71073","MoKα","","0.13","0.059","","0.214","","0.214","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206033","33.257","0.004","4.2682","0.0006","21.589","0.003","90","","123.872","0.007","90","","2544.4","0.6","93.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","2,9-Dichloroquino[2,3-b]acridine-7,14(5H,12H)-dithione dimethylformamide disolvate","","- C26 H24 Cl2 N4 O2 S2 -","- C26 H24 Cl2 N4 O2 S2 -","- C104 H96 Cl8 N16 O8 S8 -","4","0.5","OB6512","Senju, Takatoshi; Hoki, Tomonori; Mizuguchi, Jin","2,9-Dichloroquino[2,3-<i>b</i>]acridine-7,14(5<i>H</i>,12<i>H</i>)-dithione dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","6","o1617","o1619","10.1107/S1600536805013334","","","1.5418","CuKα","","","0.034","","","","0.096","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206034","12.454","0.005","7.807","0.002","12.825","0.005","90","","105.269","0.005","90","","1202.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[bis(μ-3-pyridinecarboxylato-κ^3^N,O:O')cadmium(II)]","","- C12 H8 Cd N2 O4 -","- C12 H8 Cd N2 O4 -","- C48 H32 Cd4 N8 O16 -","4","1","OB6513","Liang, Yong; Li, Wei","Poly[bis(μ-3-pyridinecarboxylato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>')cadmium(II)]","Acta Crystallographica Section E","2005","61","6","m1135","m1137","10.1107/S1600536805014698","","","0.71073","MoKα","","0.0408","0.0367","","","0.1239","0.1297","","","","","","1.211","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206035","11.609","0.001","9.754","0.001","7.6157","0.0008","90","","91.448","0.002","90","","862.08","0.15","295","2","295","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Hexaaquacobalt(II) bis(6-hydroxypyridine-3-carboxylate)","","- C12 H20 Co N2 O12 -","- C12 H20 Co N2 O12 -","- C24 H40 Co2 N4 O24 -","2","0.25","OB6516","Zhang, Xue-Li; Ng, Seik Weng","Hexaaquacobalt(II) bis(6-hydroxypyridine-3-carboxylate)","Acta Crystallographica Section E","2005","61","6","m1140","m1141","10.1107/S1600536805014911","","","0.71073","MoKα","","0.055","0.054","","","0.159","0.159","","","","","","1.19","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206036","11.556","0.001","9.767","0.001","7.5422","0.0008","90","","91.32","0.002","90","","851.04","0.15","295","2","295","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Hexaaquanickel(II) bis(6-hydroxypyridine-3-carboxylate)","","- C12 H20 N2 Ni O12 -","- C12 H20 N2 Ni O12 -","- C24 H40 N4 Ni2 O24 -","2","0.25","OB6517","Zhang, Xue-Li; Ng, Seik Weng","Hexaaquanickel(II) bis(6-hydroxypyridine-3-carboxylate)","Acta Crystallographica Section E","2005","61","6","m1142","m1143","10.1107/S1600536805014923","","","0.71073","MoKα","","0.043","0.041","","","0.11","0.111","","","","","","1.12","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206037","13.3063","0.0007","9.8112","0.0003","13.9186","0.0007","90","","91.702","0.004","90","","1816.28","0.14","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(3-Mesityl-3-methylcyclobutyl)-2-(piperidin-1-yl)ethanone","","- C21 H31 N O -","- C21 H31 N O -","- C84 H124 N4 O4 -","4","1","OB6518","Dinçer, Muharrem; Özdemir, Namık; Çukurovalı, Alaaddin; Yılmaz, İbrahim","1-(3-Mesityl-3-methylcyclobutyl)-2-(piperidin-1-yl)ethanone","Acta Crystallographica Section E","2005","61","6","o1754","o1756","10.1107/S160053680501487X","","","0.71073","MoKα","","0.0545","0.0427","","","0.1064","0.1123","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206038","14.0463","0.0012","7.7507","0.0007","25.092","0.002","90","","90.446","0.006","90","","2731.6","0.4","93.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,9-dichloro-5,12-dihydroquino[2,3-b]acridine- 7,14-dithione dimethylacetamide disolvate","","- C28 H28 Cl2 N4 O2 S2 -","- C28 H28 Cl2 N4 O2 S2 -","- C112 H112 Cl8 N16 O8 S8 -","4","1","OB6519","Hoki, Tomonori; Senju, Takatoshi; Mizuguchi, Jin","The monoclinic form of 2,9-dichloro-5,12-dihydroquino[2,3-<i>b</i>]acridine-7,14-dithione dimethylacetamide disolvate","Acta Crystallographica Section E","2005","61","6","o1927","o1929","10.1107/S1600536805016624","","","1.5418","CuKα","","","0.0444","","","","0.1365","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206039","7.156","0.002","8.941","0.003","11.487","0.004","104.32","0.02","96.91","0.02","107.369","0.018","664.5","0.4","93.1","","","","","","","","","","","6","P -1","-P 1","2","","2,9-dichloro-5,12-dihydroquino[2,3-b]acridine- 7,14-dithione dimethylacetamide disolvate","","- C28 H28 Cl2 N4 O2 S2 -","- C28 H28 Cl2 N4 O2 S2 -","- C28 H28 Cl2 N4 O2 S2 -","1","0.5","OB6520","Senju, Takatoshi; Hoki, Tomonori; Mizuguchi, Jin","The triclinic form of 2,9-dichloro-5,12-dihydroquino[2,3-<i>b</i>]acridine-7,14-dithione dimethylacetamide disolvate","Acta Crystallographica Section E","2005","61","6","o1930","o1932","10.1107/S1600536805016636","","","1.5418","CuKα","","","0.0608","","","","0.2165","","","","","","1.181","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206040","8.9387","0.0007","9.1043","0.0007","10.6069","0.0008","88.509","0.006","85.498","0.006","80.661","0.006","849.05","0.11","296","","296","","","","","","","","","5","P -1","-P 1","2","","4-Allyl-2-(morpholin-4-ylmethyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4- triazole-3-thione","","- C15 H19 N5 O S -","- C15 H19 N5 O S -","- C30 H38 N10 O2 S2 -","2","1","OB6523","Dinçer, Muharrem; Özdemir, Namık; Dege, Necmi; Çetin, Ahmet; Cansız, Ahmet; Şekerci, Memet","4-Allyl-2-(morpholin-4-ylmethyl)-5-(pyridin-4-yl)-2,4-dihydro-3<i>H</i>-1,2,4-triazole-3-thione","Acta Crystallographica Section E","2005","61","6","o1953","o1955","10.1107/S1600536805015953","","","0.71073","MoKα","","0.0485","0.0403","","","0.1095","0.1147","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206041","7.3576","0.0003","10.4263","0.0005","11.9471","0.0005","90","","102.908","0.001","90","","893.33","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Creatininium dihydrogenarsenate","","- C4 H10 As N3 O5 -","- C4 H10 As N3 O5 -","- C16 H40 As4 N12 O20 -","4","1","OB6525","Wilkinson, Hazel S.; Harrison, William T. A.","Creatininium dihydrogenarsenate","Acta Crystallographica Section E","2005","61","6","m1228","m1230","10.1107/S1600536805016144","","","0.71073","MoKα","","0.044","0.027","","","0.065","0.0686","","","","","","0.999","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206042","20.797","0.004","5.068","0.001","16.253","0.003","90","","116.42","0.01","90","","1534.1","0.5","123.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(4-chloromethyl-2,5-dimethyl-3-thienyl)methane","","- C15 H18 Cl2 S2 -","- C15 H18 Cl2 S2 -","- C60 H72 Cl8 S8 -","4","0.5","OB6526","Masataka Watanabe; Asami Miura; Taisuke Matsumoto; Shuntaro Mataka; Thies Thiemann","Bis(4-chloromethyl-2,5-dimethyl-3-thienyl)methane","Acta Crystallographica Section E","2005","61","6","o1936","o1938","10.1107/S1600536805016533","","","1.5419","CuKα","","","0.03","","","","0.102","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206043","8.5226","0.001","12.2353","0.0015","13.2586","0.0016","90","","105.095","0.002","90","","1334.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methanol(2-methyl-1H-imidazole-κ^3^)(pyridine-2,6-dicarboxylato- κ^3^N,O,O')copper(II)","","- C12 H13 Cu N3 O5 -","- C12 H13 Cu N3 O5 -","- C48 H52 Cu4 N12 O20 -","4","1","OM6237","Liu, San-Hui; Li, Yi-Zhi; Meng, Qing-Jin","Methanol(2-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)(pyridine-2,6-dicarboxylato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2005","61","6","m1183","m1184","10.1107/S1600536805015564","","","0.71073","MoKα","","0.039","0.0332","","","0.0855","0.0877","","","","","","0.99","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206044","10.1699","0.0018","16.883","0.003","12.49","0.002","90","","100.126","0.003","90","","2111.1","0.6","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Fe(phen)~2~Cl~2~","Dichlorobis(1,10-phenanthroline)iron(II)","","- C24 H16 Cl2 Fe N4 -","- C24 H16 Cl2 Fe N4 -","- C96 H64 Cl8 Fe4 N16 -","4","1","OM6242","Xu-Cheng Fu; Ming-Tian Li; Cheng-Gang Wang","<i>cis</i>-Dichlorobis(1,10-phenanthroline)iron(II)","Acta Crystallographica Section E","2005","61","6","m1221","m1222","10.1107/S1600536805016156","","","0.71073","MoKα","","0.1036","0.0665","","","0.1346","0.1492","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206045","14.043","0.002","12.4625","0.0017","15.147","0.002","90","","107.328","0.002","90","","2530.6","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2'-{2,11-Bis[(3H-1,3-benzimidazol-1-ium-2-yl)methyl]-5,8-dioxa- 2,11-diazadodecane-1,12-diyl}bis(3H-1,3-benzimidazol-1-ium) dichloride diperchlorate methanol disolvate","","- C40 H52 Cl4 N10 O12 -","- C40 H52 Cl4 N10 O12 -","- C80 H104 Cl8 N20 O24 -","2","0.5","RN6046","Qin, Shi-Dong; Feng, Si-Si; Zhang Hong-Mei; Yang, Pin; Zhu, Miao-Li","2,2'-{2,11-Bis[(3<i>H</i>-1,3-benzimidazol-1-ium-2-yl)methyl]-5,8-dioxa-2,11-diazadodecane-1,12-diyl}bis(3<i>H</i>-1,3-benzimidazol-1-ium) dichloride diperchlorate methanol disolvate","Acta Crystallographica Section E","2005","61","6","o1574","o1576","10.1107/S1600536805013723","","","0.71073","MoKα","","0.1218","0.0879","","","0.2489","0.2667","","","","","","0.956","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206046","5.6995","0.0013","17.916","0.004","7.0525","0.0017","90","","99.424","0.005","90","","710.4","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","(9S)-2-(3-Benzoylthioureido)-3-(1H-imidazol-4-yl)propionic acid","(9S)-2-(3-benzoylthioureido)-3-(1H-imidazolium-4-yl)propionate","","- C14 H14 N4 O3 S -","- C14 H14 N4 O3 S -","- C28 H28 N8 O6 S2 -","2","1","RN6047","Ngah, Nurziana; Shah, Nabihah M.; Yusof, Rusila; Yamin, Bohari M","(2<i>S</i>)-2-(3-Benzoylthioureido)-3-(1<i>H</i>-imidazol-4-yl)propionic acid","Acta Crystallographica Section E","2005","61","6","o1689","o1691","10.1107/S160053680501442X","","","0.71073","MoKα","","0.039","0.039","","","0.096","0.097","","","","","","1.14","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206047","11.3184","0.001","7.6823","0.0007","16.8656","0.0012","90","","90","","90","","1466.5","0.2","298","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-aminophenylacetic acid","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C64 H72 N8 O16 -","8","1","RZ6070","Sandra Gracin; Michael Svärd; Andreas Fischer","4-Aminophenylacetic acid","Acta Crystallographica Section E","2005","61","6","o1536","o1537","10.1107/S1600536805012754","","","0.71073","MoKα","","0.0865","0.0589","","","0.1147","0.1332","","","","","","1.159","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206048","14.4453","0.0012","6.3267","0.0005","24.4965","0.0019","90","","104.517","0.006","90","","2167.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,5-Diphenyl-4-(3,4,5-trimethoxybenzylamino)-4H-1,2,4-triazole","","- C24 H24 N4 O3 -","- C24 H24 N4 O3 -","- C96 H96 N16 O12 -","4","1","RZ6071","Ocak Ískeleli, Nazan; Çoruh, Ufuk; Bekircan, Olcay; Ağar, Ayşen; Şaşmaz, Selami; Erdönmez, Ahmet","3,5-Diphenyl-4-(3,4,5-trimethoxybenzylamino)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","6","o1659","o1661","10.1107/S1600536805014443","","","0.71073","MoKα","","0.0744","0.0488","","","0.1378","0.151","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206049","21","0.004","13.343","0.002","3.6863","0.0006","90","","90","","90","","1032.9","0.3","298","2","298","2","","","","","","","","3","P n a 21","P 2c -2n","33","","Trimesic acid dihydrate","","- C9 H10 O8 -","- C9 H10 O8 -","- C36 H40 O32 -","4","1","RZ6072","Zhen-Zhong Fan; Xin-Hua Li; Guo-Ping Wang","Trimesic acid dihydrate","Acta Crystallographica Section E","2005","61","6","o1607","o1608","10.1107/S1600536805014194","","","0.71073","MoKα","","0.092","0.0788","","","0.1507","0.1563","","","","","","1.196","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206050","7.5535","0.0005","18.3764","0.0009","12.9216","0.0009","90","","91.979","0.006","90","","1792.53","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzyl 2-(3,4-dicyanophenoxy)benzoate","","- C22 H14 N2 O3 -","- C22 H14 N2 O3 -","- C88 H56 N8 O12 -","4","1","RZ6073","Atalay,Şehriman; Ağar, Ayşen","Benzyl 2-(3,4-dicyanophenoxy)benzoate","Acta Crystallographica Section E","2005","61","6","o1815","o1817","10.1107/S1600536805014546","","","0.71073","MoKα","","0.0843","0.0445","","","0.1108","0.1202","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206051","7.824","0.004","8.153","0.004","9.227","0.004","102.202","0.008","97.123","0.008","108.95","0.008","532.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-[(4-Bromo-1-methyl-1H-pyrrol-2-ylcarbonyl)amino]propanoic acid","","- C9 H11 Br N2 O3 -","- C9 H11 Br N2 O3 -","- C18 H22 Br2 N4 O6 -","2","1","RZ6074","Xiang-Chao Zeng; Jian Gu; Shi-Hai Xu; Yu-Xia Li; Po-Run Liu","3-[(4-Bromo-1-methyl-1<i>H</i>-pyrrol-2-ylcarbonyl)amino]propanoic acid","Acta Crystallographica Section E","2005","61","6","o1805","o1806","10.1107/S1600536805015047","","","0.71073","MoKα","","0.039","0.0357","","","0.0976","0.0998","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206052","4.9893","0.0008","6.3013","0.001","26.79","0.004","90","","90","","90","","842.3","0.2","292","2","292","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2,4-Dichlorobenzohydroxamic acid","","- C7 H5 Cl2 N O2 -","- C7 H5 Cl2 N O2 -","- C28 H20 Cl8 N4 O8 -","4","1","RZ6078","Shang, Xian-Mei; Meng, Xiang-Gao; Wu, Ji-Zhou; Li, Qing-Shan","2,4-Dichlorobenzohydroxamic acid","Acta Crystallographica Section E","2005","61","6","o1961","o1962","10.1107/S1600536805016557","","","0.71073","MoKα","","0.0549","0.0434","","","0.0938","0.1001","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206053","9.562","0.003","9.83","0.003","31.393","0.005","90","","90","","90","","2950.8","1.4","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H35 N O11 S -","- C29 H35 N O11 S -","- C116 H140 N4 O44 S4 -","4","1","RZ6082","Jian-Rong Su; Duan-Jun Xu","(<i>R</i>)-Methioninium‒(<i>R</i>)-mandelate‒(<i>R</i>)-mandelic acid (1/1/2)","Acta Crystallographica Section E","2005","61","6","o1933","o1935","10.1107/S160053680501620X","","","0.71073","MoKα","","0.167","0.086","","","0.208","0.25","","","","","","0.983","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206054","9.717","0.002","27.863","0.003","14.902","0.005","90","","93.06","0.02","90","","4028.9","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[3,6,14,21-Tetraaza-3,6-difuryl-10,25-dimethyl-27,28- dioxotetracyclo[18.4.3.3^8,12^.0^15,20^]octacosa- 8,10,12(28),13,17,19,21,23,25,27(1)-decaene-κ^4^N,N',O,O'](perchlorato- κO)copper(II) perchlorate dimethylformamide solvate","","- C39 H43 Cl2 Cu N5 O13 -","- C39 H43 Cl2 Cu N5 O13 -","- C156 H172 Cl8 Cu4 N20 O52 -","4","1","SG6003","Sun, Gang-Chun; Li, Yi-Zhi; Chen, Nai-Sheng; Wang, Liu-Fang","(Perchlorato-κ<i>O</i>)[3,6,14,21-tetraaza-3,6-difuryl-27,28-dihydroxy-10,25-dimethyltetracyclo[18.4.3.3^8,12^.0^15,20^]octacosa-8,10,12(28),13,17,19,21,23,25,27(1)-decaene-κ^4^<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>']copper(II) perchlorate dimethylformamide solvate","Acta Crystallographica Section E","2005","61","6","m1065","m1066","10.1107/S1600536805011451","","","0.71073","MoKα","","0.0859","0.0608","","","0.1342","0.1401","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206055","11.616","0.001","8.663","0.001","12.046","0.001","90","","111.52","0.01","90","","1127.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethylaminium picrate","","- C8 H10 N4 O7 -","- C8 H10 N4 O7 -","- C32 H40 N16 O28 -","4","1","SG6006","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Krishnan SethuSankar; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar","Ethylaminium picrate","Acta Crystallographica Section E","2005","61","6","o1546","o1548","10.1107/S1600536805013644","","","1.5418","CuKα","","0.0873","0.0793","","","0.2135","0.2262","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206056","10.175","0.002","9.219","0.002","16.814","0.004","90","","90","","90","","1577.2","0.6","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Ethyl 3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine-1-carbonate","","- C17 H16 N4 O2 -","- C17 H16 N4 O2 -","- C68 H64 N16 O8 -","4","1","SG6007","Guo-Wu Rao; Jie Yan; Wei-Xiao Hu","Ethyl 3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine-1-carboxylate","Acta Crystallographica Section E","2005","61","6","o1637","o1638","10.1107/S1600536805013620","","","0.71073","MoKα","","0.0536","0.0336","","","0.0887","0.0984","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206057","7.423","0.001","7.034","0.001","10.998","0.001","90","","99.67","0.01","90","","566.08","0.12","296.1","0.2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","(10aS)-7-methoxy-1,10a-dihydropyrrolo[1,2-b]isoquinoline-3,10(2H,5H)-dione","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C26 H26 N2 O6 -","2","1","SG6009","Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Kadlečíková, Katarína","(10a<i>S</i>)-7-Methoxy-1,10a-dihydropyrrolo[1,2-<i>b</i>]isoquinoline-3,10(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","6","o1749","o1751","10.1107/S1600536805014996","","","0.71069","MoKα","","0.0767","0.0433","","","0.0987","0.1109","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206058","12.726","0.004","11.629","0.004","13.705","0.005","90","","90","","90","","2028.2","1.2","295","2","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-(4-bromo-5-methylthiophen-2-yl)pyridine","","- C10 H8 Br N S -","- C10 H8 Br N S -","- C80 H64 Br8 N8 S8 -","8","1","SJ6067","Xu, Fengying; Chen, Zihui; Zhang, Fushi; Wang, Ru-Ji; Zhao, Fuqun","4-(4-Bromo-5-methylthiophen-2-yl)pyridine","Acta Crystallographica Section E","2005","61","6","o1672","o1673","10.1107/S160053680501425X","","","0.71073","MoKα","","0.0976","0.0486","","","0.0831","0.0979","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206059","7.35","0.0015","7.49","0.0015","8.81","0.0018","97.05","0.03","95.86","0.03","115.34","0.03","428.5","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Salicylideneacetone","(E)-4-(2-hydroxyphenyl)but-3-en-2-one","","- C10 H10 O2 -","- C10 H10 O2 -","- C20 H20 O4 -","2","1","SJ6073","Wang, Shi-Fan; Shi, Da-Hua; Zhu, Yan; Zhu, Hai-Liang","Salicylideneacetone","Acta Crystallographica Section E","2005","61","6","o1697","o1698","10.1107/S1600536805012778","","","0.71073","MoKα","","0.0701","0.0598","","","0.1372","0.1451","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206060","7.618","0.001","10.28","0.002","10.936","0.001","90","","99.55","0.01","90","","844.6","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","H-2,4-Dimethyl-6-phenyl-8,9-dihydropyrido[3',2':5,6][1,2]thiazino[3,2-c]- [1,4]oxazin-5-one-11,11-dioxide","","- C18 H16 N2 O4 S -","- C18 H16 N2 O4 S -","- C36 H32 N4 O8 S2 -","2","1","SJ6075","Karczmarzyk, Zbigniew; Malinka, Wiesław","5<i>H</i>-2,4-Dimethyl-6-phenyl-8,9-dihydropyrido[3',2':5,6][1,2]thiazino[3,2-<i>c</i>][1,4]oxazin-5-one 11,11-dioxide","Acta Crystallographica Section E","2005","61","6","o1649","o1651","10.1107/S1600536805013140","","","0.71073","MoKα","","0.0408","0.0351","","","0.0869","0.0906","","","","","","0.962","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206061","9.878","0.002","14.978","0.004","17.764","0.005","90","","104.691","0.003","90","","2542.3","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis-Bis(dicyanamido)bis(1,10-phenanthroline)cadmium(II)","","- C28 H16 Cd N10 -","- C28 H16 Cd N10 -","- C112 H64 Cd4 N40 -","4","1","SJ6076","Guo-Zheng Lan; A-Qing Wu; Guo-Cong Guo; Fa-Kun Zheng","<i>cis</i>-Bis(dicyanamido)bis(1,10-phenanthroline)cadmium(II)","Acta Crystallographica Section E","2005","61","6","m1018","m1020","10.1107/S1600536805012924","","","0.71073","MoKα","","0.0742","0.0602","","","0.1224","0.1325","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206062","11.7463","0.0006","11.7463","0.0006","18.2841","0.001","90","","90","","120","","2184.8","0.2","173","2","173","2","","","","","","","","4","P 61 2 2","P 61 2 (0 0 5)","178","","dimethyldiphenylphosphonium iodide","","- C14 H16 I P -","- C14 H16 I P -","- C84 H96 I6 P6 -","6","0.5","SJ6077","Dornhaus, Franz; Lerner, Hans-Wolfram; Bolte, Michael","The `absolute structure' of dimethyldiphenylphosphonium iodide","Acta Crystallographica Section E","2005","61","6","o1657","o1658","10.1107/S1600536805013012","","","0.71073","MoKα","","0.0207","0.0198","","","0.0469","0.0473","","","","","","1.195","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206063","10.816","0.006","13.615","0.008","12.321","0.007","90","","99.583","0.009","90","","1789.1","1.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","6-(2,4-Dichlorophenoxy)dibenzo[d,f][1,3,2]dioxaphosphepine-6-sulfide","","- C18 H11 Cl2 O3 P S -","- C18 H11 Cl2 O3 P S -","- C72 H44 Cl8 O12 P4 S4 -","4","1","SJ6078","Krishnaiah, M.; Surendra Babu, V. H. H.; Radha Krishna, J.; Ananda Kumar, K.; Suresh Reddy, C.; Puranik, Vedavathi G.","6-(2,4-Dichlorophenoxy)dibenzo[<i>d</i>,<i>f</i>][1,3,2]dioxaphosphepine-6-sulfide","Acta Crystallographica Section E","2005","61","6","o1646","o1648","10.1107/S1600536805013991","","","0.71073","MoKα","","0.0457","0.0428","","","0.1086","0.1115","","","","","","1.127","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206064","9.3302","0.0003","10.9224","0.0004","16.5491","0.0007","90","","93.641","0.002","90","","1683.08","0.11","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7,8,15,16-tetraazadibenzo[b,n]perylene monohydrate","","- C24 H14 N4 O -","- C24 H14 N4 O -","- C96 H56 N16 O4 -","4","1","SJ6079","Zafra Stein; Israel Goldberg","π‒π stacking in 7,8,15,16-tetraazadibenzo[<i>b</i>,<i>n</i>]perylene monohydrate at 110K","Acta Crystallographica Section E","2005","61","6","o1554","o1556","10.1107/S1600536805013504","","","0.71073","MoKα","","0.1084","0.062","","","0.1415","0.1664","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206065","17.37","0.005","13.131","0.004","8.011","0.002","90","","91.803","0.007","90","","1826.3","0.9","153.2","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","Dicarbonyl(η^5^-cyclopentadienyl)(trimethylsilylisocyanide)iron(II) trifluoromethanesulfonate","","- C12 H14 F3 Fe N O5 S Si -","- C12 H14 F3 Fe N O5 S Si -","- C48 H56 F12 Fe4 N4 O20 S4 Si4 -","4","1","SJ6080","Hiroshi Nakazawa; Masumi Itazaki; Mari Owaribe","Dicarbonyl(η^5^-cyclopentadienyl)(trimethylsilyl isocyanide)iron(II) trifluoromethanesulfonate","Acta Crystallographica Section E","2005","61","6","m1073","m1074","10.1107/S1600536805013516","","","0.7107","MoKα","","","0.0675","","","","0.1709","","","","","","1.164","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206066","7.1501","0.0006","8.064","0.0008","9.685","0.001","80.247","0.013","69.517","0.01","72.896","0.011","498.6","0.09","193","2","193","2","","","","","","","","3","P -1","-P 1","2","3-acetyl-7-methoxycoumarin","3-acetyl-7-methoxy-2H-1-benzopyran-2-one","","- C12 H10 O4 -","- C12 H10 O4 -","- C24 H20 O8 -","2","1","SJ6081","Hong-Mei Han; Cheng-Rong Lu; Yong Zhang; De-Chun Zhang","3-Acetyl-7-methoxycoumarin","Acta Crystallographica Section E","2005","61","6","o1864","o1866","10.1107/S1600536805014091","","","0.7107","MoKα","","0.0535","0.0429","","","0.1107","0.118","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206067","12.4473","0.0005","17.4957","0.0007","12.8805","0.0005","90","","90","","90","","2805.04","0.19","93","2","93","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Oxotris(quinolin-8-olato-κ^2^O,N)tantalum(V) dichloromethane disolvate","","- C29 H22 Cl4 N3 O4 Ta -","- C29 H22 Cl4 N3 O4 Ta -","- C116 H88 Cl16 N12 O16 Ta4 -","4","0.5","SJ6082","Amini, Mostafa M.; Tamizkar, Tayebeh; Mirzaee, Mehdi; Ng, Seik Weng","Oxotris(quinolin-8-olato-κ^2^<i>O,N</i>)tantalum(V) dichloromethane disolvate","Acta Crystallographica Section E","2005","61","6","m1053","m1054","10.1107/S1600536805013747","","","0.71073","MoKα","","0.028","0.024","","","0.061","0.064","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206068","9.172","0.003","11.032","0.003","11.106","0.003","60.825","0.002","67.219","0.002","89.136","0.003","883.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Bis(trans-(E)-2-{[4-(4-acetylphenylsulfanyl)phenylimino-κN]methyl}phenolato- κO)copper(II)","","","- C42 H32 Cu N2 O4 S2 -","- C42 H32 Cu N2 O4 S2 -","- C42 H32 Cu N2 O4 S2 -","1","0.5","SJ6083","Hebbachi, Rabihe; Benali-Cherif, Nourredine","Bis(<i>trans</i>-(<i>E</i>)-2-{[4-(4-acetylphenylsulfanyl)phenylimino-κ<i>N</i>]methyl}phenolato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2005","61","6","m1188","m1190","10.1107/S1600536805015539","","","0.71073","MoKα","","0.0407","0.034","","","0.101","0.1194","","","","","","1.213","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2206069","9.8596","0.001","23.584","0.002","8.4499","0.0008","90","","90","","90","","1964.8","0.3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-(Benzoylmethyl)-4-(3,5-dimethyl-4H-1,2,4-triazol-4-yl)-3-(2-thienylmethyl)- 1H-1,2,4-triazol-5(4H)-one","","- C19 H18 N6 O2 S -","- C19 H18 N6 O2 S -","- C76 H72 N24 O8 S4 -","4","1","SJ6084","Sancak, Kemal; Çoruh, Ufuk; Ünver, Yasemin; Vázquez-López, Ezequiel M.","1-(Benzoylmethyl)-4-(3,5-dimethyl-4<i>H</i>-1,2,4-triazol-4-yl)-3-(2-thienylmethyl)-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","6","o1785","o1787","10.1107/S1600536805015084","","","0.71073","MoKα","","0.1332","0.0851","","","0.2296","0.249","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206070","6.405","0.002","25.82","0.009","7.197","0.002","90","","114.14","0.006","90","","1086.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-4-[(4-Hydroxyphenyl)diazenyl]benzaldehyde","","- C13 H10 N2 O2 -","- C13 H10 N2 O2 -","- C52 H40 N8 O8 -","4","1","SJ6085","Liu, Xin-Gang; Feng, Ya-Qing; Meng, Xiang-Qi; Liang, Zu-Pei; Yang, Guang","(<i>E</i>)-4-[(4-Hydroxyphenyl)diazenyl]benzaldehyde","Acta Crystallographica Section E","2005","61","6","o1694","o1696","10.1107/S1600536805014510","","","0.71073","MoKα","","0.119","0.0461","","","","0.1286","","","","","","0.996","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206071","3.957","0.001","15.798","0.003","11.461","0.002","90","","94.14","0.01","90","","714.6","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Melaminium formate","","- C4 H8 N6 O2 -","- C4 H8 N6 O2 -","- C16 H32 N24 O8 -","4","1","SJ6086","Genivaldo Julio Perpétuo; Marcos Antônio Ribeiro; Jan Janczak","Melaminium formate","Acta Crystallographica Section E","2005","61","6","o1818","o1820","10.1107/S1600536805015151","","","0.71073","MoKα","","0.0538","0.0357","","","0.0875","0.0956","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206072","12.413","0.0014","13.1265","0.0015","15.159","0.0018","87.559","0.002","74.392","0.002","77.313","0.002","2320.5","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","7""-Benzyl-9""-benzylidene-4'-[4-(dimethylamino)phenyl]-1'-methyl-5""-phenyl- 2"",3"",6"",7"",8"",9""-hexahydro-1H-indole-3(2H)-spiro-2'-pyrrolidine-3'-spiro-2''- pyrido[4,3-d]thiazolo[3,2-a]pyrimidine-2,2''-dione acetonitrile disolvate","","- C52 H50 N8 O2 S -","- C52 H50 N8 O2 S -","- C104 H100 N16 O4 S2 -","2","1","SJ6088","Hu, Xiao-Fen; Feng, Ya-Qing; Su, Qi; Qiao, Kang-Jian","7''-Benzyl-9''-benzylidene-4'-[4-(dimethylamino)phenyl]-1'-methyl-5''-phenyl- 2'',3'',6'',7'',8'',9''-hexahydro-1<i>H</i>-indole-3(2<i>H</i>)-spiro-2'-pyrrolidine-3'-spiro-2''-pyrido[4,3-<i>d</i>]thiazolo[3,2-<i>a</i>]pyrimidine-2,2''-dione acetonitrile disolvate","Acta Crystallographica Section E","2005","61","6","o1830","o1832","10.1107/S1600536805015485","","","0.71073","MoKα","","0.0978","0.0534","","","","0.1573","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206073","17.489","0.001","6.816","0.001","16.528","0.001","90","","100.68","0.01","90","","1936.1","0.3","100","0.1","100","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","N-Methyl-3-methylsulfonyl-N-nitroaniline","N-Methyl-3-methylsulfonyl-N-nitroaniline","","- C8 H10 N2 O4 S -","- C8 H10 N2 O4 S -","- C64 H80 N16 O32 S8 -","8","1","SJ6090","Zarychta, Bartosz; Daszkiewicz, Zdzisław; Zaleski, Jacek","<i>N</i>-Methyl-3-methylsulfonyl-<i>N</i>-nitroaniline","Acta Crystallographica Section E","2005","61","6","o1897","o1899","10.1107/S1600536805015965","","","0.71073","MoKα","","0.0351","0.0312","","","0.0818","0.0847","","","","","","1.059","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206074","10.539","0.002","15.986","0.002","10.905","0.002","90","","113.48","0.002","90","","1685.1","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Methanol[4-nitro-2-(pyridin-2- ylmethyliminomethyl)phenolato](thiocyanato)copper(II)","","- C15 H14 Cu N4 O4 S -","- C15 H14 Cu N4 O4 S -","- C60 H56 Cu4 N16 O16 S4 -","4","1","SJ6092","Wang, Nong; Li, Jing-Ping","Methanol[4-nitro-2-(pyridin-2-ylmethyliminomethyl)phenolato](thiocyanato)copper(II)","Acta Crystallographica Section E","2005","61","6","m1223","m1225","10.1107/S1600536805016363","","","0.71073","MoKα","","0.0664","0.0428","","","0.1077","0.1204","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206075","40.0008","0.0012","40.0008","0.0012","12.093","","90","","90","","120","","16757.2","0.7","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","Hexacarbonylhexakis(μ-3,4-dimethylbenzenethiolato)triiron(II)","","- C54 H54 Fe3 O6 S6 -","- C54 H54 Fe3 O6 S6 -","- C648 H648 Fe36 O72 S72 -","12","0.666667","SU6189","Hu, Mingqiang; Ma, Chengbing; Chen, Changneng","Hexacarbonylhexakis(μ-3,4-dimethylbenzenethiolato)triiron(II)","Acta Crystallographica Section E","2005","61","6","m1045","m1047","10.1107/S1600536805013024","","","0.71073","MoKα","","0.0584","0.049","","","0.1018","0.1064","","","","","","1.087","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206076","10.735","0.002","9.4311","0.0019","16.61","0.003","90","","106.81","0.03","90","","1609.8","0.6","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Methyl 3,3,7,7,9-pentamethyl-1,5-dioxaspiro[5.5]undec-8-ene-8-carboxylate","","- C16 H26 O4 -","- C16 H26 O4 -","- C64 H104 O16 -","4","1","SU6192","Koskinen, Ari M. P.; Laitinen, Risto S.; Oilunkaniemi, Raija; Savilampi, Satu K.; Toivola, Reijo J.","Methyl 3,3,7,7,9-pentamethyl-1,5-dioxaspiro[5.5]undec-8-ene-8-carboxylate","Acta Crystallographica Section E","2005","61","6","o1627","o1628","10.1107/S1600536805013127","","","0.71073","MoKα","","0.0429","0.0379","","","0.1081","0.1197","","","","","","1.083","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206077","7.207","0.003","19.112","0.004","12.686","0.003","90","","95.67","0.03","90","","1738.8","0.9","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]methanolperchloratozinc(II)","","- C14 H14 Br Cl N2 O6 Zn -","- C14 H14 Br Cl N2 O6 Zn -","- C56 H56 Br4 Cl4 N8 O24 Zn4 -","4","1","SU6193","Wei, Yi-Jun","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]methanolperchloratozinc(II)","Acta Crystallographica Section E","2005","61","6","m1085","m1087","10.1107/S1600536805012882","","","0.71073","MoKα","","0.0699","0.0479","","","0.1165","0.1288","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206078","13.7823","0.0013","17.5908","0.0017","18.1368","0.0018","90","","90","","90","","4397.1","0.7","223","2","223","2","","","","","","","","4","I b c a","-I 2b 2c","73","","Diazidobis(1,7-phenanthroline)zinc(II)","","- C24 H16 N10 Zn -","- C24 H16 N10 Zn -","- C192 H128 N80 Zn8 -","8","0.5","SU6194","Sun, Bai-Wang; Du Lin","Diazidobis(1,7-phenanthroline)zinc(II)","Acta Crystallographica Section E","2005","61","6","m1099","m1100","10.1107/S1600536805014108","","","0.71073","MoKα","","0.0656","0.0446","","","0.1103","0.1227","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206079","21.578","0.005","4.674","0.005","11.709","0.005","90","0.005","95.829","0.005","90","0.005","1174.8","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","5-[(4-methylphenyl)diazenyl]salicylaldehyde","5-[(4-methylphenyl)diazenyl]salicylaldehyde","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","1","SU6195","Bakir, Mohammed; Harewood, Gabriel R.; Holder, Alvin; Hassan, Ishmael; Dasgupta, Tara; Maragh, Paul; Singh-Wilmot, Marvadeen","5-[(4-Methylphenyl)diazenyl]salicylaldehyde","Acta Crystallographica Section E","2005","61","6","o1611","o1613","10.1107/S1600536805013413","","","0.71069","MoKα","","0.0928","0.0459","","","0.0871","0.1025","","","","","","1.289","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206080","9.248","0.002","10.272","0.002","11.399","0.002","79.155","0.002","67.425","0.002","81.923","0.002","979.2","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis{1-[3-(cyclohexylamino)propyliminomethyl]naphth-2-olato}nickel(II)","","- C40 H50 N4 Ni O2 -","- C40 H50 N4 Ni O2 -","- C40 H50 N4 Ni O2 -","1","0.5","SU6196","Wei, Yi-Jun","Bis{1-[3-(cyclohexylamino)propyliminomethyl]naphth-2-olato}nickel(II)","Acta Crystallographica Section E","2005","61","6","m1088","m1089","10.1107/S1600536805012286","","","0.71073","MoKα","","0.0784","0.0705","","","0.1775","0.1862","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206081","7.9131","0.0005","13.572","0.0008","25.0065","0.0014","90","","90","","90","","2685.6","0.3","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","catena-Poly[[[4-bromo-2-(2-pyridylmethyliminomethyl)phenolato]copper(II)]- μ-chloro]","","- C13 H10 Br Cl Cu N2 O -","- C13 H10 Br Cl Cu N2 O -","- C104 H80 Br8 Cl8 Cu8 N16 O8 -","8","1","SU6197","Sun, Yu-Xi; Gao, Yi-Zhen; Zhang, Hong-Lin; Kong, De-Sheng; Yu, You","<i>catena</i>-Poly[[[4-bromo-2-(2-pyridylmethyliminomethyl)phenolato]copper(II)]-μ-chloro]","Acta Crystallographica Section E","2005","61","6","m1055","m1057","10.1107/S1600536805013401","","","0.71073","MoKα","","0.0696","0.0372","","","0.0784","0.0847","","","","","","0.854","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206082","12.3075","0.0014","7.4751","0.0009","13.6676","0.0017","90","","94.046","0.003","90","","1254.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Amino-4-(2-naphthalyl)thiophene-3-carbonitrile","","- C15 H10 N2 S -","- C15 H10 N2 S -","- C60 H40 N8 S4 -","4","1","SU6198","Çoruh, Ufuk; Tümer, Ferhan; Vázquez-López, Ezequiel M.; Demir, Ümit","2-Amino-4-(2-naphthyl)thiophene-3-carbonitrile","Acta Crystallographica Section E","2005","61","6","o1680","o1682","10.1107/S1600536805013425","","","0.71073","MoKα","","0.1969","0.0416","","","0.0525","0.0697","","","","","","0.716","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206083","7.4846","0.0014","8.1059","0.0015","27.139","0.005","90","","97.867","0.004","90","","1631","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 3-methyl-6-oxo-5-[3-(trifluoromethyl)phenyl]-1,6-dihydro-1-pyridazineacetate","","- C16 H15 F3 N2 O3 -","- C16 H15 F3 N2 O3 -","- C64 H60 F12 N8 O12 -","4","1","SU6199","Han Xu; Hai-Bin Song; Chang-Sheng Yao; You-Quan Zhu; Fang-Zhong Hu; Xiao-Mao Zou; Hua-Zheng Yang","Ethyl 3-methyl-6-oxo-5-[3-(trifluoromethyl)phenyl]-1,6-dihydro-1-pyridazineacetate","Acta Crystallographica Section E","2005","61","6","o1561","o1563","10.1107/S1600536805013498","","","0.71073","MoKα","","0.1429","0.059","","","0.1431","0.1852","","","","","","1.003","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206084","12.706","0.003","11.141","0.002","11.552","0.002","90","","90","","90","","1635.3","0.6","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4-{[1-(1-Adamantyl)ethyl]iminomethyl}phenol","","- C19 H25 N O -","- C19 H25 N O -","- C76 H100 N4 O4 -","4","1","SU6200","Feng, Yun-Long; Zhao, Guo-Liang; Wen, Yi-Hang","4-{[1-(1-Adamantyl)ethyl]iminomethyl}phenol","Acta Crystallographica Section E","2005","61","6","o1771","o1773","10.1107/S1600536805014935","","","0.71073","MoKα","","0.0756","0.0421","","","0.0822","0.0855","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206085","7.8","0.002","5.845","0.002","21.61","0.003","90","","97.599","0.002","90","","976.6","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(Cyclopropyliminomethyl)-4-nitrophenol","","- C10 H10 N2 O3 -","- C10 H10 N2 O3 -","- C40 H40 N8 O12 -","4","1","SU6201","Zhao, Li-Fang","2-(Cyclopropyliminomethyl)-4-nitrophenol","Acta Crystallographica Section E","2005","61","6","o1670","o1671","10.1107/S1600536805014145","","","0.71073","MoKα","","0.0662","0.0549","","","0.1293","0.1361","","","","","","1.125","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206086","9.2293","0.0017","16.506","0.003","12.354","0.002","90","","107.286","0.004","90","","1797","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 2,7,7-trimethyl-5-oxo-4-(3-chlorophenyl)-1,4,5,6,7,8- hexahydroquinoline-3-carboxylate","","- C20 H22 Cl N O3 -","- C20 H22 Cl N O3 -","- C80 H88 Cl4 N4 O12 -","4","1","TK6221","Yu-Ling Li; Bai-Xiang Du; Xiang-Shan Wang; Mei-Mei Zhang; Zhao-Sen Zeng","Methyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","Acta Crystallographica Section E","2005","61","6","o1634","o1636","10.1107/S1600536805012821","","","0.7107","MoKα","","0.067","0.055","","","0.124","0.13","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206087","10.305","0.001","12.088","0.001","20.341","0.002","90","","90","","90","","2533.8","0.4","295","2","295","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","L-(-)-dichloro(N,N-diethyldithiocarbamato)(β-menthoxycarbonylethyl)tin(IV)","","- C18 H33 Cl2 N O2 S2 Sn -","- C18 H33 Cl2 N O2 S2 Sn -","- C72 H132 Cl8 N4 O8 S8 Sn4 -","4","1","TK6223","Ng, Seik Weng","Redetermination of <small>L</small>-(‒)-dichloro(<i>N,N</i>-diethyldithiocarbamato)(β-menthoxycarbonylethyl)tin(IV)","Acta Crystallographica Section E","2005","61","6","m1051","m1052","10.1107/S160053680501281X","","","0.71073","MoKα","","0.041","0.035","","","0.075","0.079","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206088","10.9217","0.0007","21.5274","0.0017","16.4036","0.0011","90","","91.037","0.001","90","","3856.1","0.5","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,4'-Bipyridinium bis(3,5-dicarboxybenzoate) benzene-1,3,5-tricarboxylic acid hexahydrate","","- C37 H38 N2 O24 -","- C37 H38 N2 O24 -","- C148 H152 N8 O96 -","4","0.5","WK6046","Xin-Hua Li; Xin-Xiang Lei; Shun Wang","4,4'-Bipyridinium bis(3,5-dicarboxybenzoate) benzene-1,3,5-tricarboxylic acid hexahydrate","Acta Crystallographica Section E","2005","61","6","o1802","o1804","10.1107/S1600536805015035","","","0.71073","MoKα","","0.0759","0.0715","","","0.1544","0.1571","","","","","","1.215","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2206089","7.8401","0.0009","12.5177","0.0014","7.6177","0.0008","90","","103.049","0.002","90","","728.3","0.14","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(4-pyridylmethyl)ammonium chloride","(4-Pyridylmethyl)aminium chloride","","- C6 H9 Cl N2 -","- C6 H9 Cl N2 -","- C24 H36 Cl4 N8 -","4","1","WK6048","Elise J. C. de Vries; Clive L. Oliver; Gareth O. Lloyd","(4-Pyridylmethyl)aminium chloride","Acta Crystallographica Section E","2005","61","6","o1577","o1578","10.1107/S1600536805013255","","","0.71073","MoKα","","0.0402","0.0356","","","0.087","0.0898","","","","","","1.075","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2206090","11.72","0.002","8.0163","0.0015","8.952","0.002","90","","90","","90","","841","0.3","298","2","298","2","","","","","","","","4","P m m n :2","-P 2ab 2a","59","praseodymium triiodide nona-hydrate","praseodymium triiodide nonahydrate","","- H18 I3 O9 Pr -","- I3 O9 Pr -","- I6 O18 Pr2 -","2","0.25","WM6064","Timofte, Tudor; Babai, Arash; Meyer, Gerd; Mudring, Anja-Verena","Praseodymium triiodide nonahydrate","Acta Crystallographica Section E","2005","61","6","i94","i95","10.1107/S1600536805012857","","","0.71073","MoKα","","0.0574","0.0501","","","0.13","0.1362","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206091","7.7592","0.0008","7.7592","0.0008","11.3079","0.0013","90","","90","","90","","680.79","0.13","296","","295","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Dicaesium dibromoaurate(I) tetrabromoaurate(III)","","- Au2 Br6 Cs2 -","- Au2 Br6 Cs2 -","- Au4 Br12 Cs4 -","2","0.0625","WM6065","Matsushita, Nobuyuki; Fukuhara, Fumiya; Kojima, Norimichi","A three-dimensional bromo-bridged mixed-valence gold(I,III) compound, Cs~2~Au^I^Au^III^Br~6~","Acta Crystallographica Section E","2005","61","6","i123","i125","10.1107/S1600536805016594","","","0.71069","MoKα","","0.0975","0.064","","","0.154","0.1701","","","","","","1.044","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206092","4.0757","0.0002","4.0757","0.0002","14.1965","0.0011","90","","90","","90","","235.82","0.02","293","2","293","2","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","Ag.28(1) Si1.72(1) Yb","ytterbium silver silicide","","- Ag0.28 Si1.72 Yb -","- Ag0.284 Si1.716 Yb -","- Ag1.136 Si6.864 Yb4 -","4","0.125","WM6066","Bobev, Svilen; Bauer, Eric D.","YbAg~<i>x~</i>Si~2{-~<i>x</i>} [<i>x</i> = 0.28(1)] with the tetragonal α-ThSi~2~ structure type","Acta Crystallographica Section E","2005","61","6","i96","i98","10.1107/S1600536805013103","","","0.71073","MoKα","","0.0113","0.0091","","","0.0196","0.0203","","","","","","1.233","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206093","4.3051","0.0003","19.0324","0.0015","20.7335","0.0019","90","","90","","90","","1698.8","0.2","173","2","173","2","","","","","","","","4","C m c m","-C 2c 2","63","Potassium trichloro decafluoropentastannates(II)","pentapotassium trichlorodecafluoropentastannate(II)","","- Cl3 F10 K3 Sn5 -","- Cl3 F10 K3 Sn5 -","- Cl12 F40 K12 Sn20 -","4","0.25","WM6068","Hocine Merazig; Fatima Setifi; Zouaoui Setifi; Peter H. Bird; George Dénès; Korzior Tam","K~3~Sn~5~Cl~3~F~10~ with a corrugated layered structure","Acta Crystallographica Section E","2005","61","6","i120","i122","10.1107/S1600536805016351","","","0.71073","MoKα","","0.0253","0.025","","","0.0576","0.0578","","","","","","1.207","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206094","8.236","0.002","15.237","0.003","22.724","0.005","90","","90","","90","","2851.7","1.1","193","2","193","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","europium antimony sulfide","europium antimony sulfide","","- Eu6 S17 Sb6 -","- Eu6 S17 Sb6 -","- Eu24 S68 Sb24 -","4","1","WM6069","Jin, Gengbang; Wells, Daniel M.; Crerar, Shane J.; Shehee, Thomas C.; Mar, Arthur; Albrecht-Schmitt, Thomas E.","Europium antimony sulfide, Eu~6~Sb~6~S~17~","Acta Crystallographica Section E","2005","61","6","i116","i119","10.1107/S1600536805016211","","","0.71073","MoKα","","0.0381","0.0311","","","0.0602","0.0615","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206095","7.347","0.0015","9.501","0.0019","13.568","0.003","90","","97.81","0.03","90","","938.3","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Methyl ent-15β-hydroxy-16α-kauran-19-oate","","- C21 H34 O3 -","- C21 H34 O3 -","- C42 H68 O6 -","2","1","WN6340","Batista, Ronan; García, Pablo A.; Castro, María A.; del Corral, José M. Miguel; Speziali, Nivaldo L.; Oliveira, Alaide B. de","Methyl <i>ent</i>-15β-hydroxy-16α-kauran-19-oate","Acta Crystallographica Section E","2005","61","6","o1525","o1527","10.1107/S1600536805009554","","","1.5418","CuKα","","0.0333","0.0323","","","0.0884","0.0895","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206096","15.8942","0.0013","6.9666","0.0003","20.2673","0.0017","90","","102.634","0.006","90","","2189.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(2-Thienylmethyl)-4,4'-bi-1H-1,2,4-triazol-5(4H)-one","","- C9 H8 N6 O S -","- C9 H8 N6 O S -","- C72 H64 N48 O8 S8 -","8","2","WN6349","Sancak, Kemal; Ustabaş, Reşat; Çoruh, Ufuk; Er, Mustafa; Ünver, Yasemin; Yavuz, Metin","3-(2-Thienylmethyl)-4,4'-bi-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","6","o1764","o1766","10.1107/S1600536805013942","","","0.71073","MoKα","","0.1179","0.0872","","","0.262","0.2844","","","","","","1.019","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206097","7.931","0.0005","11.9091","0.001","21.3948","0.0015","90","","90","","90","","2020.8","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","4',4',6',6'-Tetrachloro-3-(4,6-dimethylpyridin-2-yl)-3,4-dihydrospiro[1,3,2- benzoxazaphosphinine-2,2'-(2λ^5^,4λ^5^,6λ^5^-cyclotriphosphazene)]","","- C14 H14 Cl4 N5 O P3 -","- C14 H14 Cl4 N5 O P3 -","- C56 H56 Cl16 N20 O4 P12 -","4","1","WN6350","Çaylak, Nagihan; Hökelek, Tuncer; Büyükgüngör, Orhan; Dal, Hakan; Süzen, Yasemin; Kılıç, Zeynel","4',4',6',6'-Tetrachloro-3-(4,6-dimethylpyridin-2-yl)-3,4-dihydrospiro[1,3,2-benzoxazaphosphinine-2,2'-(2λ^5^,4λ^5^,6λ^5^-cyclotriphosphazene)]","Acta Crystallographica Section E","2005","61","6","o1557","o1560","10.1107/S1600536805013383","","","0.71073","MoKα","","0.0321","0.0298","","","0.0738","0.0744","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206098","11.857","0.002","7.1867","0.0014","32.253","0.007","90","","90","","90","","2748.4","0.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-(4-Methoxystyryl)-2H-1,4-benzoxazin-2-one","","- C17 H13 N O3 -","- C17 H13 N O3 -","- C136 H104 N8 O24 -","8","1","WN6351","Yan-Chao Wu; Hai-Bin Song; Li Liu; Dong Wang; Yong-Jun Chen","3-(4-Methoxystyryl)-2<i>H</i>-1,4-benzoxazin-2-one","Acta Crystallographica Section E","2005","61","6","o1590","o1591","10.1107/S1600536805013772","","","0.71073","MoKα","","0.1039","0.0483","","","0.126","0.1401","","","","","","0.83","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206099","7.2873","0.0015","18.657","0.004","30.047","0.006","90","","90","","90","","4085.2","1.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2,2'-bis(1-phenyl-1H-tetrazole-5-ylsulfanyl) ether","","- C18 H18 N8 O S2 -","- C18 H18 N8 O S2 -","- C144 H144 N64 O8 S16 -","8","1","WN6352","Wei Wang; Bing Zhao; Wen-Qin Zhang","2,2'-Bis(1-phenyl-1<i>H</i>-tetrazol-5-ylsulfanyl) ether","Acta Crystallographica Section E","2005","61","6","o1639","o1640","10.1107/S1600536805013784","","","0.71073","MoKα","","0.1139","0.0585","","","0.0973","0.1187","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206100","11.735","0.002","12.964","0.003","11.82","0.002","90","","90","","90","","1798.2","0.6","292","2","292","2","","","","","","","","2","P b c n","-P 2n 2ab","60","","1,2-Dimethyl-4,5-bis(phenylethynyl)benzene","","- C24 H18 -","- C24 H18 -","- C96 H72 -","4","0.5","WN6353","Nengfang She; Huizhen Guo; Yitao Li; Anxin Wu","1,2-Dimethyl-4,5-bis(phenylethynyl)benzene","Acta Crystallographica Section E","2005","61","6","o1790","o1792","10.1107/S1600536805014820","","","0.71073","MoKα","","0.0972","0.0582","","","0.1374","0.1593","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206101","10.7701","0.0005","10.7701","0.0005","6.3526","0.0002","90","","90","","120","","638.15","0.05","150","","150","","","","","","","","","5","P 31 2 1","P 31 2""","152","","Sodium 3,5-dinitrobenzoate","","- C7 H3 N2 Na O6 -","- C7 H3 N2 Na O6 -","- C21 H9 N6 Na3 O18 -","3","0.5","WW6381","Jones, Helen P.; Gillon, Amy L.; Davey, Roger J.","Sodium 3,5-dinitrobenzoate","Acta Crystallographica Section E","2005","61","6","m1131","m1132","10.1107/S1600536805014893","","","0.71073","MoKα","","0.0274","0.0255","","","0.0655","0.0662","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206102","7.623","0.003","19.92","0.006","11.558","0.004","90","","92.304","0.006","90","","1753.7","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,10-Phenanthrolin-1-ium 2-carboxy-6-nitrobenzoate","","- C20 H13 N3 O6 -","- C20 H13 N3 O6 -","- C80 H52 N12 O24 -","4","1","WW6383","Guo, Ming-Lin","1,10-Phenanthrolin-1-ium 2-carboxy-6-nitrobenzoate","Acta Crystallographica Section E","2005","61","6","o1728","o1730","10.1107/S1600536805014753","","","0.71073","MoKα","","0.092","0.0451","","","0.0934","0.1084","","","","","","1.007","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206103","16.4728","0.0016","13.815","0.0014","7.6914","0.0008","90","","93.829","0.002","90","","1746.4","0.3","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(4-Methylbenzoyl)-3-{5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl)urea","","- C18 H13 F3 N4 O2 S -","- C18 H13 F3 N4 O2 S -","- C72 H52 F12 N16 O8 S4 -","4","1","WW6384","Song, Xinjian; Tan, Xiaohong; Wang, Yangang; Meng, Xianggao; Shi, Bo-An","1-(4-Methylbenzoyl)-3-{5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}urea","Acta Crystallographica Section E","2005","61","6","o1731","o1732","10.1107/S1600536805014765","","","0.71073","MoKα","","0.0777","0.0543","","","0.1546","0.177","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206104","13.457","0.003","19.807","0.003","14.08","0.003","90","","97.15","0.02","90","","3723.7","1.3","287","2","287","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[N,N-diisopropyl-2,2'-(2,3-naphthalenedioxy)diacetamide]trinitratoneodymium(III) acetone solvate","","- C29 H44 N5 Nd O14 -","- C29 H44 N5 Nd O14 -","- C116 H176 N20 Nd4 O56 -","4","1","XU6004","Lei, Ke-Wei; Liu, Wei-Sheng; Yu, Kai-Bei","[<i>N,N</i>-Diisopropyl-2,2'-(2,3-naphthalenedioxy)diacetamide]trinitratoneodymium(III) acetone solvate","Acta Crystallographica Section E","2005","61","6","m1159","m1160","10.1107/S1600536805015321","","","0.71073","MoKα","","0.035","0.025","","","0.054","0.056","","","","","","0.972","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206105","8.457","0.007","13.732","0.011","15.621","0.013","115.53","0.01","90.89","0.01","102.366","0.011","1587","2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Aqua[2,2'-(naphthylene-2,3-dioxy)bis(N,N- diethylacetamide)]trinitratocerium(III) acetonitrile solvate","","- C24 H35 Ce N6 O14 -","- C24 H35 Ce N6 O14 -","- C48 H70 Ce2 N12 O28 -","2","1","XU6005","Lei, Ke-Wei; Liu, Wei-Sheng; Wang, Da-Qi","Aqua[2,2'-(naphthalene-2,3-dioxy)bis(<i>N</i>,<i>N</i>-diethylacetamide)]trinitratocerium(III) acetonitrile solvate","Acta Crystallographica Section E","2005","61","6","m1243","m1244","10.1107/S1600536805016612","","","0.71073","MoKα","","0.04","0.034","","","0.083","0.091","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206106","12.01","0.002","7.029","0.0014","16.382","0.003","90","","94.84","0.03","90","","1378","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","sodium hydrogen diglycolate nitrate","disodium trihydrogen bis(2,2'-oxydiacetate) nitrate","","- C8 H11 N Na2 O13 -","- C8 H11 N Na2 O13 -","- C32 H44 N4 Na8 O52 -","4","0.5","XU6006","Price, Daniel J.; Fritsch, Stefan; Wood, Paul T.; Powell, Annie K.","Possible strong symmetric hydrogen bonding in disodium trihydrogen bis(2,2'-oxydiacetate) nitrate","Acta Crystallographica Section E","2005","61","6","m1174","m1177","10.1107/S1600536805014819","","","0.71073","MoKα","","0.038","0.033","","","0.1","0.103","","","","","","1.167","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206107","6.898","0.0014","7.755","0.0016","30.339","0.006","90","","93.44","0.03","90","","1620","0.6","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-poly[[[triaquazinc(II)]-μ-N,N'-(benzene-1,4-dicarboxamido)diacetato- κ^2^O:O'] dihydrate]","","- C12 H20 N2 O11 Zn -","- C12 H20 N2 O11 Zn -","- C48 H80 N8 O44 Zn4 -","4","0.5","XU6010","Zhang, Hong-Tao; You, Xiao-Zeng","The one-dimensional zigzag coordination polymer <i>catena</i>-poly[[[triaquazinc(II)]-μ-<i>N</i>,<i>N</i>'-(benzene-1,4-dicarboxamido)diacetato-κ^2^<i>O</i>:<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2005","61","6","m1163","m1165","10.1107/S1600536805015345","","","0.71073","MoKα","","0.052","0.042","","","0.113","0.12","","","","","","1.122","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206108","7.5743","0.0015","9.4265","0.0019","23.07","0.005","90","","99.17","0.03","90","","1626.1","0.6","283","2","283","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[[(1,10-phenanthroline-κ^2^N,N')cadmium(II)]-μ~3~-pyridine-3,4- dicarboxylato-κ^5^N:O,O':O'',O''']","","- C19 H11 Cd N3 O4 -","- C19 H11 Cd N3 O4 -","- C76 H44 Cd4 N12 O16 -","4","1","XU6011","Xin-Long Wang; Chao Qin; En-Bo Wang","Poly[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ~3~-pyridine-3,4-dicarboxylato-κ^5^<i>N</i>:<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2005","61","6","m1234","m1236","10.1107/S1600536805016016","","","0.71073","MoKα","","0.037","0.031","","","0.0845","0.094","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206109","9.3371","0.0003","17.5155","0.0005","11.6735","0.0003","90","","96.964","0.001","90","","1895.05","0.09","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2,6-Bis(2-pyridylamino)pyridine]dinitratocadmium monohydrate","","- C15 H15 Cd N7 O7 -","- C15 H15 Cd N7 O7 -","- C60 H60 Cd4 N28 O28 -","4","1","YA6239","Fang, Xiao-Niu; Li, Xin-Fa; Zeng, Xi-Rui","[2,6-Bis(2-pyridylamino)pyridine]dinitratocadmium monohydrate","Acta Crystallographica Section E","2005","61","6","m1123","m1125","10.1107/S1600536805014649","","","0.71073","MoKα","","0.047","0.026","","","0.056","0.06","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206110","13.9144","0.0013","5.5055","0.0004","17.8016","0.0017","90","","107.858","0.008","90","","1298","0.2","150","","150","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2-exo,7-exo,9-exo,10-exo)-11-oxatricyclo[6.2.1.0^2,7^]undec-4-ene-9,10-diyl diacetate","","- C14 H18 O5 -","- C14 H18 O5 -","- C56 H72 O20 -","4","1","YA6244","Sema Öztürk Yıldırım; Mehmet Akkurt; Arif Baran; Hasan Seçen; Orhan Büyükgüngör","The 2-<i>exo</i>,7-<i>exo</i>,9-<i>exo</i>,10-<i>exo</i> isomer of 11-oxatricyclo[6.2.1.0^2,7^]undec-4-ene-9,10-diyl diacetate","Acta Crystallographica Section E","2005","61","6","o1677","o1679","10.1107/S160053680501398X","","","0.71073","MoKα","","0.049","0.045","","","0.124","0.127","","","","","","1.05","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206111","10.4499","0.0018","6.0036","0.001","13.688","0.002","90","","103.995","0.002","90","","833.3","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[2-(2-pyridyl)ethyl]dithiooxamide","","- C16 H18 N4 S2 -","- C16 H18 N4 S2 -","- C32 H36 N8 S4 -","2","0.5","YA6245","Cui, Jian-Zhong; Zhang, Dan; Pan, Shuo-Wen; Cheng, Peng; Liao, Dai-Zheng; Wang, Geng-Lin","<i>N</i>,<i>N</i>'-Bis[2-(2-pyridyl)ethyl]dithiooxamide","Acta Crystallographica Section E","2005","61","6","o1913","o1915","10.1107/S1600536805016338","","","0.71073","MoKα","","0.046","0.033","","","0.093","0.097","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206112","5.31","0.0003","9.0392","0.0004","15.3871","0.0008","90","","90","","90","","738.55","0.07","299","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4-Hydroxyphenylacetic acid","","- C8 H8 O3 -","- C8 H8 O3 -","- C32 H32 O12 -","4","1","YA6248","Sandra Gracin; Andreas Fischer","4-Hydroxyphenylacetic acid","Acta Crystallographica Section E","2005","61","6","o1919","o1920","10.1107/S1600536805016405","","","0.71073","MoKα","","0.063","0.044","","","0.099","0.111","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206113","27.871","0.002","4.6083","0.0003","17.3806","0.0015","90","","90.949","0.007","90","","2232","0.3","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(2-Cyanomethoxy-6-methoxyphenoxy)acetonitrile","","- C11 H10 N2 O3 -","- C11 H10 N2 O3 -","- C88 H80 N16 O24 -","8","1","AT6011","Sancak, Kemal","(2-Cyanomethoxy-6-methoxyphenoxy)acetonitrile","Acta Crystallographica Section E","2005","61","7","o2015","o2017","10.1107/S1600536805015837","","","0.71073","MoKα","","0.073","0.043","","","0.103","0.113","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206114","8.1578","0.0008","10.8246","0.0012","12.1665","0.0011","75.445","0.008","89.69","0.008","74.082","0.008","997.68","0.18","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","Poly[[[diaquabis(pyridine-4-carboxamide-κN^1^)cobalt(II)]-μ~2~- squarato-κO:O'] dihydrate]","","- C16 H20 Co N4 O10 -","- C16 H20 Co N4 O10 -","- C32 H40 Co2 N8 O20 -","2","1","AT6015","Uçar, İbrahim; Bulut, Ahmet","Poly[[[diaquabis(pyridine-4-carboxamide-κ<i>N</i>^1^)cobalt(II)]-μ~2~-squarato-κ<i>O</i>:<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2005","61","7","m1320","m1323","10.1107/S1600536805018295","","","0.71073","MoKα","","0.084","0.056","","","0.148","0.164","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206115","10.6294","0.0019","13.299","0.002","13.702","0.002","104.778","0.003","95.84","0.003","91.828","0.003","1859.8","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","10''-(4-Methoxybenzylidene)-5''-(4-methoxyphenyl)-4'-(4-methoxyphenyl)-1'- methyl-2,3,2'',3'',7'',8'',9'',10''-octahydro-1H,5''H,6''H-indole-3-spiro-2'- pyrrolidine-3'-spiro-2''-cyclohepteno[1,2-d]thiazolo[3,2-a]pyrimidine-2,3''- dione","","- C44 H42 N4 O5 S -","- C44 H42 N4 O5 S -","- C88 H84 N8 O10 S2 -","2","1","AT6016","Chen, Hong-Liang; Feng, Ya-Qing; Hu, Xiao-Fen; Liu, Xin-Gang","10''-(4-Methoxybenzylidene)-5'',4'-bis(4-methoxyphenyl)-1'-methyl-2,3,2'',3'',7'',8'',9'',10''-octahydro-1<i>H</i>,5''<i>H</i>,6''<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-cyclohepteno[1,2-<i>d</i>]thiazolo[3,2-<i>a</i>]pyrimidine-2,3''-dione","Acta Crystallographica Section E","2005","61","7","o2086","o2088","10.1107/S1600536805017939","","","0.71073","MoKα","","0.126","0.055","","","","0.14","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206116","15.1169","0.0018","10.7393","0.0013","10.2017","0.0013","90","","95.839","0.003","90","","1647.6","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yloxy)benzoic acid isopropyl ester","","- C17 H18 N4 O3 -","- C17 H18 N4 O3 -","- C68 H72 N16 O12 -","4","1","AT6017","Qiong Chen; Qiong-You wu; Xiao-Wei Hu; Guang-Fu Yang","Isopropyl 2-(5,7-dimethyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-2-yloxy)benzoate","Acta Crystallographica Section E","2005","61","7","o2079","o2080","10.1107/S1600536805017885","","","0.71073","MoKα","","0.104","0.059","","","0.135","0.159","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206117","8.7619","0.0005","9.8234","0.0007","18.5527","0.001","90","","92.27","0.004","90","","1595.61","0.17","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(2-Bromo-4,5-dimethoxybenzyloxy)phthalonitrile","","- C17 H13 Br N2 O3 -","- C17 H13 Br N2 O3 -","- C68 H52 Br4 N8 O12 -","4","1","AT6018","Ocak Ískeleli, Nazan; Atalay, Şehriman; Ağar, Erbil; Akdemir, Nesuhi","4-(2-Bromo-4,5-dimethoxybenzyloxy)phthalonitrile","Acta Crystallographica Section E","2005","61","7","o2294","o2295","10.1107/S1600536805020076","","","0.71073","MoKα","","0.066","0.043","","","0.109","0.127","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206118","14.66","0.03","12.62","0.03","15.14","0.03","90","","96.62","0.03","90","","2782","10","293","2","293","2","","","","","","","","3","P 1 2/n 1","-P 2yac","13","p-cumylcalix[4]arene‒para-xylene (1/1)","4-(2-Phenylisopropyl)calix[4]arene‒1,4-dimethylbenzene (1/1)","","- C72 H74 O4 -","- C72 H70 O4 -","- C144 H140 O8 -","2","0.5","BD6001","Abdelhak, Ettahiri; Merle, Daphne; Perrin, Monique; Thozet, Alain","<i>p</i>-Cumylcalix[4]arene‒<i>para</i>-xylene (1/1)","Acta Crystallographica Section E","2005","61","7","o2001","o2002","10.1107/S1600536805016442","","","0.71073","MoKα","","0.0993","0.0549","","","0.1333","0.1547","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206119","13.151","0.003","7.166","0.0014","14.7","0.003","90","","97.53","0.03","90","","1373.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-(4-Methoxyphenyl)-1-phenylpyrazolidin-3-one","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C64 H64 N8 O8 -","4","1","BD6003","Shi, Hong; Zhu, Hong-Jun; Yin, Peng-Wei; Wang, Jin-Tang; Shi, Xiao-Lan","5-(4-Methoxyphenyl)-1-phenylpyrazolidin-3-one","Acta Crystallographica Section E","2005","61","7","o2246","o2247","10.1107/S1600536805019227","","","0.71073","MoKα","","0.0772","0.048","","","0.143","0.1621","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206120","4.8966","0.0008","7.2049","0.0012","14.719","0.002","90","","90","","90","","519.28","0.14","168","2","168","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Methylimidazolidinetrione","","- C4 H4 N2 O3 -","- C4 H4 N2 O3 -","- C16 H16 N8 O12 -","4","1","BD6004","Rodriguez, Mark A.; Andrews, Nicholas L.; Boyle, Timothy J.; Frazer, Colleen S.","<i>N</i>-Methylimidazolidinetrione","Acta Crystallographica Section E","2005","61","7","o2288","o2290","10.1107/S1600536805019690","","","0.71073","MoKα","","0.0401","0.0313","","","0.0761","0.0812","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206121","3.823","0.0014","15.99","0.005","13.1","0.004","90","","99.768","0.009","90","","789.2","0.5","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(3-acetylpyridine)copper(I)]-μ~3~-chloro]","","- C14 H14 Cl2 Cu2 N2 O2 -","- C14 H14 Cl2 Cu2 N2 O2 -","- C28 H28 Cl4 Cu4 N4 O4 -","2","0.5","BH6008","Lennartson, Anders; Salo, Kent; Håkansson, Mikael","<i>catena</i>-Poly[[(3-acetylpyridine)copper(I)]-μ~3~-chloro]","Acta Crystallographica Section E","2005","61","7","m1261","m1263","10.1107/S1600536805017150","","","0.71073","MoKα","","0.0779","0.0529","","","0.131","0.1424","","","","","","0.908","","","","has coordinates,has Fobs","249787","2020-10-21","18:00:00",""
"2206122","12.066","0.0005","18.2275","0.0008","15.1284","0.0006","90","","93.774","0.001","90","","3320","0.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(2-methyl-2-phenylpropyl)(pyridine-3-carboxylato)tin(IV)","","- C36 H43 N O2 Sn -","- C36 H43 N O2 Sn -","- C144 H172 N4 O8 Sn4 -","4","1","BH6011","Tian, Lai-Jin; Sun, Yu-Xi; Yang, Min; Yang, Guo-Ming","Tris(2-methyl-2-phenylpropyl)(pyridine-3-carboxylato)tin(IV)","Acta Crystallographica Section E","2005","61","7","m1346","m1347","10.1107/S1600536805018635","","","0.71073","MoKα","","0.0384","0.0299","","","0.0745","0.0795","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206123","10.6177","0.0008","17.6052","0.0013","14.1076","0.001","90","","105.897","0.002","90","","2536.2","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Z)-Ethyl 3-(4-methylphenyl)-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","","- C30 H28 N O2 P -","- C30 H28 N O2 P -","- C120 H112 N4 O8 P4 -","4","1","BH6012","Huang, Xiao-Bo; Xu, Rong; Ding, Jin-Chang; Wu, Hua-Yue; Zhang, Xi-Chang; Liu, Miao-Chang; Xiao, Hong-Ping","(<i>Z</i>)-Ethyl 3-(4-methylphenyl)-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","Acta Crystallographica Section E","2005","61","7","o2196","o2197","10.1107/S1600536805018647","","","0.71073","MoKα","","0.0899","0.0668","","","0.139","0.1495","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206124","10.4162","0.0014","16.693","0.002","15.536","0.002","90","","97.474","0.002","90","","2678.4","0.6","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[μ-pyruvic acid benzoylhydrazonato(2-)]bis[bis(4-chlorobenzyl)ethanoltin(IV)]","","- C52 H52 Cl4 N4 O8 Sn2 -","- C52 H52 Cl4 N4 O8 Sn2 -","- C104 H104 Cl8 N8 O16 Sn4 -","2","0.5","BR6193","Min Hong; Handong Yin; Daqi Wang; Haolong Xu","Bis[μ-pyruvic acid benzoylhydrazonato(2‒)]bis[bis(4-chlorobenzyl)ethanoltin(IV)]","Acta Crystallographica Section E","2005","61","7","m1248","m1250","10.1107/S1600536805016910","","","0.71073","MoKα","","0.0542","0.0336","","","0.0865","0.1059","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206125","18.1814","0.0008","18.1814","0.0008","8.546","0.0007","90","","90","","90","","2825","0.3","298","2","298","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","cyclo-Tetrakis{μ-1-[2-(2-oxidoethylamino)ethyliminomethyl]naphthalen-2- olato}tetranickel(II)","","- C60 H64 N8 Ni4 O8 -","- C60 H64 N8 Ni4 O8 -","- C120 H128 N16 Ni8 O16 -","2","0.25","BR6196","Ma, Ji-Long; You, Zhong-Lu; Zhu, Hai-Liang","<i>cyclo</i>-Tetrakis{μ-1-[2-(2-oxidoethylamino)ethyliminomethyl]naphthalen-2-olato}tetranickel(II)","Acta Crystallographica Section E","2005","61","7","m1258","m1260","10.1107/S1600536805017058","","","0.71073","MoKα","","0.0621","0.0486","","","0.1156","0.1233","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206126","14.4166","0.0009","7.7234","0.0005","18.6868","0.0011","90","","107.421","0.001","90","","1985.2","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Mn N2 O8 S -","- C19 H16 Mn N2 O8 S -","- C76 H64 Mn4 N8 O32 S4 -","4","1","BR6197","Fan, Sai-Rong; Zhu, Long-Guan","<i>catena</i>-Poly[[<i>cis</i>-diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ~2~-5-sulfonatosalicylato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","7","m1298","m1300","10.1107/S1600536805017861","","","0.71073","MoKα","","0.0333","0.0303","","","0.0819","0.0839","","","","","","1.069","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206127","8.2289","0.0009","15.2809","0.0017","23.793","0.003","90","","95.946","0.002","90","","2975.8","0.6","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pyridine{4,4',6,6'-tetrabromo-2,2'-[1,2- phenylenebis(nitrilomethylidyne)]diphenolato}zinc(II) dimethylformamide solvate","","- C28 H22 Br4 N4 O3 Zn -","- C28 H22 Br4 N4 O3 Zn -","- C112 H88 Br16 N16 O12 Zn4 -","4","1","BR6198","Yu Wu; Zongqiu Hu; Mingtian Li; Xucheng Fu","Pyridine{4,4',6,6'-tetrabromo-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato}zinc(II) dimethylformamide solvate","Acta Crystallographica Section E","2005","61","7","m1352","m1353","10.1107/S1600536805018787","","","0.71073","MoKα","","0.0777","0.0445","","","0.119","0.1616","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206128","13.6402","0.0009","10.4097","0.0006","18.443","0.0011","90","","99.756","0.001","90","","2580.9","0.3","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-[α-(4-Methoxyphenyl)-β-(4-chlorophenyl)vinyl]-2-methyl-1-phenylsulfonyl- 1H-indole","","- C30 H24 Cl N O3 S -","- C30 H24 Cl N O3 S -","- C120 H96 Cl4 N4 O12 S4 -","4","1","BT6662","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; P. Jaisankar; P. C. Srinivasan","3-[β-(4-Chlorophenyl)-α-(4-methoxyphenyl)vinyl]-2-methyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","7","o2227","o2229","10.1107/S1600536805017472","","","0.71073","MoKα","","0.1045","0.0851","","","0.2563","0.277","","","","","","1.052","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206129","8.2023","0.0005","11.7111","0.0007","25.465","0.0015","102.102","0.001","90.014","0.001","103.949","0.001","2317.9","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","2'-Benzoyl-1'-(4-chlorophenyl)-5',6',7',7a'-tetrahydrospiro[indan- 2,3'(2'H)-1H-pyrrolizidine]-1,3-dione","","- C28 H22 Cl N O3 -","- C28 H22 Cl N O3 -","- C112 H88 Cl4 N4 O12 -","4","2","BT6673","S. Kalyanasundaram; S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Poornachandran; R. Raghunathan","2'-Benzoyl-1'-(4-chlorophenyl)-5',6',7',7a'-tetrahydrospiro[indan-2,3'(2'<i>H</i>)-1<i>H</i>-pyrrolizine]-1,3-dione","Acta Crystallographica Section E","2005","61","7","o2158","o2160","10.1107/S1600536805015928","","","0.71073","MoKα","","0.056","0.0462","","","0.1338","0.1429","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206130","5.357","0.002","8.232","0.003","10.172","0.004","96.88","0.03","104.47","0.03","102.11","0.03","417.6","0.3","293","2","293","2","","","","","","","","4","P 1","P 1","1","L-Asparaginium Nitrate","L-Asparaginium nitrate","","- C4 H9 N3 O6 -","- C4 H9 N3 O6 -","- C8 H18 N6 O12 -","2","2","BT6674","A. Aarthy; K. Anitha; S. Athimoolam; S. Asath Bahadur; R.K. Rajaram","<small>L</small>-Asparaginium nitrate","Acta Crystallographica Section E","2005","61","7","o2042","o2044","10.1107/S1600536805017496","","","0.71073","MoKα","","0.0638","0.0577","","","0.1678","0.1891","","","","","","1.134","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206131","8.9769","0.0009","14.3789","0.0013","10.0589","0.001","90","","101.755","0.008","90","","1271.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-4-Methoxy-2-[(4-nitrophenyl)iminomethyl]phenol","","- C14 H12 N2 O4 -","- C14 H12 N2 O4 -","- C56 H48 N8 O16 -","4","1","BT6675","Kos̨ar, Bas̨ak; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-4-Methoxy-2-[(4-nitrophenyl)iminomethyl]phenol","Acta Crystallographica Section E","2005","61","7","o2106","o2108","10.1107/S1600536805018155","","","0.71073","MoKα","","0.1155","0.0418","","","0.0901","0.1044","","","","","","0.817","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206132","27.883","0.002","7.1237","0.0007","14.7975","0.001","90","","111.524","0.004","90","","2734.3","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(E)-2-Ethoxy-6-[(4-nitrophenyl)iminomethyl]phenol","","- C15 H14 N2 O4 -","- C15 H14 N2 O4 -","- C120 H112 N16 O32 -","8","1","BT6676","Koşar, Başak; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-2-Ethoxy-6-[(4-nitrophenyl)iminomethyl]phenol","Acta Crystallographica Section E","2005","61","7","o2109","o2111","10.1107/S1600536805018167","","","0.71073","MoKα","","0.085","0.0349","","","0.0625","0.0685","","","","","","0.809","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206133","14.8973","0.0011","8.9581","0.0007","18.9941","0.0014","90","","97.658","0.001","90","","2512.2","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[α-(4-Methoxyphenyl)-β-phenylvinyl]-2-methyl-1-phenylsulfonyl-1H-indole","","- C30 H25 N O3 S -","- C30 H25 N O3 S -","- C120 H100 N4 O12 S4 -","4","1","BT6677","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; P. Jaisankar; P. C. Srinivasan","3-[α-(4-Methoxyphenyl)-β-phenylvinyl]-2-methyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","7","o2221","o2223","10.1107/S1600536805018921","","","0.71073","MoKα","","0.0665","0.0483","","","0.1292","0.1425","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206134","10.8372","0.0006","17.2384","0.001","12.722","0.0007","90","","90.269","0.001","90","","2376.6","0.2","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(2,5-Dimethylbenzyl)-3-phenylsulfanyl-1-phenylsulfonyl-1H-indole","","- C29 H25 N O2 S2 -","- C29 H25 N O2 S2 -","- C116 H100 N4 O8 S8 -","4","1","BT6678","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; N. Sureshbabu; P. C. Srinivasan","2-(2,5-Dimethylbenzyl)-3-phenylsulfanyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","7","o2224","o2226","10.1107/S1600536805018933","","","0.71073","MoKα","","0.0609","0.0493","","","0.1334","0.1431","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206135","10.485","0.004","33.972","0.008","12.544","0.004","90","","102.12","0.03","90","","4369","2","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","syn-exo-4,7-Bis(trimethylsilyl)-4,7-dihydro[2.2]paracyclophane","","- C22 H34 Si2 -","- C22 H34 Si2 -","- C176 H272 Si16 -","8","2","BT6679","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Savinsky, Rainer","<i>syn</i>-<i>exo</i>-4,7-Bis(trimethylsilyl)-4,7-dihydro[2.2]paracyclophane","Acta Crystallographica Section E","2005","61","7","o2175","o2176","10.1107/S1600536805018349","","","0.71073","MoKα","","0.1304","0.0549","","","0.1225","0.1642","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206136","13.906","0.004","13.906","0.004","16.263","0.005","90","","90","","90","","3144.9","1.6","143","2","143","2","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","syn-exo-4,7,12,15-Tetrakis(trimethylsilyl)-4,7,12,15- tetrahydro[2.2]paracyclophane","","- C28 H52 Si4 -","- C28 H52 Si4 -","- C112 H208 Si16 -","4","0.25","BT6680","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Savinsky, Rainer","<i>syn</i>-<i>exo</i>-4,7,12,15-Tetrakis(trimethylsilyl)-4,7,12,15-tetrahydro[2.2]paracyclophane","Acta Crystallographica Section E","2005","61","7","o2177","o2178","10.1107/S1600536805018350","","","0.71073","MoKα","","0.0489","0.0404","","","0.1065","0.1142","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206137","6.6033","0.001","12.3957","0.0018","6.7152","0.001","90","","102.783","0.012","90","","536.03","0.14","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4-Bis(dibromomethylidene)cyclohexane","","- C8 H8 Br4 -","- C8 H8 Br4 -","- C16 H16 Br8 -","2","0.5","BT6681","Jones, Peter G.; Kämpen, Jan; Bubenitschek, Peter; Hopf, Henning","1,4-Bis(dibromomethylidene)cyclohexane: crystal packing with Br···Br and Br···π contacts","Acta Crystallographica Section E","2005","61","7","o2179","o2180","10.1107/S1600536805018374","","","0.71073","MoKα","","0.0652","0.0415","","","0.0976","0.1051","","","","","","1.126","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206138","5.8205","0.0005","18.0795","0.0015","10.6725","0.001","90","","94.324","0.006","90","","1119.89","0.17","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-2,2,6,6-Tetramethyl-4-hepten-3-one","","- C11 H20 O -","- C11 H20 O -","- C44 H80 O4 -","4","1","BT6682","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Mlynek, Cornelia","(<i>E</i>)-2,2,6,6-Tetramethylhept-4-en-3-one","Acta Crystallographica Section E","2005","61","7","o2181","o2182","10.1107/S1600536805018386","","","0.71073","MoKα","","0.0714","0.0401","","","0.0886","0.0981","","","","","","0.928","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206139","8.8352","0.0004","10.0584","0.0007","11.4944","0.0008","71.2","0.03","88.61","0.04","69.86","0.04","903.5","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Tricarbonyl[η^4^-2-phenyl-4-(3-phenylallylidene)-4H-oxazol-5-onato]iron","","- C21 H13 Fe N O5 -","- C21 H13 Fe N O5 -","- C42 H26 Fe2 N2 O10 -","2","1","BT6683","Imhof, Wolfgang; Garms, Stefan","Tricarbonyl[η^4^-2-phenyl-4-(3-phenylallylidene)-4<i>H</i>-oxazol-5-one]iron(0)","Acta Crystallographica Section E","2005","61","7","m1413","m1415","10.1107/S1600536805019483","","","0.71073","MoKα","","0.0533","0.0393","","","0.0911","0.0974","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206140","7.073","0.003","7.423","0.003","7.711","0.003","83.87","0.03","81.98","0.03","62.24","0.03","354.3","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","5-Chloro-2-nitroaniline","","- C6 H5 Cl N2 O2 -","- C6 H5 Cl N2 O2 -","- C12 H10 Cl2 N4 O4 -","2","1","BT6685","Ng, Seik Weng","5-Chloro-2-nitroaniline","Acta Crystallographica Section E","2005","61","7","o2299","o2300","10.1107/S1600536805019707","","","0.71073","MoKα","","0.048","0.041","","","0.118","0.122","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206141","12.409","0.003","3.768","0.002","13.349","0.003","90","","104.42","0.03","90","","604.5","0.4","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,3-Dihydroxybenzaldehyde","","- C7 H6 O3 -","- C7 H6 O3 -","- C28 H24 O12 -","4","1","BT6686","Ng, Seik Weng","2,3-Dihydroxybenzaldehyde","Acta Crystallographica Section E","2005","61","7","o2301","o2302","10.1107/S1600536805019719","","","0.71073","MoKα","","0.04","0.036","","","0.108","0.111","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206142","6.9774","0.0002","10.1668","0.0003","27.6762","0.0007","90","","96.495","0.002","90","","1950.69","0.09","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,4-dichloronitrobenzene‒aniline (2/1)","","- C18 H13 Cl4 N3 O4 -","- C18 H13 Cl4 N3 O4 -","- C72 H52 Cl16 N12 O16 -","4","1","BT6687","Sarah A. Barnett; Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","3,4-Dichloro-1-nitrobenzene‒aniline (2/1)","Acta Crystallographica Section E","2005","61","7","o2318","o2319","10.1107/S1600536805019999","","","0.71073","MoKα","","0.0695","0.0382","","","0.0713","0.0805","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206143","9.624","0.006","12.811","0.007","13.392","0.009","112.231","0.005","96.527","0.006","90.078","0.006","1516.7","1.6","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","[2-Carboxy-2,2',2''-nitrilotris(ethanethiolato)- κ^4^N,S,S',S''](triphenylphosphine-κP)rhenium(III) acetone solvate","","- C28 H33 N O3 P Re S3 -","- C28 H33 N O3 P Re S3 -","- C56 H66 N2 O6 P2 Re2 S6 -","2","1","CF6427","Eik Schiller; Werner Kraus; Günter Reck; Hartmut Spies; Hans-Jürgen Pietzsch","[2-Carboxy-2,2',2''-nitrilotris(ethanethiolato)-κ^4^<i>N</i>,<i>S</i>,<i>S</i>',<i>S</i>''](triphenylphosphine-κ<i>P</i>)rhenium(III) acetone solvate","Acta Crystallographica Section E","2005","61","7","m1373","m1375","10.1107/S1600536805018660","","","0.71073","MoKα","","0.09","0.0737","","","0.2027","0.214","","","","","","0.986","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206144","5.2736","0.0005","7.7366","0.0006","13.6863","0.001","89.184","0.006","83.433","0.006","74.64","0.006","534.84","0.08","293","","293","","","","","","","","","3","P -1","-P 1","2","","2-Phenoxybenzoic acid","","- C13 H10 O3 -","- C13 H10 O3 -","- C26 H20 O6 -","2","1","CF6429","Andrew Parkin; Suzanne M. Harte; Donnie Carmichael; Scott Currie; Lorna Drummond; Adam Haahr; Kevin Haggerty; Tracey Hunter; André Lamarque; Loretta Lawton; Craig Martin; Jennifer E. Mathieson; Thomas McGlone; Julie McGregor; Liam McMillan; Louise Robertson; Robert Thatcher; Steven Vance; Chick C. Wilson","2-Phenoxybenzoic acid at room temperature","Acta Crystallographica Section E","2005","61","7","o2280","o2282","10.1107/S1600536805019495","","","0.71073","MoKα","","0.0811","0.0538","","0.1637","0.1561","0.1637","","","","","","0.9314","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206145","9.2618","0.0004","23.6323","0.0008","15.1606","0.0007","90","","103.023","0.004","90","","3233","0.2","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","7,11-[Butane-1,4-diyldioxydi-o-phenylenedimethylene]-6,6-dichloro- 4,4-bis(pyrrolidin-1-yl)-2λ^5^,4λ^5^,6λ^5^-triphosphaza-1,3,5,7,11- pentaazaspiro[5.5]undeca-1,3,5-triene","","- C29 H42 Cl2 N7 O2 P3 -","- C29 H42 Cl2 N7 O2 P3 -","- C116 H168 Cl8 N28 O8 P12 -","4","1","CF6432","Tercan, Barış; Hökelek, Tuncer; Büyükgüngör, Orhan; Asmafiliz, Nuran; İlter, Elif Ece; Kılıç, Zeynel","7,11-(Butane-1,4-diyldioxydi-<i>o</i>-phenylenedimethylene)-6,6-dichloro-4,4-bis(pyrrolidin-1-yl)-2λ^5^,4λ^5^,6λ^5^-triphosphaza-1,3,5,7,11-pentaazaspiro[5.5]undeca-1,3,5-triene","Acta Crystallographica Section E","2005","61","7","o2145","o2147","10.1107/S1600536805018362","","","0.71073","MoKα","","0.0425","0.0335","","","0.0851","0.089","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206146","11.768","0.004","8.164","0.003","20.428","0.007","90","","105.474","0.006","90","","1891.5","1.1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2-Oxido-1-naphthaldehyde (2-hydroxybenzoyl)hydrazonato]pyridinenickel(II)","","- C23 H17 N3 Ni O3 -","- C23 H17 N3 Ni O3 -","- C92 H68 N12 Ni4 O12 -","4","1","CF6433","Ming-Li Liu; Jian-Min Dou; Da-Qi Wang; Da-Cheng Li","[2-Oxido-1-naphthaldehyde (2-hydroxybenzoyl)hydrazonato]pyridinenickel(II)","Acta Crystallographica Section E","2005","61","7","m1366","m1367","10.1107/S1600536805018672","","","0.71073","MoKα","","0.0562","0.0377","","","0.0821","0.0921","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206147","15.005","0.003","10.2992","0.0019","19.602","0.004","90","","97.984","0.003","90","","2999.9","1","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Cholesteryl isobutylcarbonate","","- C32 H54 O3 -","- C32 H54 O3 -","- C128 H216 O12 -","4","2","CF6437","Park, Young Ja; Bae, Jinmi; Lah, Myoung Soo","Cholesteryl isobutylcarbonate","Acta Crystallographica Section E","2005","61","7","o2312","o2314","10.1107/S1600536805020118","","","0.71073","MoKα","","0.0752","0.0578","","","0.1543","0.1689","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206148","8.4402","0.0007","22.1502","0.0019","14.5043","0.0012","90","","95.835","0.002","90","","2697.6","0.4","292","2","292","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Diethyl 2,5-bis(3,4,5-trimethoxyphenyl)furan-3,4-dicarboxylate 0.16-hydrate","","- C28 H32.32 O11.16 -","- C28 H32.32 O11.16 -","- C112 H129.28 O44.64 -","4","1","CI6584","Hu, Sheng-Li; Wu, An-Xin","Diethyl 2,5-bis(3,4,5-trimethoxyphenyl)furan-3,4-dicarboxylate 0.16-hydrate","Acta Crystallographica Section E","2005","61","7","o2030","o2032","10.1107/S1600536805016430","","","0.71073","MoKα","","0.0996","0.0638","","","0.1579","0.1803","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","194389","2020-10-21","18:00:00",""
"2206149","7.846","0.005","16.758","0.014","12.94","0.015","90","","98.374","0.012","90","","1683","3","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methyl-4-(4-nitrophenyl)‒6-oxo-1-phenyl-4,5-dihydropyrazolo[3,4-b]pyridine","","- C19 H16 N4 O3 -","- C19 H16 N4 O3 -","- C76 H64 N16 O12 -","4","1","CI6587","Jiang, Hong; Tu, Shu-Jiang; Zhu, Song-Lei","3-Methyl-4-(4-nitrophenyl)-6-oxo-1-phenyl-4,5-dihydropyrazolo[3,4-<i>b</i>]pyridine","Acta Crystallographica Section E","2005","61","7","o2074","o2075","10.1107/S1600536805017800","","","0.7107","MoKα","","0.0739","0.0616","","","0.1458","0.1539","","","","","","1.131","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206150","7.078","0.001","11.597","0.002","13.924","0.002","77.89","0.01","75.41","0.01","79.35","0.01","1070.9","0.3","289","2","289","2","","","","","","","","6","P -1","-P 1","2","","Bis(trimethylaminium) hexaaquazinc(II) bis(naphthalene-1,6-disulfonate)","","- C32 H56 N2 O18 S4 Zn -","- C32 H56 N2 O18 S4 Zn -","- C32 H56 N2 O18 S4 Zn -","1","0.5","CI6590","Wei-Guang San; Hai Feng; Li Li; Zhi-Min Jin; Mao-Lin Hu","Bis(triethylaminium) hexaaquazinc(II) bis(naphthalene-1,6-disulfonate)","Acta Crystallographica Section E","2005","61","7","m1363","m1365","10.1107/S160053680501888X","","","0.71073","MoKα","","0.0476","0.0366","","","0.1022","0.1061","","","","","","1.098","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206151","5.2029","0.0014","7.79","0.002","13.496","0.004","99.166","0.004","90.369","0.004","106.993","0.004","515.6","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","5-butyl-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one","","- C9 H14 N2 O S -","- C9 H14 N2 O S -","- C18 H28 N4 O2 S2 -","2","1","CI6591","Long, Tao; Zhou, Hong-Bin; Wu, An-Xin","5-Butyl-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","7","o2169","o2171","10.1107/S1600536805018465","","","0.71073","MoKα","","0.0726","0.0567","","","0.1516","0.1645","","","","","","1.061","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206152","27.942","0.009","14.203","0.006","8.353","0.003","90","","90.291","0.006","90","","3315","2","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","5,6,6a,7,8,8a-Hexahydro-6a,7-dihydroxy-13bH-indeno[2,1-c]phenanthren- 9(13cH)-one hemihydrate","","- C21 H21 O3.5 -","- C21 H21 O3.5 -","- C168 H168 O28 -","8","1","CI6592","Hong-Tao Mu; Lin Liu; Hai-Bin Song; He-Yang Li; Wen-Bin Chen","5,6,6a,7,8,8a-Hexahydro-6a,7-dihydroxy-13b<i>H</i>-indeno[2,1-<i>c</i>]phenanthren-9(13c<i>H</i>)-one hemihydrate","Acta Crystallographica Section E","2005","61","7","o2216","o2218","10.1107/S1600536805018891","","","0.71073","MoKα","","0.08","0.0432","","","0.0882","0.1017","","","","","","1.017","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206153","23.458","0.007","13.923","0.004","8.228","0.002","90","","101.163","0.005","90","","2636.5","1.3","292","2","292","2","","","","","","","","7","C 1 c 1","C -2yc","9","(MB)[PbI~3~].DMF","catena-Poly[[[3,7-bis(dimethylamino)phenazathionium] lead(II)-tri-μ-iodo] N,N'-dimethylformamide]","","- C19 H25 I3 N4 O Pb S -","- C19 H25 I3 N4 O Pb S -","- C76 H100 I12 N16 O4 Pb4 S4 -","4","1","CI6594","Ming-Tian Li; Qin-Ling Liao; Xu-Cheng Fu; Cheng-Gang Wang","<i>catena</i>-Poly[[[3,7-bis(dimethylamino)phenothiazonium] lead(II)-tri-μ-iodo] <i>N</i>,<i>N</i>'-dimethylformamide]","Acta Crystallographica Section E","2005","61","7","m1396","m1397","10.1107/S1600536805019331","","","0.71073","MoKα","","0.049","0.037","","","0.0682","0.0721","","","","","","0.926","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206154","7.8763","0.0003","25.0242","0.0007","12.7232","0.0003","90","","101.275","0.001","90","","2459.32","0.13","297","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaqua(cyclohexane-1,1-diacetato-κ^2^O,O')(phenanthroline- κ^2^N,N')manganese(II) trihydrate","","- C22 H32 Mn N2 O9 -","- C22 H32 Mn N2 O9 -","- C88 H128 Mn4 N8 O36 -","4","1","CI6595","Liang Shen; Li-Cheng Yan; Zhi-Min Jin; Yi-Jian Zhang","Diaqua(cyclohexane-1,1-diacetato-κ^2^<i>O,O</i>')(phenanthroline-κ^2^<i>N,N</i>')manganese(II) trihydrate","Acta Crystallographica Section E","2005","61","7","m1419","m1421","10.1107/S1600536805019665","","","0.7107","MoKα","","","0.035","","","","0.075","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206155","11.995","0.004","11.002","0.004","19.965","0.007","90","","101.419","0.006","90","","2582.6","1.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(2,6-Dihydroxyphenyl)-3,3,6,6-tetramethyl-N-(4-methylphenyl)- 1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridine","","- C30 H33 N O4 -","- C30 H33 N O4 -","- C120 H132 N4 O16 -","4","1","CI6596","Hong Jang; Tuanjie Li; Shujiang Tu; Xiang Zou","9-(2,6-Dihydroxyphenyl)-3,3,6,6-tetramethyl-<i>N</i>-(4-methylphenyl)-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridine","Acta Crystallographica Section E","2005","61","7","o2296","o2298","10.1107/S1600536805019720","","","0.71073","MoKα","","0.2283","0.0733","","","0.1689","0.2191","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206156","29.409","0.004","5.8286","0.0014","11.73","0.003","90","","101.22","0.008","90","","1972.2","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Benzyloxy-6-fluoropyridazine","","- C11 H9 F N2 O -","- C11 H9 F N2 O -","- C88 H72 F8 N16 O8 -","8","2","CI6597","Fang-Zhong Hu; Min Zhang; Hai-Bin Song; Xiao-Mao Zou; Hua-Zheng Yang","3-Benzyloxy-6-fluoropyridazine","Acta Crystallographica Section E","2005","61","7","o2241","o2242","10.1107/S1600536805019161","","","0.71073","MoKα","","0.1669","0.0532","","","0.1221","0.1623","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206157","10.9285","0.0006","21.3431","0.0007","16.8988","0.0008","90","","98.804","0.004","90","","3895.2","0.3","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(1,10-phenanthroline-κ^2^N,N')iron(II) squarate octahydrate","","- C40 H40 Fe N6 O12 -","- C40 H40 Fe N6 O12 -","- C160 H160 Fe4 N24 O48 -","4","1","CI6598","Uçar, İbrahim; Paşaoĝlu, Hümeyra; Büyükgüngör, Orhan; Bulut, Ahmet","Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')iron(II) squarate octahydrate","Acta Crystallographica Section E","2005","61","7","m1405","m1407","10.1107/S1600536805019550","","","0.71073","MoKα","","0.0651","0.0405","","","0.1043","0.1128","","","","","","0.961","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206158","10.949","0.004","9.344","0.003","18.961","0.005","90","","109.154","0.016","90","","1832.5","1","293","2","293","2","","","","","","","","3","P 1 c 1","P -2yc","7","exo spiroalcohol","2-Hydroxy-2'-oxo-1,2,3,3a,8,8a,1',2',3',4'-decahydrospiro[cyclopenta[a]indene- 3,1'-naphthalen]-8-yl acetate","","- C23 H22 O4 -","- C23 H22 O4 -","- C92 H88 O16 -","4","2","CI6600","Hong-Tao Mu; He-Yang Li; Hai-Bin Song; Wen-Bin Chen","2-Hydroxy-2'-oxo-1,2,3,3a,8,8a,1',2',3',4'-decahydrospiro[cyclopenta[<i>a</i>]indene-3,1'-naphthalen]-8-yl acetate","Acta Crystallographica Section E","2005","61","7","o2305","o2307","10.1107/S1600536805019835","","","0.71073","MoKα","","0.0454","0.0338","","","0.0792","0.0873","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206159","16.547","0.004","6.053","0.002","16.924","0.004","90","","111.93","0.02","90","","1572.4","0.8","295","2","295","3","","","","","","","","5","P 1 2/a 1","-P 2ya","13","","5-Bromo-1H-indole-3-carbaldehyde 2-nitrophenylhydrazone hemihydrate","","- C16 H12 Br N4 O3.5 -","- C16 H12 Br N4 O3.5 -","- C64 H48 Br4 N16 O14 -","4","1","CI6605","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng","5-Bromo-1<i>H</i>-indole-3-carbaldehyde 2-nitrophenylhydrazone hemihydrate","Acta Crystallographica Section E","2005","61","7","o2308","o2309","10.1107/S1600536805020064","","","0.71073","MoKα","","0.0598","0.0382","","","0.0994","0.1101","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206160","11.8342","0.001","26.0933","0.0019","12.4701","0.0011","90","","116.845","0.006","90","","3435.7","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[N,N'-Diphenylureato(2-)][phthalocyaninato(2-)]titanium(IV)","","- C45 H26 N10 O Ti -","- C45 H26 N10 O Ti -","- C180 H104 N40 O4 Ti4 -","4","1","CV6506","Darwish, Wael; Harms, Klaus; Sundermeyer, Jörg","[<i>N</i>,<i>N</i>'-Diphenylureato(2{-})][phthalocyaninato(2{-})]titanium(IV)","Acta Crystallographica Section E","2005","61","7","m1280","m1282","10.1107/S1600536805015850","","","0.71073","MoKα","","","0.042","","","","0.0914","","","","","","0.804","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206161","7.507","0.005","20.018","0.014","9.6","0.007","90","","103.33","0.011","90","","1403.8","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Amino-4-(ferrocenyl)-5-(1H-1,2,4-triazol-1-yl)-1,3-thiazole","","- C15 H13 Fe N5 S -","- C15 H13 Fe N5 S -","- C60 H52 Fe4 N20 S4 -","4","1","CV6515","Shao, Ling; Hu, Yan; Zhou, Xin; Zhang, Qing; Jin, Zhong; Liu, Jian-Bing; Fang, Jian-Xin","2-Amino-4-(ferrocenyl)-5-(1<i>H</i>-1,2,4-triazol-1-yl)-1,3-thiazole","Acta Crystallographica Section E","2005","61","7","m1269","m1271","10.1107/S1600536805017186","","","0.71073","MoKα","","0.0474","0.0308","","","0.0736","0.0917","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206162","10.8522","0.0012","11.4576","0.0002","20.2987","0.0002","93.58","0.001","95.311","0.001","94.243","0.001","2500.1","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","1,2-Dibenzoyl-3,4-bis(4-methoxyphenyl)cyclobutane","","- C32 H28 O4 -","- C32 H28 O4 -","- C128 H112 O16 -","4","2","CV6516","Steyl, Gideon; Hill, Tania; Roodt, Andreas","1,2-Dibenzoyl-3,4-bis(4-methoxyphenyl)cyclobutane","Acta Crystallographica Section E","2005","61","7","o1978","o1980","10.1107/S1600536805016806","","","0.71073","MoKα","","0.0761","0.046","","","0.1027","0.1162","","","","","","1.037","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206163","7.5001","0.0008","11.992","0.0013","14.111","0.0014","90.867","0.01","93.531","0.007","107.084","0.008","1210.1","0.2","100","2","100","","","","","","","","","4","P -1","-P 1","2","","N-[(1E)-(2,4-Dinitrophenyl)methylene]aniline","","- C13 H9 N3 O4 -","- C13 H9 N3 O4 -","- C52 H36 N12 O16 -","4","2","CV6518","Barys, Maciej; Ciunik, Zbigniew","<i>N</i>-[(<i>E</i>)-(2,4-Dinitrophenyl)methylene]aniline","Acta Crystallographica Section E","2005","61","7","o1967","o1969","10.1107/S1600536805016922","","","0.71073","MoKα","","0.0821","0.0429","","","0.0789","0.0859","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206164","7.8","0.0018","9.366","0.002","8.474","0.002","90","","96.114","0.004","90","","615.5","0.2","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquadibromobis(1H-imidazole)nickel(II)","","- C6 H12 Br2 N4 Ni O2 -","- C6 H12 Br2 N4 Ni O2 -","- C12 H24 Br4 N8 Ni2 O4 -","2","0.5","CV6519","Zhang, Hui; Fang, Liang; Yuan, Runzhang","Diaquadibromobis(1<i>H</i>-imidazole)nickel(II)","Acta Crystallographica Section E","2005","61","7","m1391","m1392","10.1107/S1600536805019069","","","0.71073","MoKα","","0.0237","0.0203","","","0.0496","0.051","","","","","","1.054","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206165","9.071","0.002","9.546","0.002","11.506","0.003","66.45","0.004","71.709","0.004","74.49","0.004","855.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N'-(2-Fluorobenzylidene)-2-(quinolin-8-yloxy)acetohydrazide methanol solvate","","- C19 H18 F N3 O3 -","- C19 H18 F N3 O3 -","- C38 H36 F2 N6 O6 -","2","1","CV6520","Yong-Hong Wen; Shu-Sheng Zhang; Mao-Jie Li; Xue-Mei Li","<i>N</i>'-(2-Fluorobenzylidene)-2-(quinolin-8-yloxy)acetohydrazide methanol solvate","Acta Crystallographica Section E","2005","61","7","o2045","o2046","10.1107/S1600536805017575","","","0.71073","MoKα","","0.0503","0.0424","","","0.1135","0.1223","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206166","11.5192","0.0018","7.3222","0.0011","20.048","0.003","90","","90","","90","","1691","0.4","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-N-Methyl-1H-1,2,4-triazole-4-amino-5-mercapto-1,2,4-triazole","","- C5 H7 N7 S -","- C5 H7 N7 S -","- C40 H56 N56 S8 -","8","1","CV6521","Xu, Liang-Zhong; Yu, Guan-Ping; Xu, Feng-Ling; Li, Wei-Hua","4-Amino-3-(1,2,4-triazol-1-yl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","7","o2061","o2062","10.1107/S1600536805017587","","","0.71073","MoKα","","0.0478","0.0312","","","0.074","0.0832","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206167","18.476","0.004","11.494","0.002","8.4632","0.0017","90","","90","","90","","1797.3","0.6","292","2","292","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","1,2-Dimethyl-4,5-bis(phenoxymethyl)benzene","","- C22 H22 O2 -","- C22 H22 O2 -","- C88 H88 O8 -","4","0.5","CV6522","Guo-Dong Yin; Zhi-Guo Wang; An-Xin Wu","1,2-Dimethyl-4,5-bis(phenoxymethyl)benzene","Acta Crystallographica Section E","2005","61","7","o2148","o2149","10.1107/S1600536805018076","","","0.71073","MoKα","","0.0729","0.0447","","","0.1101","0.1201","","","","","","0.893","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206168","9.3444","0.0009","10.1558","0.001","11.6007","0.0011","99.651","0.002","100.645","0.002","102.014","0.002","1033.65","0.17","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-(4-methoxyphenyylsulfonamido)- 1H-pyrazole-3-carbonitrile","","- C18 H11 Cl2 F3 N4 O3 S -","- C18 H11 Cl2 F3 N4 O3 S -","- C36 H22 Cl4 F6 N8 O6 S2 -","2","1","CV6524","Zhang, Xiao-Hong; Zhong, Ping; Xiao, Hong-Ping; Hu, Mao-Lin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-(4-methoxyphenylsulfonamido)-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","7","o2134","o2135","10.1107/S160053680501812X","","","0.71073","MoKα","","0.0989","0.078","","","0.181","0.196","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206169","7.7987","0.0013","11.324","0.002","17.75","0.003","90","","100.625","0.003","90","","1540.7","0.5","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(3,4-Dichlorobenzoylmethyl)-1,2-benzisothiazol-3(2H)-one 1,1-dioxide","","- C15 H9 Cl2 N O4 S -","- C15 H9 Cl2 N O4 S -","- C60 H36 Cl8 N4 O16 S4 -","4","1","CV6525","Liang-Zhong Xu; Yong-Wei Huang; Guan-Ping Yu; Pu-Yong Zhang; Ya-Xun Yang","2-(3,4-Dichlorobenzoylmethyl)-1,2-benzisothiazol-3(2<i>H</i>)-one 1,1-dioxide","Acta Crystallographica Section E","2005","61","7","o2123","o2124","10.1107/S1600536805018301","","","0.71073","MoKα","","0.075","0.0401","","","0.0902","0.1066","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206170","19.9786","0.0017","5.355","0.0004","13.5855","0.0012","90","","107.507","0.002","90","","1386.1","0.2","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H21 N S2 -","- C13 H21 N S2 -","- C52 H84 N4 S8 -","4","1","CV6526","Muller, Alfred; Otto, Stefanus","Methyl 2-(cyclohexylamino)cyclopent-1-ene-1-dithiocarboxylate","Acta Crystallographica Section E","2005","61","7","o2198","o2199","10.1107/S1600536805018180","","","0.71073","MoKα","","","0.044","","","","0.1116","","","","","","0.833","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206171","6.287","0.0005","13.248","0.0009","22.25","0.0009","90","","90","","90","","1853.2","0.2","293","2","293","2","","","","","","","","5","P b c 21","P 2c -2b","29","","2-(Biphenyl-4-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one","","- C22 H19 N O2 S -","- C22 H19 N O2 S -","- C88 H76 N4 O8 S4 -","4","1","CV6528","Mahendra, M; Jayalakshmi, K.; Basappa; Rangappa, K. S.; Sridhar, M. A.; Shashidhara Prasad, J.","2-(Biphenyl-4-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one","Acta Crystallographica Section E","2005","61","7","o2315","o2317","10.1107/S1600536805019732","","","0.71073","MoKα","","0.067","0.045","","","0.0961","0.1097","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206172","8.6418","0.0004","11.8765","0.0006","18.2755","0.0012","90","","90","","90","","1875.69","0.18","193","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(3R,6S,7R,8R,9S,9aS)-Methyl 6,9-diacetoxy-7,8-diazidoperhydro- 5-oxothiazolo[3,2-a]azepine-3-carboxylate","","- C14 H17 N7 O7 S -","- C14 H17 N7 O7 S -","- C56 H68 N28 O28 S4 -","4","1","CV6529","Hörger, Rolf; Marsch, Michael; Geyer, Armin; Harms, Klaus","(3<i>R</i>,6<i>S</i>,7<i>R</i>,8<i>R</i>,9<i>S</i>,9a<i>S</i>)-Methyl 6,9-diacetoxy-7,8-diazidoperhydro-5-oxothiazolo[3,2-<i>a</i>]azepine-3-carboxylate","Acta Crystallographica Section E","2005","61","7","o2191","o2192","10.1107/S160053680501843X","","","0.71073","MoKα","","","0.0229","","","","0.0574","","","","","","1.029","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206173","5.925","0.0012","10.514","0.002","11.567","0.002","103.54","0.03","91.1","0.03","90.19","0.03","700.4","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","4-phenyl-1-(1-phenylethylidene)thiosemicarbazide","","- C15 H15 N3 S -","- C15 H15 N3 S -","- C30 H30 N6 S2 -","2","1","CV6531","Fangfang Jian; Ying Li; Hailian Xiao","4-Phenyl-1-(1-phenylethylidene)thiosemicarbazide","Acta Crystallographica Section E","2005","61","7","o2219","o2220","10.1107/S1600536805019070","","","0.71073","MoKα","","0.1717","0.0544","","","0.1323","0.1693","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206174","14.1805","0.0008","10.1822","0.0005","18.3636","0.001","90","","91.08","0.001","90","","2651","0.2","273","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N-{3-(4-methylphenyl)-6-[(Z)-(4-methylphenyl)methylidene]-2-phenyl- 2-azabicyclo[2.2.2]oct-5-ylidene}aniline","","- C34 H32 N2 -","- C34 H32 N2 -","- C136 H128 N8 -","4","1","CV6534","K. Ravikumar; B. Sridhar; M. Mahesh; V. V. Narayana Reddy","<i>N</i>-{3-(4-Methylphenyl)-6-[(<i>Z</i>)-(4-methylphenyl)methylidene]-2-phenyl-2-azabicyclo[2.2.2]oct-5-ylidene}aniline","Acta Crystallographica Section E","2005","61","7","o2277","o2279","10.1107/S1600536805019471","","","0.71073","MoKα","","0.0558","0.0427","","","0.1158","0.1274","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206175","9.407","0.004","10.776","0.004","18.174","0.007","84.279","0.005","86.952","0.005","84.89","0.005","1824","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(Acetonitrile-κN)[2-(3,5-dimethylpyrazol-1-yl)benzothiazole-κ^2^N,N'] (dinitrato-κ^2^O,O')cobalt(II)","","- C14 H14 Co N6 O6 S -","- C14 H14 Co N6 O6 S -","- C56 H56 Co4 N24 O24 S4 -","4","2","DN6222","Zhi-Gang Zhang; Yuan-Yuan Sun; Xiao-Ming Jiang","Acetonitrile[2-(3,5-dimethylpyrazol-1-yl)-1,3-benzothiazole]dinitratocobalt(II)","Acta Crystallographica Section E","2005","61","7","m1307","m1309","10.1107/S1600536805017794","","","0.71073","MoKα","","0.1012","0.0976","","","0.2061","0.2084","","","","","","1.198","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206176","6.6382","0.0006","11.4258","0.0006","18.2702","0.0016","90","","107.039","0.007","90","","1324.91","0.19","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Nitro-1-(2-phenylethyl)-1H-benzimidazole","","- C15 H13 N3 O2 -","- C15 H13 N3 O2 -","- C60 H52 N12 O8 -","4","1","DN6224","Sema Öztürk Yıldırım; Mehmet Akkurt; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","6-Nitro-1-(2-phenylethyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","7","o2038","o2039","10.1107/S1600536805017502","","","0.71073","MoKα","","0.0669","0.0419","","","0.1036","0.1131","","","","","","0.926","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206177","26.334","0.008","4.5962","0.0013","9.57","0.003","90","","90","","90","","1158.3","0.6","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1-(3-Nitrophenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C11 H10 N4 O3 -","- C11 H10 N4 O3 -","- C44 H40 N16 O12 -","4","1","DN6226","Jun Wan; Chun-Li Li; Xue-Mei Li; Ying Li; Shu-Sheng Zhang; Hong Xu; Ping-Kai Ouyang","1-(3-Nitrophenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","7","o1997","o1998","10.1107/S1600536805017198","","","0.71073","MoKα","","0.044","0.0384","","","0.0885","0.092","","","","","","1.139","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206178","7.02","0.003","8.121","0.004","16.888","0.007","90","","100.74","0.04","90","","945.9","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bipyridine bis[5-amino-1,3,4-thiadiazole-2(3H)-thione]","","- C14 H14 N8 S4 -","- C14 H14 N8 S4 -","- C28 H28 N16 S8 -","2","0.5","DN6230","Deng, Qian-Jun; Yao, Min-Xia; Zeng, Ming-Hua","4,4'-Bipyridine‒5-amino-1,3,4-thiadiazole-2(3<i>H</i>)-thione (1/2)","Acta Crystallographica Section E","2005","61","7","o2239","o2240","10.1107/S1600536805019136","","","0.71073","MoKα","","0.0723","0.0443","","","0.0962","0.109","","","","","","1.013","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206179","7.1407","0.0008","8.7188","0.001","16.8945","0.0019","90","","90","","90","","1051.8","0.2","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","triethylenediaminium dichloride dihydrate","1,4-diazaoniabicyclo[2.2.2]octane dichloride dihydrate","","- C6 H18 Cl2 N2 O2 -","- C6 H18 Cl2 N2 O2 -","- C24 H72 Cl8 N8 O8 -","4","1","DN6231","Thomas C. Lewis; Derek A. Tocher","A low-temperature determination of triethylenediaminium dichloride dihydrate","Acta Crystallographica Section E","2005","61","7","o2202","o2204","10.1107/S1600536805019124","","","0.71073","MoKα","","0.0208","0.0205","","","0.0523","0.0525","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206180","11.3798","0.0004","8.7584","0.0003","13.39","0.0006","90","","99.178","0.001","90","","1317.48","0.09","295","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 2-amino-4-methyl-6-phenyl-6H-1,3-thiazine-5-carboxylate","","- C13 H14 N2 O2 S -","- C13 H14 N2 O2 S -","- C52 H56 N8 O8 S4 -","4","1","DN6232","Lin, Xu-Feng","Methyl 2-amino-4-methyl-6-phenyl-6<i>H</i>-1,3-thiazine-5-carboxylate","Acta Crystallographica Section E","2005","61","7","o2207","o2208","10.1107/S1600536805019045","","","0.7107","MoKα","","","0.039","","","","0.106","","","","","","1.005","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206181","4.9836","0.001","7.6562","0.0015","25.698","0.005","90","","90","","90","","980.5","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","guaiphenesin","3-(2-Methoxyphenoxy)propane-1,2-diol","","- C10 H14 O4 -","- C10 H14 O4 -","- C40 H56 O16 -","4","1","FL6165","Yongli Wang; Ming Li; Lijun Liu; Lina Zhou; Jingkang Wang","3-(2-Methoxyphenoxy)propane-1,2-diol","Acta Crystallographica Section E","2005","61","7","o1999","o2000","10.1107/S1600536805016909","","","0.71073","MoKα","","0.0616","0.0482","","","0.14","0.1482","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206182","5.4122","0.0016","8.447","0.002","12.083","0.004","89.454","0.005","85.718","0.005","77.096","0.004","536.9","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","4-Amino-5-fluoropyrimidin-2(1H)-one‒2-amino-5-fluoropyrimidin-4(3H)-one‒water (1/1/1)","","- C8 H10 F2 N6 O3 -","- C8 H10 F2 N6 O3 -","- C16 H20 F4 N12 O6 -","2","1","FL6169","Hulme, Ashley T.; Tocher, Derek A.","4-Amino-5-fluoropyrimidin-2(1H)-one‒2-amino-5-fluoropyrimidin-4(3H)-one‒water (1/1/1)","Acta Crystallographica Section E","2005","61","7","o2112","o2113","10.1107/S1600536805018179","","","0.71073","MoKα","","0.057","0.0444","","","0.1152","0.1232","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206183","6.9395","0.0005","16.2519","0.0013","19.1287","0.0015","67.382","0.001","86.524","0.001","81.535","0.001","1969.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Heptaaqua[tetrachlorophthalato(2-)]praseodymium(III) tetrachlorophthalate(-) tetrachlorophthalic acid monohydrate","","- C24 H19 Cl12 O20 Pr -","- C24 H19 Cl12 O20 Pr -","- C48 H38 Cl24 O40 Pr2 -","2","1","HB6175","Na, Xu; Yan, Ouyang; Dai-Zheng, Liao; Zong-Hui, Jiang","Heptaaqua[tetrachlorophthalato(2‒)]praseodymium(III) tetrachlorophthalate(‒) tetrachlorophthalic acid monohydrate","Acta Crystallographica Section E","2005","61","7","m1272","m1274","10.1107/S1600536805017071","","","0.71073","MoKα","","0.0276","0.023","","","0.0558","0.0569","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206184","12.34","0.003","12.836","0.003","14.121","0.003","81.7","0.03","86.2","0.03","71.78","0.03","2101.8","0.9","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","cis-Di-tert-butylamidotetra-μ-tert-butylimido-di-μ-oxo-tetratellurium diiodide acetonitrile solvate","","- C26 H59 I2 N7 O2 Te4 -","- C26 H59 I2 N7 O2 Te4 -","- C52 H118 I4 N14 O4 Te8 -","2","1","HB6185","Jari Konu; Tristram Chivers; Risto S. Laitinen; Gabriele Schatte","<i>cis</i>-Di-<i>tert</i>-butylamidotetra-μ-<i>tert</i>-butylimido-di-μ-oxo-tetratellurium diiodide acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","o2251","o2253","10.1107/S1600536805018714","","","0.71073","MoKα","","0.0357","0.0255","","","0.0504","0.055","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206185","16.5483","0.0015","12.3987","0.0011","14.744","0.0013","90","","105.512","0.001","90","","2914.9","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(aqua)bis(diperchlorato)(3,7,15,19-tetraaza-25,26-dihydroxy-11,23- dimethyltricyclo[19,3,1,1^9,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23- decaene-1κ^2^N,N';2κ^2^N'',N''';1:2κ^2^O:O')dicadmium(II) bis(aqua)(3,7,15,19-tetraaza-25,26-dihydroxy-11,23- dimethyltricyclo[19,3,1,1^9,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23- decaene-1κ^2^N,N';2κ^2^N'',N''';1:2κ^2^O:O')dicadmium(II) diperchlorate","","- C48 H60 Cd4 Cl4 N8 O24 -","- C48 H60 Cd4 Cl4 N8 O24 -","- C96 H120 Cd8 Cl8 N16 O48 -","2","0.5","HB6198","Liu, Bo; Zhou, Hong; Pan, Zhi-Quan; Hu, Xue-Lei; Chen, Lei","Diaquadiperchlorato[μ-11,23-dimethyl-3,7,15,19-tetraazatricyclo[19.3.1.1^9,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23-decaene-25,26-diolato-1κ^2^<i>N</i>,<i>N</i>';2κ^2^<i>N</i>'',<i>N</i>''';1:2κ^2^<i>O</i>:<i>O</i>']dicadmium(II) diaqua[μ-11,23-dimethyl-3,7,15,19-tetraazatricyclo[19.3.1.1^9,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23-decaene-25,26-diolato-1κ^2^<i>N</i>,<i>N</i>';2κ^2^<i>N</i>'',<i>N</i>''';1:2κ^2^<i>O</i>:<i>O</i>']dicadmium(II) diperchlorate","Acta Crystallographica Section E","2005","61","7","m1295","m1297","10.1107/S1600536805017599","","","0.71073","MoKα","","0.0648","0.0501","","","0.1141","0.1185","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206186","9.485","0.002","6.8022","0.0016","9.681","0.002","90","","118.263","0.003","90","","550.1","0.2","298","2","298","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C11 H9 N3 O -","- C11 H9 N3 O -","- C22 H18 N6 O2 -","2","0.5","HB6200","Li, Su-Yue; Song, Yin-Yin; You, Zhong-Lu; Wen, Yan-Wei; Qin, Jin-Gui","2-Dicyanomethylene-4,5,5-trimethyl-2,5-dihydrofuran-3-carbonitrile","Acta Crystallographica Section E","2005","61","7","o2093","o2095","10.1107/S1600536805017976","","","0.71073","MoKα","","0.0826","0.0648","","","0.1966","0.2129","","","","","","0.973","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206187","11.2645","0.0019","11.4907","0.0019","13.665","0.002","95.865","0.003","104.109","0.003","100.969","0.003","1663.4","0.5","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","catena-Poly[[[tetrakis(dimethylformamide-κO)magnesium(II)]-μ- diphenylphosphato-κ^2^O:O'] trifluoromethanesulfonate]","","- C25 H38 F3 Mg N4 O11 P S -","- C25 H38 F3 Mg N4 O11 P S -","- C50 H76 F6 Mg2 N8 O22 P2 S2 -","2","1","HB6205","Adams, Harry; Rolfe, Alan; Jones, Simon","<i>catena</i>-Poly[[[tetrakis(dimethylformamide-κ<i>O</i>)magnesium(II)]-μ-diphenylphosphato-κ^2^<i>O</i>:<i>O</i>'] trifluoromethanesulfonate]","Acta Crystallographica Section E","2005","61","7","m1251","m1252","10.1107/S1600536805016880","","","0.71073","MoKα","","0.0699","0.0452","","","0.1055","0.1186","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206188","7.97","0.0002","14.374","0.0003","9.575","0.0002","90","","100.335","0.0015","90","","1079.12","0.04","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Difluoro(η^5^,η^5^-propane-2,2-diyldicyclopentadienyl)titanium(IV)","","- C13 H14 F2 Ti -","- C13 H14 F2 Ti -","- C52 H56 F8 Ti4 -","4","1","HB6211","Picka, Michal; Císařová, Ivana; Vinklárek, Jaromír; Erben, Milan","Difluoro(η^5^,η^5^-propane-2,2-diyldicyclopentadienyl)titanium(IV)","Acta Crystallographica Section E","2005","61","7","m1266","m1268","10.1107/S1600536805017095","","","0.71073","MoKα","","0.0375","0.0304","","","0.0815","0.0872","","","","","","0.993","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206189","11.892","0.0002","5.1318","0.0001","12.3063","0.0002","90","","98.125","0.001","90","","743.48","0.02","295","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C4 H17 N2 O12 P3 Zn2 -","- C4 H17 N2 O12 P3 Zn2 -","- C8 H34 N4 O24 P6 Zn4 -","2","1","HB6212","Zabukovec Logar, Nataša; Rajić, Nevenka; Stojaković, Djordje; Šajić, Sanja; Golobič, Amalija; Kaučič, Venčeslav","(C~4~H~12~N~2~)[Zn~2~(PO~4~)(HPO~4~)(H~2~PO~4~)], a layered zinc phosphate with intercalated <i>N</i>-methylpropane-1,3-diaminium cations","Acta Crystallographica Section E","2005","61","7","m1354","m1356","10.1107/S1600536805018908","","","0.71073","MoKα","","0.029","0.0281","","","0.0859","0.0865","","","","","","1.187","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206190","8.193","0.003","5.518","0.002","9.233","0.004","90","","107.33","0.03","90","","398.5","0.3","296","","296","","","","","","","","","7","P 1 2/m 1","-P 2y","10","","catena-poly[[[bis(ethylenediamine)platinum(II)]-μ-chloro- [bis(ethylenediamine)platinum(IV)]-μ-chloro] tetrakis(hexafluorophosphate)]","","- C4 H16 Cl F12 N4 P2 Pt -","- C4 H16 Cl F12 N4 P2 Pt -","- C4 H16 Cl F12 N4 P2 Pt -","1","0.25","HB6213","Matsushita, Nobuyuki","Redetermination of <i>catena</i>-poly[[[bis(ethylenediamine)platinum(II)]-μ-chloro-[bis(ethylenediamine)platinum(IV)]-μ-chloro] tetrakis(hexafluorophosphate)]","Acta Crystallographica Section E","2005","61","7","m1301","m1303","10.1107/S1600536805017873","","","0.7107","MoKα","","0.0297","0.0297","","","0.0872","0.0872","","","","","","1.194","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206191","18.8369","0.0005","13.4729","0.0003","8.9472","0.0002","90","","101.639","0.008","90","","2224","0.11","295","3","295","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Hexaaquanickel(II) bis(thiodiacetato-κ^3^O,S,O')nickel(II) tetrahydrate","","- C8 H28 Ni2 O18 S2 -","- C8 H28 Ni2 O18 S2 -","- C32 H112 Ni8 O72 S8 -","4","1","HB6214","Tian-Tian Pan; Jian-Rong Su; Duan-Jun Xu","Hexaaquanickelate(II) bis(thiodiacetato-κ^3^<i>O,S,O</i>')nickel(II) tetrahydrate","Acta Crystallographica Section E","2005","61","7","m1376","m1378","10.1107/S1600536805018982","","","0.71073","MoKα","","0.022","0.021","","","0.061","0.061","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206192","16.5125","0.0005","17.8156","0.0006","25.5801","0.0008","90","","99.913","0.002","90","","7412.8","0.4","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C34 H39.5 Cl Fe N3.5 Ni O4 P2 S3 -","- C34 H38 Cl Fe N3.5 Ni O4 P2 S3 -","- C272 H304 Cl8 Fe8 N28 Ni8 O32 P16 S24 -","8","2","HB6219","Duff, S. E.; Hitchcock, P. B.; Davies, S. C.; Barclay, J. E.; Evans, D. J.","1,3-Bis(diphenylphosphino)propane-2κ^2^<i>P</i>,<i>P</i>'-{μ-2-[bis(2-mercaptoethyl)amino]ethanesulfinato(3‒)-1κ^4^<i>N</i>,<i>S</i>,<i>S</i>',<i>S</i>'':2κ^2^<i>S</i>,<i>S</i>'}chloro-2κ<i>Cl</i>-dinitroso-1κ^2^<i>N</i>-iron(II)nickel(II) acetonitrile hemisolvate","Acta Crystallographica Section E","2005","61","7","m1313","m1315","10.1107/S1600536805018027","","","0.71073","MoKα","","0.2251","0.1079","","","0.2066","0.2559","","","","","","0.994","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206193","19.69","0.004","8.862","0.002","26.828","0.005","90","","100.721","0.002","90","","4599.6","1.6","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(μ~2~-Bicarbonato-κ^2^O,O')[μ~2~-1,4,8,11,14,18,23,27-octaaza-6,16,25(1,3)- tribenzenabicyclo[9.9.9]nonacosaphane]dicopper(II) triperchlorate acetonitrile solvate","","- C39 H58 Cl3 Cu2 N9 O15 -","- C39 H58 Cl3 Cu2 N9 O15 -","- C156 H232 Cl12 Cu8 N36 O60 -","4","1","HB6220","Derossi, Sofia; Bond, Andrew D.; McKenzie, Christine J.; Nelson, Jane","(μ~2~-Bicarbonato-κ^2^<i>O</i>,<i>O</i>')[μ~2~-1,4,8,11,14,18,23,27-octaaza-6,16,25(1,3)-tribenzenabicyclo[9.9.9]nonacosaphane]dicopper(II) triperchlorate acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","m1379","m1382","10.1107/S1600536805018581","","","0.71073","MoKα","","0.0956","0.0515","","","0.1197","0.1373","","","","","","0.985","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206194","9.667","0.002","12.096","0.002","14.185","0.003","66.41","0.03","85.1","0.03","74.07","0.03","1461.1","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis[4,4'-dimethyl-2,2'-bipyridinium(+)] tetraoxorhenium triiodide","","- C24 H26 I3 N4 O4 Re -","- C24 H26 I3 N4 O4 Re -","- C48 H52 I6 N8 O8 Re2 -","2","1","HB6221","Andrzej Kochel","Bis[4,4'-dimethyl-2,2'-bipyridinium(+)] tetraoxorhenate(VII) triiodide","Acta Crystallographica Section E","2005","61","7","m1368","m1369","10.1107/S1600536805018726","","","0.71073","MoKα","","0.0335","0.0261","","","0.0572","0.059","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206195","7.6177","0.0006","12.2882","0.0009","14.9197","0.0011","95.008","0.001","101.415","0.001","92.755","0.001","1360.69","0.18","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","2,6-Dibenzyl-4,8-dioxo-tetrahydro-2,3a,4a,6,7a,8a-hexaaza-cyclopenta[def] fluorene-8b,8c-dicarboxylic acid diethyl ester","","- C28 H32 N6 O6 -","- C28 H32 N6 O6 -","- C56 H64 N12 O12 -","2","1","HB6223","Li, Yi-Tao; Wang, Zhiguo; Yin, Guodong; Wu, An-Xin","Diethyl 2,6-dibenzyl-4,8-dioxotetrahydro-2,3a,4a,6,7a,8a-hexaazacyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2005","61","7","o2187","o2188","10.1107/S1600536805018775","","","0.71073","MoKα","","0.0861","0.0724","","","0.1903","0.2041","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206196","9.6464","0.0008","7.6262","0.0008","19.7151","0.0008","90","","96.485","0.006","90","","1441.1","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorobis[1-methylimidazoline-2(3H)-thione]cadmium(II)","","- C8 H12 Cd Cl2 N4 S2 -","- C8 H12 Cd Cl2 N4 S2 -","- C32 H48 Cd4 Cl8 N16 S8 -","4","1","HB6226","Beheshti, Azizolla; Brooks, Neil R.; Clegg, William; Hyvadi, Reza","Dichlorobis[1-methylimidazoline-2(3<i>H</i>)-thione]cadmium(II)","Acta Crystallographica Section E","2005","61","7","m1383","m1385","10.1107/S1600536805019203","","","0.71073","MoKα","","0.0344","0.0225","","","0.0429","0.0461","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206197","9.4211","0.0019","10.741","0.002","19.185","0.004","78.17","0.03","79","0.03","76","0.03","1823.2","0.7","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","μ~2~-Aqua-bis(μ~2~-trifluoroaceto-κ^2^O,O')bis[(trifluoroacetato- κO)bis(pyridine-κN)cobalt(II)]","","- C28 H22 Co2 F12 N4 O9 -","- C28 H22 Co2 F12 N4 O9 -","- C56 H44 Co4 F24 N8 O18 -","2","1","HB6227","Burley, Jonathan C.; Prior, Timothy J.","μ~2~-Aqua-bis(μ~2~-trifluoroaceto-κ^2^<i>O</i>,<i>O</i>')bis[bis(pyridine-κ<i>N</i>)(trifluoroacetato-κ<i>O</i>)cobalt(II)]","Acta Crystallographica Section E","2005","61","7","m1422","m1424","10.1107/S1600536805019586","","","0.71073","MoKα","","0.1014","0.0792","","","0.2126","0.24","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206198","10.3757","0.0005","10.8125","0.0005","16.9455","0.0008","90","","92.095","0.003","90","","1899.8","0.16","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-nitro-2-furaldehyde N-(hydroxymethyl)semicarbazone","","- C7 H8 N4 O5 -","- C7 H8 N4 O5 -","- C56 H64 N32 O40 -","8","1","HG6183","Doriguetto, Antonio C.; de Paula Silva, Carlos H. T.; Ellena, Javier; Trossini, Gustavo H. G.; Chin, Chung Man; Ferreira, Elizabeth I.","5-Nitro-2-furaldehyde <i>N</i>-(hydroxymethyl)semicarbazone","Acta Crystallographica Section E","2005","61","7","o2099","o2101","10.1107/S1600536805017721","","","0.71073","MoKα","","","0.0386","","","","0.1113","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206199","19.6572","0.0016","8.0741","0.0007","17.6413","0.0015","90","","90","","90","","2799.9","0.4","298","2","298","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1,4-Dimethyl-1,4-diazoniabicyclo[2.2.2]octane tetrachlorocuprate(II)","","- C8 H18 Cl4 Cu N2 -","- C8 H18 Cl4 Cu N2 -","- C64 H144 Cl32 Cu8 N16 -","8","2","HG6186","Sun, Xian-Ming; Qu, Yang","1,4-Dimethyl-1,4-diazoniabicyclo[2.2.2]octane tetrachlorocuprate(II)","Acta Crystallographica Section E","2005","61","7","m1360","m1362","10.1107/S160053680501860X","","","0.71073","MoKα","","0.0342","0.0305","","","0.0733","0.0754","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206200","20.4833","0.0018","21.6089","0.0018","16.0523","0.0014","90","","126.549","0.002","90","","5707.9","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","12-chloro-2,10-dibenzyloxy-3,9-dimethoxytetrahydroprotoberberine","2,10-dibenzyloxy-12-chloro-3,9-dimethoxy-5,8,13,13a- tetrahydro-6H-dibenzo[a,g]quinolizine","","- C33 H32 Cl N O4 -","- C33 H32 Cl N O4 -","- C264 H256 Cl8 N8 O32 -","8","1","HG6192","Ding, Yu; Yao, Guang-Min; Chen, Yi-Lang; Yang, Yu-She","Racemic 2,10-dibenzyloxy-12-chloro-3,9-dimethoxy-5,8,13,13a-tetrahydro-6<i>H</i>-dibenzo[<i>a,g</i>]quinolizine","Acta Crystallographica Section E","2005","61","7","o2020","o2021","10.1107/S1600536805017307","","","0.71073","MoKα","","0.1003","0.0626","","","0.1579","0.1769","","","","","","0.956","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206201","8.414","0.0017","9.513","0.0019","10.497","0.002","102.57","0.03","96.58","0.03","97.08","0.03","805.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-Cyclopropyl-6-fluoro-7-(4-formylpiperazin-1-yl)- 4-oxo-1,4-dihydroquinoline-3-carboxylic acid","","- C18 H17 F N3 O4 -","- C18 H17 F N3 O4 -","- C36 H34 F2 N6 O8 -","2","1","HG6194","Xian-Wen Li; Feng Zhi; Jian-Hua Shen; Yi-Qiao Hu","1-Cyclopropyl-6-fluoro-7-(4-formylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid","Acta Crystallographica Section E","2005","61","7","o2235","o2236","10.1107/S1600536805018623","","","0.71073","MoKα","","0.1129","0.054","","","0.1303","0.1561","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206202","12.296","0.001","10.587","0.002","17.164","0.002","90","","99.77","0.03","90","","2202","0.6","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","4-{[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-[(2,6- dimethylphenyl)aminocarbonylmethyl]piperazine","","- C23 H26 Cl N5 O2 -","- C23 H26 Cl N5 O2 -","- C92 H104 Cl4 N20 O8 -","4","1","HG6196","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","4-{[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-[(2,6-dimethylphenyl)aminocarbonylmethyl]piperazine","Acta Crystallographica Section E","2005","61","7","o1994","o1996","10.1107/S1600536805017228","","","0.71073","MoKα","","0.1047","0.0577","","","0.1674","0.2011","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206203","13.9136","0.0007","13.9136","0.0007","4.7065","0.0004","90","","90","","90","","911.12","0.1","105","2","105","2","","","","","","","","4","P 42","P 4c","77","","L-threonyl-L-alanine","","- C7 H14 N2 O4 -","- C7 H14 N2 O4 -","- C28 H56 N8 O16 -","4","1","HG6197","Görbitz, Carl Henrik","<small>L</small>-Threonyl-<small>L</small>-alanine","Acta Crystallographica Section E","2005","61","7","o2012","o2014","10.1107/S1600536805017174","","","0.71073","MoKα","","0.0357","0.0293","","","0.0705","0.074","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206204","11.0071","0.0017","7.915","0.0012","16.645","0.003","90","","104.823","0.003","90","","1401.9","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(2-Fluorobenzylideneamino)-3-(1,2,4-triazol-4-ylmethyl)-1H-1,2,4-triazole- 5(4H)-thione","","- C12 H10 F N7 S -","- C12 H10 F N7 S -","- C48 H40 F4 N28 S4 -","4","1","HG6198","Wei-Hua Li; Guan-Ping Yu; Fa-Qian Liu; Bao-Rong Hou; Zhi-Gang Yu","4-(2-Fluorobenzylideneamino)-3-(1,2,4-triazol-4-ylmethyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","7","o2058","o2060","10.1107/S1600536805017435","","","0.71073","MoKα","","0.0625","0.036","","","0.0841","0.0986","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206205","11.232","0.002","12.274","0.003","16.013","0.003","74.95","0.03","89.49","0.03","68.79","0.03","1978.6","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","trans-Carbonylchlorobis[tris(pentafluorophenyl)phosphine)]rhodium(I)","","- C37 Cl F30 O P2 Rh -","- C37 Cl F30 O P2 Rh -","- C74 Cl2 F60 O2 P4 Rh2 -","2","1","HG6199","Meijboom, Reinout; Muller, Alfred; Roodt, Andreas","<i>trans</i>-Carbonylchlorobis[tris(pentafluorophenyl)phosphine)]rhodium(I)","Acta Crystallographica Section E","2005","61","7","m1283","m1285","10.1107/S1600536805017447","","","0.71073","MoKα","","","0.0495","","","","0.1058","","","","","","0.976","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206206","18.441","0.004","7.8992","0.001","13.014","0.003","90","","95.516","0.016","90","","1887","0.6","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-4-[(E)-(4-ethylphenyl)diazenyl]-6-{[1,3-dihydroxy-2-(hydroxymethyl)propan- 2-ylamino]methylene}cyclohexa-2,4-dienone","","- C19 H23 N3 O4 -","- C19 H23 N3 O4 -","- C76 H92 N12 O16 -","4","1","HG6200","Şahin, Onur; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>Z</i>)-6-{[1,3-Dihydroxy-2-(hydroxymethyl)propan-2-ylamino]methylene}-4-[(<i>E</i>)-(4-ethylphenyl)diazenyl]cyclohexa-2,4-dienone","Acta Crystallographica Section E","2005","61","7","o2076","o2078","10.1107/S1600536805017733","","","0.71073","MoKα","","0.2105","0.1073","","","0.2683","0.3125","","","","","","0.927","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206207","5.633","0.0011","25.961","0.005","7.977","0.0016","90","","102.26","0.03","90","","1139.9","0.4","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(Hydroxyethylamino)-1-phenylbut-2-en-1-one","","- C12 H15 N O2 -","- C12 H15 N O2 -","- C48 H60 N4 O8 -","4","1","HG6201","Yao-Cheng Shi","<i>R</i>~2~^2^(14) dimers in 3-(hydroxyethyl)amino-1-phenylbut-2-en-1-one","Acta Crystallographica Section E","2005","61","7","o2005","o2007","10.1107/S1600536805017290","","","0.71073","MoKα","","0.1571","0.0714","","","0.1728","0.2199","","","","","","0.974","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206208","9.1916","0.001","9.9676","0.0011","10.0055","0.0011","86.049","0.002","72.405","0.002","79.7","0.002","859.61","0.16","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","2-benzylamino-4-phenyl-5,5-dimethyl-1,3,2-dioxaphosphorinane-2-oxide","","- C18 H22 N O3 P -","- C18 H22 N O3 P -","- C36 H44 N2 O6 P2 -","2","1","HG6202","Wan, Shi-Guan; Liu, Chang; Yu, Yan; Yang, Xing-Yu","2-Benzylamino-5,5-dimethyl-4-phenyl-1,3,2-dioxaphosphorinane 2-oxide","Acta Crystallographica Section E","2005","61","7","o2117","o2119","10.1107/S1600536805018003","","","0.71073","MoKα","","0.0475","0.0445","","","0.1178","0.1212","","","","","","1.073","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206209","5.4935","0.0005","22.3315","0.001","7.997","0.0004","90","","99.401","0.006","90","","967.88","0.11","291","","291","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Quinolinum perchlorate","","- C9 H8 Cl N O4 -","- C9 H8 Cl N O4 -","- C36 H32 Cl4 N4 O16 -","4","1","HG6203","Sieroń, Lesław","Quinolinium perchlorate","Acta Crystallographica Section E","2005","61","7","o2091","o2092","10.1107/S1600536805017927","","","0.71073","MoKα","","0.0428","0.0378","","","0.1036","0.1075","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206210","8.7906","0.0012","9.6774","0.0011","10.7788","0.0012","82.41","0.009","78.47","0.01","63.796","0.009","805.11","0.18","150","2","150","2","","","","","","","","3","P -1","-P 1","2","1,3-Bis(3,5-dimethylphenoxy)propane","1,3-Bis(3,5-dimethylphenoxy)propane","","- C19 H24 O2 -","- C19 H24 O2 -","- C38 H48 O4 -","2","1","HG6204","Tooke, Duncan M.; Lutz, M.; Spek, Anthony L.","1,3-Bis(3,5-dimethylphenoxy)propane","Acta Crystallographica Section E","2005","61","7","o2152","o2154","10.1107/S1600536805018532","","","0.71073","MoKα","","0.0741","0.0498","","","0.1207","0.1349","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206211","11.155","0.002","7.0897","0.0016","17.488","0.004","90","","99.313","0.003","90","","1364.8","0.5","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","Bis(kokusaginine)trihydrate","4,6,7-Trimethoxyfuro[2,3-b]quinoline‒water (2/3)","","- C28 H32 N2 O11 -","- C28 H32 N2 O11 -","- C56 H64 N4 O22 -","2","1","HK6009","Latip, Jalifah; Ali, Noor Hapeedah. M.; Yamin, Bohari M.","4,6,7-Trimethoxyfuro[2,3-<i>b</i>]quinoline‒water (2/3)","Acta Crystallographica Section E","2005","61","7","o2230","o2232","10.1107/S1600536805019082","","","0.71073","MoKα","","0.047","0.041","","","0.099","0.102","","","","","","1.16","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206212","7.4651","0.0015","13.0034","0.0016","15.9759","0.0018","90","","90","","90","","1550.8","0.4","296","2","296","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","2,5-dibenzoyl-1,4-phenylenediamine","2,5-dibenzoyl-1,4-phenylenediamine","","- C20 H16 N2 O2 -","- C20 H16 N2 O2 -","- C80 H64 N8 O8 -","4","0.5","HK6017","Zhu, Hong-Jun; Wang, Dan-Dan; Song, Guang-Liang; Wang, Jin-Tang; Wang, Ke-Le","2,5-Dibenzoyl-1,4-phenylenediamine","Acta Crystallographica Section E","2005","61","7","o2209","o2210","10.1107/S1600536805019112","","","0.71073","MoKα","","0.147","0.0543","","","0.1202","0.1509","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206213","7.1993","0.0005","9.2058","0.0007","19.9448","0.0016","101.133","0.002","100.209","0.002","91.704","0.002","1273.64","0.17","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","(Z)-2,3-Dichloro-1,1,4,4-tetrakis-(4-chlorophenyl)but-2-ene","","- C28 H18 Cl6 -","- C28 H18 Cl6 -","- C56 H36 Cl12 -","2","1","HK6018","Shimakoshi, Hisashi; Aritome, Isao; Tokunaga, Mami; Hisaeda, Yoshio","(<i>Z</i>)-2,3-Dichloro-1,1,4,4-tetrakis(4-chlorophenyl)but-2-ene","Acta Crystallographica Section E","2005","61","7","o2063","o2064","10.1107/S160053680501768X","","","0.71073","MoKα","","0.0679","0.0498","","","0.1166","0.1282","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206214","7.985","0.0005","10.9104","0.0006","11.1556","0.0007","90","","108.414","0.002","90","","922.11","0.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Amino-5-methylpyridinium phosphate","","- C6 H11 N2 O4 P -","- C6 H11 N2 O4 P -","- C24 H44 N8 O16 P4 -","4","1","IS6071","Hai Feng; Cui-Rong Sun; Li Li; Zhi-Min Jin; Bin Tu","2-Amino-5-methylpyridinium phosphate","Acta Crystallographica Section E","2005","61","7","o1983","o1984","10.1107/S1600536805014716","","","0.71073","MoKα","","0.0468","0.0352","","","0.0891","0.093","","","","","","0.973","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206215","20.692","0.011","12.456","0.006","11.792","0.006","90","","114.51","0.008","90","","2765","2","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-tert-Butylphenoxy)-2-chloropyrimidine","","- C14 H15 Cl N2 O -","- C14 H15 Cl N2 O -","- C112 H120 Cl8 N16 O8 -","8","1","IS6079","Wei-Min Liu; You-Quan Zhu; Yi-Feng Wang; Gong-Chun Li; Hua-Zheng Yang","4-(4-<i>tert</i>-Butylphenoxy)-2-chloropyrimidine","Acta Crystallographica Section E","2005","61","7","o2040","o2041","10.1107/S1600536805017460","","","0.71073","MoKα","","0.136","0.0552","","","0.1089","0.1337","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206216","6.2021","0.0018","7.6","0.002","10.849","0.003","100.589","0.004","92.777","0.005","113.518","0.004","456.7","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","1,4-Bis[chloro(hydroximino)methyl]benzene N,N'-dimethylformamide disolvate","","- C14 H20 Cl2 N4 O4 -","- C14 H20 Cl2 N4 O4 -","- C14 H20 Cl2 N4 O4 -","1","0.5","IS6081","Liu, Xin-Gang; Feng, Ya-Qing; Liu, Dong-Qing; Zhao, Yao","1,4-Bis[chloro(hydroxyimino)methyl]benzene <i>N</i>,<i>N</i>'-dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","7","o1970","o1972","10.1107/S1600536805018738","","","0.71073","MoKα","","0.062","0.0395","","","","0.1037","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206217","8.849","0.001","10.581","0.001","11.3773","0.0008","113.447","0.001","98.852","0.001","106.364","0.002","893.89","0.15","295","1","","","","","","","","","","5","P -1","-P 1","2","","2-(4,6-Dimethoxypyrimidin-2-yloxy)-6-fluoro-N-(3-methylpyridyl)benzylamine","","- C19 H19 F N4 O3 -","- C19 H19 F N4 O3 -","- C38 H38 F2 N8 O6 -","2","1","IS6083","De-Long Shen; Qi-Sun Gong; Cheng-Xia Tan; Jian-Quan Weng","2-(4,6-Dimethoxypyrimidin-2-yloxy)-6-fluoro-<i>N</i>-(3-methylpyridyl)benzylamine","Acta Crystallographica Section E","2005","61","7","o2270","o2271","10.1107/S1600536805019446","","","0.71073","MoKα","","0.0668","0.0496","","","0.1565","0.1726","","","","","","1.063","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206218","17.534","0.001","15.616","0.001","21.394","0.002","90","","90","","90","","5857.9","0.7","153.2","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C30 H30 F6 Fe O2 P2 -","- C30 H30 F6 Fe O2 P2 -","- C240 H240 F48 Fe8 O16 P16 -","8","1","IS6084","Hiroshi Nakazawa; Masumi Itazaki; Mari Owaribe","Dicarbonyl(η^5^-pentamethylcyclopentadienyl)(triphenylphosphine)iron(II) hexafluorophosphate","Acta Crystallographica Section E","2005","61","7","m1275","m1276","10.1107/S1600536805017344","","","0.7107","MoKα","","","0.0632","","","","0.1762","","","","","","1.113","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206219","9.2694","0.001","9.3192","0.001","23.448","0.003","90","","95.234","0.002","90","","2017.1","0.4","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(5-Benzyloxy-2,4-dichlorophenyl)hexahydroisoindole-1,3-dione","","- C21 H21 Cl2 N O4 -","- C21 H21 Cl2 N O4 -","- C84 H84 Cl8 N4 O16 -","4","1","IS6087","Neng-Xue Wang; Yan-Ping Luo; Qiong Chen; Guang-Fu Yang","2-(5-Benzyloxy-2,4-dichlorophenyl)perhydroisoindole-1,3-dione monohydrate","Acta Crystallographica Section E","2005","61","7","o2081","o2082","10.1107/S1600536805017770","","","0.71073","MoKα","","0.0699","0.0533","","","0.1251","0.1351","","","","","","1.065","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206220","14.0356","0.0012","15.0658","0.0013","7.1354","0.0006","90","","90","","90","","1508.8","0.2","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-methoxy-12-methyl-12-azatetracyclo[9.3^1.10^.0^2.7^] heptadeca-2(7),3,5-triene","","- C18 H25 N O -","- C18 H25 N O -","- C72 H100 N4 O4 -","4","1","IS6088","Swamy, G. Y. S. K.; Ravikumar, K.; Bhujanga Rao, A. K. S.","Dextromethorphan, an antitussive agent","Acta Crystallographica Section E","2005","61","7","o2071","o2073","10.1107/S1600536805017782","","","0.71073","MoKα","","0.0403","0.0383","","","0.1007","0.1022","","","","","","1.082","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206221","7.6684","0.0007","10.2831","0.0009","11.6172","0.001","102.895","0.002","102.286","0.002","102.822","0.002","836.89","0.13","150","2","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H16 N4 -","- C22 H16 N4 -","- C44 H32 N8 -","2","1","IS6089","Yong-Ru Liu; Xiang-Ping Li; Jing-An Zhang; Cheng-Yong Su","<i>N</i>,<i>N</i>'-Bis(4-pyridylmethylene)naphthalene-1,5-diamine","Acta Crystallographica Section E","2005","61","7","o2089","o2090","10.1107/S1600536805017940","","","0.71073","MoKα","","","0.0438","","","","0.108","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206222","7.0192","0.0004","22.1771","0.001","10.5972","0.0007","90","","119.541","0.004","90","","1435.17","0.15","293","2","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(N-Ethylthiocarbamoyl)-3,5-di-2-furyl-2-pyrazoline","","- C14 H15 N3 O2 S -","- C14 H15 N3 O2 S -","- C56 H60 N12 O8 S4 -","4","1","IS6090","Özdemir Gonca; Şamil Işik; Özdemir Zuhal; Bilgin Altan","1-(<i>N</i>-Ethylthiocarbamoyl)-3,5-di-2-furyl-2-pyrazoline","Acta Crystallographica Section E","2005","61","7","o2205","o2206","10.1107/S160053680501915X","","","0.71073","MoKα","","0.0571","0.0494","","","0.1869","0.1393","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206223","15.5846","0.0017","10.1592","0.0011","11.1622","0.0012","90","","121.118","0.002","90","","1513","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(Pyridin-2-yl)hydrazinecarbothioamide","","- C6 H8 N4 S -","- C6 H8 N4 S -","- C48 H64 N32 S8 -","8","1","JH6009","P. F. Rapheal; E. Manoj; M. R. Prathapachandra Kurup; E. Suresh","<i>N</i>-(Pyridin-2-yl)hydrazinecarbothioamide","Acta Crystallographica Section E","2005","61","7","o2243","o2245","10.1107/S1600536805019057","","","0.71073","MoKα","","0.0372","0.0349","","","0.1049","0.107","","","","","","1.119","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206224","9.766","0.0009","6.6155","0.0006","10.5192","0.001","90","","90","","90","","679.61","0.11","292","2","292","2","","","","","","","","4","P c c a","-P 2a 2ac","54","[Mn (C2 O4) (H2 O)2], H2 O","catena-Poly[[[diaquamanganese(II)]-μ-oxalato] monohydrate]","","- C2 H6 Mn O7 -","- C2 H6 Mn O7 -","- C8 H24 Mn4 O28 -","4","0.5","JH6010","Xucheng Fu; Chenggang Wang; Mingtian Li","<i>catena</i>-Poly[[[diaquamanganese(II)]-μ-oxalato] monohydrate]","Acta Crystallographica Section E","2005","61","7","m1348","m1349","10.1107/S1600536805018805","","","0.71073","MoKα","","0.0205","0.0198","","","0.0535","0.0539","","","","","","1.07","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206225","18.0582","0.0005","11.4381","0.0003","18.6791","0.0004","90","","108.796","0.001","90","","3652.45","0.16","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","poly[[tris(μ~4~-benzene-1,4-dicarboxylato)bis(μ~2~- N,N-diethylformamide)digadolinium(III)] monohydrate]","","- C34 H36 Gd2 N2 O15 -","- C34 H34 Gd2 N2 O15 -","- C136 H136 Gd8 N8 O60 -","4","0.5","LH6399","Poulsen, Rasmus D.; Overgaard, Jacob; Chevallier, Marie-Agnes; Clausen, Henrik F.; Iversen, Bo B.","A gadolinium-based metal‒organic framework, poly[[tris(μ~4~-benzene-1,4-dicarboxylato)bis(μ~2~-<i>N</i>,<i>N</i>-diethylformamide)digadolinium(III)] monohydrate]","Acta Crystallographica Section E","2005","61","7","m1337","m1339","10.1107/S1600536805018271","","","0.71073","MoKα","","0.0314","0.0221","","","0.0522","0.0537","","","","","","0.95","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206226","28.242","0.006","9.5962","0.0019","21.108","0.004","90","","127.74","0.03","90","","4524","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","6a-Methyl-7-phenylsulfonyl-6-phenylsulfonylmethyl-7,7a-dihydro-6aH- cyclopropa[d][1,2,3]triazolo[4,3-b]pyridazine:acetone solvate 2:1","","- C21.5 H21 N4 O4.5 S2 -","- C21.5 H21 N4 O4.5 S2 -","- C172 H168 N32 O36 S16 -","8","1","LH6417","Anna Katrusiak; Andrzej Katrusiak","6a-Methyl-7-phenylsulfonyl-6-phenylsulfonylmethyl-7,7a-dihydro-6a<i>H</i>-cyclopropa[<i>d</i>][1,2,3]triazolo[4,3-<i>b</i>]pyridazine acetone hemisolvate","Acta Crystallographica Section E","2005","61","7","o2142","o2144","10.1107/S1600536805018106","","","0.71073","MoKα","","0.2284","0.0584","","","0.0802","0.1207","","","","","","0.902","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206227","6.413","0.001","9.763","0.002","12.113","0.002","79.54","0.03","79.26","0.03","80.61","0.03","726.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","bis(2,4-pyridinedicarboxylato-N,O)-(μ~2~-4,4'-bipyridine)-hexaaqua -dicobalt(II) dihydrate","μ-4,4'-Bipyridine-κ^2^N:N'-bis[triaqua(pyridine-2,4-dicarboxylato- κ^2^N,O)cobalt(II)] dihydrate","","- C24 H30 Co2 N4 O16 -","- C24 H30 Co2 N4 O16 -","- C24 H30 Co2 N4 O16 -","1","0.5","LH6428","Zhang, Xian-Ming","μ-4,4'-Bipyridine-κ^2^<i>N</i>:<i>N</i>'-bis[triaqua(pyridine-2,4-dicarboxylato-κ^2^<i>N</i>,<i>O</i>)cobalt(II)] dihydrate","Acta Crystallographica Section E","2005","61","7","m1332","m1333","10.1107/S1600536805015473","","","0.71073","MoKα","","0.0749","0.0523","","","0.1288","0.1454","","","","","","1.117","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206228","7.838","0.002","9.609","0.001","17.739","0.003","86.68","0.01","86.1","0.02","75.32","0.01","1288.3","0.4","303","2","303","2","","","","","","","","6","P -1","-P 1","2","","trans-Diaquadichlorooxovanadium(IV) bis[2-(2-pyridylamino)pyridinium] dichloride","","- C20 H24 Cl4 N6 O3 V -","- C20 H24 Cl4 N6 O3 V -","- C40 H48 Cl8 N12 O6 V2 -","2","1","LH6432","Hartung, Jens; Schmidt, Philipp; Svoboda, Ingrid; Fuess, Hartmut","<i>trans</i>-Diaquadichlorooxovanadium(IV) bis[2-(2-pyridylamino)pyridinium] dichloride","Acta Crystallographica Section E","2005","61","7","m1253","m1255","10.1107/S1600536805016843","","","0.71093","MoKα","","0.0612","0.0339","","","0.087","0.0966","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206229","14.861","0.001","7.364","0.001","27.948","0.002","90","","93.42","0.01","90","","3053.1","0.5","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","gemfibrozil","5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid","","- C15 H22 O3 -","- C15 H22 O3 -","- C120 H176 O24 -","8","2","LH6433","Bruni, Bruno; Coran, Silvia; Di Vaira, Massimo; Giannellini, Valerio","5-(2,5-Dimethylphenoxy)-2,2-dimethylpentanoic acid (gemfibrozil)","Acta Crystallographica Section E","2005","61","7","o1989","o1991","10.1107/S1600536805016855","","","1.5418","CuKα","","0.0837","0.0579","","","0.1747","0.1884","","","","","","0.864","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206230","11.651","0.002","13.942","0.002","8.981","0.002","90","","110.837","0.003","90","","1363.4","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3040","Poly[(μ~3~-n-hexane-1,6-dicarboxylato)dysprosium(III)]","","- C9 H16 Dy O8 -","- C9 H16 Dy O8 -","- C36 H64 Dy4 O32 -","4","1","LH6434","Lill, Daniel T. de; Brennessel, William W.; Borkowski, Lauren A.; Gunning, Noel S.; Cahill, Christopher L.","Poly[(μ~3~-<i>n</i>-hexane-1,6-dicarboxylato)dysprosium(III)]","Acta Crystallographica Section E","2005","61","7","m1343","m1345","10.1107/S1600536805018246","","","0.71073","MoKα","","0.035","0.0294","","","0.0771","0.0795","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206231","7.3829","0.0011","6.7658","0.001","11.1074","0.0017","90","","93.826","0.002","90","","553.59","0.14","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(5S,6R)-4,5-Dimethyl-6-phenylmorpholine-2,3-dione","","- C12 H13 N O3 -","- C12 H13 N O3 -","- C24 H26 N2 O6 -","2","1","LH6437","Ji-Dan Yan; Ming Lu; Yu-Ping Guo; Chun-Bao Li; Xiang-Yang Tang","(5<i>S</i>,6<i>R</i>)-4,5-Dimethyl-6-phenylmorpholine-2,3-dione","Acta Crystallographica Section E","2005","61","7","o2167","o2168","10.1107/S160053680501682X","","","0.71073","MoKα","","0.0364","0.0312","","","0.0844","0.087","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206232","9.19","0.005","16.756","0.009","12.69","0.007","90","","95.126","0.01","90","","1946.3","1.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ~2~-acetato-bis[μ~2~-N,N'-bis(salicylidene)butane-1,4- diaminato]trimanganese(II)","","- C40 H42 Mn3 N4 O8 -","- C40 H42 Mn3 N4 O8 -","- C80 H84 Mn6 N8 O16 -","2","0.5","LH6439","Ma, Ji-Long; You, Zhong-Lu; Zhu, Hai-Liang","Di-μ~2~-acetato-bis[μ~2~-<i>N</i>,<i>N</i>'-bis(salicylidene)butane-1,4-diaminato]trimanganese(II)","Acta Crystallographica Section E","2005","61","7","m1286","m1288","10.1107/S1600536805017423","","","0.71073","MoKα","","0.0799","0.0405","","","0.0793","0.0878","","","","","","0.835","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206233","9.7833","0.001","9.9027","0.001","10.2853","0.0011","101.957","0.002","104.951","0.002","101.511","0.002","907.46","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(Z)-4-(4-Methoxybenzylidene)-2-methylsulfanyl-3-phenethyl-1H-imidazol-5(4H)-one","","- C20 H20 N2 O2 S -","- C20 H20 N2 O2 S -","- C40 H40 N4 O4 S2 -","2","1","LH6440","Ping Wang; Xiao-He Chu; Wei-Ke Su","(<i>Z</i>)-4-(4-Methoxybenzylidene)-2-methylsulfanyl-3-phenethyl-1<i>H</i>-imidazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","7","o2200","o2201","10.1107/S1600536805018878","","","0.71073","MoKα","","0.0986","0.0817","","","0.1641","0.1733","","","","","","1.287","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206234","15.5563","0.0008","4.6549","0.0002","15.0454","0.0007","90","","103.399","0.001","90","","1059.83","0.09","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","Propane-1,3-diaminium bis(dihydrogenarsenate)","","- C3 H16 As2 N2 O8 -","- C3 H16 As2 N2 O8 -","- C12 H64 As8 N8 O32 -","4","0.5","LH6441","Wilkinson, Hazel S.; Harrison, William T. A.","Propane-1,3-diaminium bis(dihydrogenarsenate)","Acta Crystallographica Section E","2005","61","7","m1289","m1291","10.1107/S1600536805017411","","","0.71073","MoKα","","0.0406","0.0365","","","0.092","0.0944","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206235","9.569","0.007","10.723","0.006","15.416","0.006","90","","90","","90","","1581.8","1.6","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-N-(1-Benzyl-2-hydroxy-ethyl)phthalamic acid","","- C17 H17 N O4 -","- C17 H17 N O4 -","- C68 H68 N4 O16 -","4","1","LH6442","McCormac, Paul B.; Pratt, Albert C.; Long, Conor; Howie, R. Alan","(<i>S</i>)-<i>N</i>-(1-Benzyl-2-hydroxyethyl)phthalamic acid","Acta Crystallographica Section E","2005","61","7","o2047","o2049","10.1107/S160053680501740X","","","0.71073","MoKα","","0.2404","0.0752","","","0.1053","0.1296","","","","","","0.853","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206236","10.114","0.002","10.26","0.002","15.126","0.003","78.7","0.03","73.88","0.03","87.45","0.03","1478.6","0.6","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2-(acetylamino)-N-benzyl-2-(ethylsulfinyl)acetamide","","- C13 H18 N2 O3 S -","- C13 H18 N2 O3 S -","- C52 H72 N8 O12 S4 -","4","2","LH6443","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","2-(Acetylamino)-<i>N</i>-benzyl-2-(ethylsulfinyl)acetamide: structural basis for lack of anticonvulsant activity","Acta Crystallographica Section E","2005","61","7","o2120","o2122","10.1107/S1600536805018258","","","1.54178","CuKα","","0.1229","0.0771","","","0.1738","0.1876","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206237","9.381","0.004","11.552","0.003","14.12","0.004","80.18","0.02","83.89","0.03","74.93","0.03","1452.8","0.9","298","","298","","","","","","","","","5","P -1","-P 1","2","","(μ~2~-chloro)(μ~2~-η^2^-2-tert-butyl-ethyn-1-yl)- bis[bis(η~5~-cyclopentadienyl)dimethylsilane]dititanium(II)","","- C30 H37 Cl Si2 Ti2 -","- C30 H37 Cl Si2 Ti2 -","- C60 H74 Cl2 Si4 Ti4 -","2","1","LH6444","Kooijman, Huub; Hogenbirk, Marijke; Schat, Gerrit; Akkerman, Otto S.; Bickelhaupt, Friedrich; Spek, Anthony L.","(μ~2~-η^2^-2-<i>tert</i>-Butylethyn-1-yl)(μ~2~-chloro)bis{[bis(η^5^-cyclopentadienyl)dimethylsilane]titanium}","Acta Crystallographica Section E","2005","61","7","m1329","m1331","10.1107/S1600536805017903","","","0.71073","MoKα","","0.1344","0.0703","","","0.1562","0.183","","","","","","1.172","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206238","11.46","0.02","13.094","0.005","13.563","0.009","90","","114.22","0.05","90","","1856","4","295","2","295","2","","","","","","","","3","I 1 2/m 1","-I 2y","12","","Benzylammonium 2,4-bis(dicyanomethylene)-2,3-dihydroisoindolide","","- C21 H14 N6 -","- C21 H14 N6 -","- C84 H56 N24 -","4","0.5","LH6446","Conway, Shane P.; Pratt, Albert C.; Long, Conor; Howie, R. Alan","Benzylammonium 2,4-bis(dicyanomethylene)-2,3-dihydroisoindolide","Acta Crystallographica Section E","2005","61","7","o2258","o2260","10.1107/S1600536805018866","","","0.71073","MoKα","","0.1029","0.0512","","","0.1145","0.127","","","","","","0.985","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2206239","13.886","0.003","9.898","0.002","10.896","0.002","90","","91.46","0.02","90","","1497.1","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(Biphenyl-2-yl)-5-(1-methylhydrazino)-1,3,4-thiadiazole","","- C15 H14 N4 S -","- C15 H14 N4 S -","- C60 H56 N16 S4 -","4","1","LH6447","Hempel, Andrew; Lilian Y. Y. Ma; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","2-(Biphenyl-2-yl)-5-(1-methylhydrazino)-1,3,4-thiadiazole: a thiadiazole‒hydrazine derivative with anticonvulsant properties","Acta Crystallographica Section E","2005","61","7","o2164","o2166","10.1107/S1600536805018453","","","1.54178","CuKα","","0.1618","0.0706","","","0.1333","0.1356","","","","","","0.892","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206240","13.392","0.0007","16.4043","0.0006","15.1901","0.001","90","","90","","90","","3337.1","0.3","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","α-Tris(2,4-pentanedionato-κ^2^O,O')vanadium(III)","","- C15 H21 O6 V -","- C15 H21 O6 V -","- C120 H168 O48 V8 -","8","1","LH6448","Kavitha, S. Jose; Panchanatheswaran, Krishnaswamy; Low, John N.; Glidewell, Christopher","The α polymorph of racemic tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')vanadium(III), redetermined at 120 K","Acta Crystallographica Section E","2005","61","7","m1326","m1328","10.1107/S1600536805018441","","","0.71073","MoKα","","0.156","0.0575","","","0.1045","0.1347","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206241","9.231","0.003","13.375","0.004","13.354","0.004","90","","90","","90","","1648.7","0.9","273","2","298","2","","","","","","","","4","C c c m","-C 2 2c","66","","Poly[μ-cyano-tetracyanodipyridinedicopper(II)]","","- C14 H10 Cu2 N6 -","- C14 H10 Cu2 N6 -","- C56 H40 Cu8 N24 -","4","0.25","LH6449","Xiaohua Pu; Xiaoming Jiang; Yibin Wei; Yanping Li; Pin Yang","Poly[dipyridinecopper(II)-μ-cyano-copper(II)-tri-μ-cyano]","Acta Crystallographica Section E","2005","61","7","m1393","m1395","10.1107/S1600536805019148","","","0.71073","MoKα","","0.0362","0.0299","","","0.0735","0.0769","","","","","","1.002","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206242","6.726","0.002","6.837","0.002","25.267","0.005","83.57","0.02","83.03","0.02","88.03","0.02","1145.8","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2-(4-chlorobenzamido)ethanaminium chloride","","- C9 H12 Cl2 N2 O -","- C9 H12 Cl2 N2 O -","- C36 H48 Cl8 N8 O4 -","4","2","LH6450","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","A monoamine oxidase B inhibitor: <i>N</i>-(2-aminoethyl)-<i>p</i>-chlorobenzamide (Ro16-6491) hydrochloride","Acta Crystallographica Section E","2005","61","7","o2283","o2285","10.1107/S1600536805019008","","","1.54178","CuKα","","0.1342","0.076","","","0.1918","0.2059","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206243","9.9145","0.0014","10.214","0.002","10.521","0.002","76.905","0.01","63.051","0.009","67.639","0.01","876.4","0.3","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","dichloro[1,2-bis(phenylsulfanyl)benzene]palladium","","- C18 H14 Cl2 Pd S2 -","- C18 H14 Cl2 Pd S2 -","- C36 H28 Cl4 Pd2 S4 -","2","1","LH6454","Nobuhiro Takeda; Daisuke Shimizu; Takahiro Sasamori; Norihiro Tokitoh","[1,2-Bis(phenylsulfanyl)benzene]dichloropalladium(II)","Acta Crystallographica Section E","2005","61","7","m1408","m1410","10.1107/S1600536805019409","","","0.7107","MoKα","","0.0186","0.0173","","","0.0426","0.0431","","","","","","1.091","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206244","7.022","0.001","13.667","0.002","15.192","0.002","90","","90","","90","","1458","0.4","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Bis(2-acetyl-5-hydroxyphenolato-κ^2^O,O')copper(II)","","- C16 H14 Cu O6 -","- C16 H14 Cu O6 -","- C64 H56 Cu4 O24 -","4","0.5","LH6458","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng","Bis(2-acetyl-5-hydroxyphenolato-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2005","61","7","m1429","m1430","10.1107/S160053680501980X","","","0.71073","MoKα","","0.062","0.036","","","0.104","0.117","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206245","8.8121","0.0008","10.0253","0.0009","10.172","0.0009","69.474","0.001","80.252","0.001","81.477","0.001","825.58","0.13","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(3-bromo-1-oxidoanthraquinone-κ^2^<i>O</i>^1^,<i>O</i>^9^)bis(pyridine- κN)copper(II) dihydrate","","- C38 H26 Br2 Cu N2 O8 -","- C38 H26 Br2 Cu N2 O8 -","- C38 H26 Br2 Cu N2 O8 -","1","0.5","LH6459","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Koushik, Saha; Ng, Seik Weng","Bis(3-bromo-1-oxidoanthraquinone-κ^2^<i>O</i>^1^,<i>O</i>^9^)bis(pyridine-κ<i>N</i>)copper(II) dihydrate","Acta Crystallographica Section E","2005","61","7","m1431","m1432","10.1107/S1600536805019811","","","0.71073","MoKα","","0.091","0.048","","","0.122","0.144","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206247","5.7994","0.0007","9.1494","0.0012","12.8573","0.0015","92.152","0.01","94.282","0.01","90.551","0.01","679.78","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","N,N-Bis(2-cyanoethyl)-p-toluenesulfonamide","","- C13 H15 N3 O2 S -","- C13 H15 N3 O2 S -","- C26 H30 N6 O4 S2 -","2","1","NC6032","Yathirajan, Hemmige S.; Anilkumar, Haleyur G.; Lokanatharai, Kuriya M.; Nagaraj, Basavegowda; Bolte, Michael","<i>N</i>,<i>N</i>-Bis(2-cyanoethyl)-<i>p</i>-toluenesulfonamide","Acta Crystallographica Section E","2005","61","7","o1965","o1966","10.1107/S1600536805016041","","","0.71073","MoKα","","0.0388","0.0324","","","0.077","0.08","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206248","6.838","0.003","9.946","0.004","10.087","0.004","105.94","0.05","96.54","0.05","103.44","0.05","629.9","0.5","291","2","291","2","","","","","","","","3","P -1","-P 1","2","","3,4-Dihydroxy-9H-xanthen-9-one trihydrate","","- C13 H14 O7 -","- C13 H14 O7 -","- C26 H28 O14 -","2","1","NC6035","Gales, Luis; Sousa, Maria E.; Pinto, Madalena M. M.; Damas, Ana M.","3,4-Dihydroxy-9<i>H</i>-xanthen-9-one trihydrate","Acta Crystallographica Section E","2005","61","7","o2213","o2215","10.1107/S1600536805018994","","","0.71069","MoKα","","0.0755","0.0499","","","0.1284","0.1514","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206249","7.4402","0.0005","12.4849","0.0009","8.4844","0.0006","90","","104.524","0.0001","90","","762.93","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[2-(hydroxymethyl)pyridine-κ^2^N,O]dinitratocopper(II)","","- C12 H14 Cu N4 O8 -","- C12 H14 Cu N4 O8 -","- C24 H28 Cu2 N8 O16 -","2","0.5","NG6149","Feng He; Di Liu","Bis[2-(hydroxymethyl)pyridine-κ^2^<i>N</i>,<i>O</i>]dinitratocopper(II)","Acta Crystallographica Section E","2005","61","7","m1350","m1351","10.1107/S1600536805018696","","","0.71073","MoKα","","0.0263","0.0248","","","0.0752","0.0763","","","","","","1.05","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2206250","5.47","0.001","16.618","0.003","17.322","0.003","90","","90","","90","","1574.6","0.5","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[o-Phenylenebis(salicylideneaminato)]copper(II)","","- C20 H14 Cu N2 O2 -","- C20 H14 Cu N2 O2 -","- C80 H56 Cu4 N8 O8 -","4","1","NG6151","Yang, Yu-Min","[<i>o</i>-Phenylenebis(salicylideneaminato)]copper(II)","Acta Crystallographica Section E","2005","61","7","m1425","m1426","10.1107/S1600536805019975","","","0.71073","MoKα","","0.1299","0.0756","","","0.1446","0.1711","","","","","","1.028","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2206251","14.789","0.006","12.853","0.005","10.688","0.004","90","","92.549","0.006","90","","2029.6","1.4","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Anthrapinacol","9,9'-Bi-10H-anthracene-9,9'-diol","","- C28 H22 O2 -","- C28 H22 O2 -","- C112 H88 O8 -","4","1","OB6506","Liu, Jian-Cheng; Jin, Shuo; Liu, Bo; Guo, Jian-Ping","9,9'-Bi-10<i>H</i>-anthracene-9,9'-diol","Acta Crystallographica Section E","2005","61","7","o2035","o2037","10.1107/S1600536805014005","","","0.71073","MoKα","","0.1095","0.0621","","","0.108","0.1213","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206252","14.532","0.002","9.7074","0.0013","14.823","0.002","90","","96.167","0.002","90","","2078.9","0.5","295","2","295","2","","","","","","","","6","C 1 c 1","C -2yc","9","","(2-Methylpropane-1,2-diamine-κ^2^N,N')[tris(2-aminoehtttyl)amine- κ^4^N,N',N'',N''')nickel(II) diperchlorate","","- C10 H30 Cl2 N6 Ni O8 -","- C10 H30 Cl2 N6 Ni O8 -","- C40 H120 Cl8 N24 Ni4 O32 -","4","1","OB6524","Yung-Chan Lin; Tian-Huey Lu; Chang-Yao Li; Fen-Ling Liao; Chung-Sun Chung","(2-Methylpropane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')[tris(2-aminoethyl)amine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']nickel(II) diperchlorate","Acta Crystallographica Section E","2005","61","7","m1398","m1400","10.1107/S160053680501932X","","","0.71073","MoKα","","0.0483","0.0392","","","0.108","0.1158","","","","","","0.914","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206253","12.7001","0.0014","32.015","0.005","7.3041","0.0019","90","","90","","90","","2969.8","1","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","brucinium 3-nitrohydrogenphthalate dihydrate","2,3-dimethoxystrychnidinium-10-one 2-carboxy-6-nitrophthalate dihydrate","","- C31 H35 N3 O12 -","- C31 H35 N3 O12 -","- C124 H140 N12 O48 -","4","1","OB6527","Graham Smith; Urs D. Wermuth; David J. Young; Peter C. Healy","Brucinium 2-carboxy-6-nitrophthalate dihydrate: the 1:1 proton-transfer compound of brucine with 3-nitrophthalic acid","Acta Crystallographica Section E","2005","61","7","o2008","o2011","10.1107/S1600536805017149","","","0.71069","MoKα","","0.0935","0.065","","","0.1626","0.1794","","","","","","1.169","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206254","8.355","0.001","9.75","0.001","12.202","0.002","99.292","0.003","96.912","0.003","97.103","0.003","963.4","0.2","289","2","289","2","","","","","","","","4","P -1","-P 1","2","","Diethyl 2,8-diamino-4,10-bis(3-nitrophenyl)naphtha[1,2-b;6,5-b']dipyran- 3,9-dicarboxylate dimethylformamide disolvate","","- C40 H42 N6 O12 -","- C40 H42 N6 O12 -","- C40 H42 N6 O12 -","1","0.5","OB6529","Yu-Cheng Wang; Xiang-Shan Wang; Zhao-Sen Zeng; Da-Qing Shi","Diethyl 2,8-diamino-4,10-bis(3-nitrophenyl)naphtho[1,2-<i>b</i>;6,5-<i>b</i>']dipyran-3,9-dicarboxylate dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","7","o2027","o2029","10.1107/S1600536805017113","","","0.71073","MoKα","","0.0955","0.0707","","","0.2198","0.2415","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206255","11.5861","0.0005","13.7665","0.0007","16.8391","0.0008","90","","90","","90","","2685.8","0.2","295","","295","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(5R,6R,7R,9R,13R,14S)-21-Cyclopropylmethyl-6,14-endo-ethano- 2',3',4',5',7,8-hexahydro-4',4',5',5'-tetramethylfurano- [2',3'6,7]normorphide hydrochloride methanol solvate","","- C29 H42 Cl N O4 -","- C29 H42 Cl N O4 -","- C116 H168 Cl4 N4 O16 -","4","1","OB6533","Čejka, Jan; Kratochvíl, Bohumil; Chudík, Miloslav; Jegorov, Alexandr","(5<i>R</i>,6<i>R</i>,7<i>R</i>,9<i>R</i>,13<i>R</i>,14<i>S</i>)-21-Cyclopropylmethyl-6,14-<i>endo</i>-ethano-2',3',4',5',7,8-hexahydro-4',4',5',5'-tetramethylfurano[2',3'6,7]normorphide hydrochloride methanol solvate","Acta Crystallographica Section E","2005","61","7","o2274","o2276","10.1107/S1600536805019410","","","1.5418","CuKα","","0.0461","0.0412","","0.0524","0.0491","0.0491","","","","","","1.0818","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206256","13.689","0.0004","8.2386","0.0002","16.7066","0.0005","90","","92.9198","0.0009","90","","1881.69","0.09","296","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(4-Methylphenylsulfonyl)-1,3-diphenylprop-2-en-1-one","","- C22 H18 O3 S -","- C22 H18 O3 S -","- C88 H72 O12 S4 -","4","1","OB6534","Jian-Ming Gu; Xiu-Rong Hu; Wei-Ming Xu","2-(4-Methylphenylsulfonyl)-1,3-diphenylprop-2-en-1-one","Acta Crystallographica Section E","2005","61","7","o2183","o2184","10.1107/S1600536805018684","","","0.7107","MoKα","","","0.045","","","","0.141","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206257","11.3701","0.0005","19.4632","0.0008","17.7735","0.0007","90","","103.338","0.001","90","","3827.2","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(2,2'-Bipyridine)chloro(4'-tolyl-2,2':6',2""-terpyridine)iridium(III) bis(hexafluorophosphate) acetonitrile disolvate","","- C36 H31 Cl F12 Ir N7 P2 -","- C36 H31 Cl F12 Ir N7 P2 -","- C144 H124 Cl4 F48 Ir4 N28 P8 -","4","1","OB6535","Yutaka, Tomona; Obara, Shinya; Haga, Masa-aki; Yokoyama, Yoshimi; Sakai, Ken","(2,2'-Bipyridine)chloro(4'-tolyl-2,2':6',2''-terpyridine)iridium(III) bis(hexafluorophosphate) acetonitrile disolvate","Acta Crystallographica Section E","2005","61","7","m1357","m1359","10.1107/S1600536805018702","","","0.71073","MoKα","","0.0202","0.0177","","","0.0438","0.0449","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206258","11.9675","0.0015","11.066","0.002","32.7891","0.0014","90","","90","","90","","4342.3","1","290","2","290","2","","","","","","","","4","P c a 21","P 2c -2ac","29","(3RS,4RS)-3-(2-Furyl)-2-phenetyl-4-(pyrrolidin-1-ylcarbonyl)-3,4- dihydroisoquinolin-1(2H)-one","(3RS,4RS)-3-(2-Furyl)-2-phenetyl-4-(pyrrolidin-1-ylcarbonyl)-3,4- dihydroisoquinolin-1(2H)-one","","- C26 H26 N2 O3 -","- C26 H26 N2 O3 -","- C208 H208 N16 O24 -","8","2","OB6537","Rosica Petrova; Boris Shivachev; Krasimir Kosev; Malinka Stoyanova; Silvia Angelova","(3<i>RS</i>,4<i>RS</i>)-3-(2-Furyl)-2-phenethyl-4-(pyrrolidin-1-ylcarbonyl)-3,4-dihydroisoquinolin-1(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","7","o2248","o2250","10.1107/S1600536805019239","","","0.71073","MoKα","","0.1428","0.0551","","","0.1026","0.1287","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206259","12.6213","0.0018","11.2582","0.0016","14.291","0.002","90","","109.869","0.003","90","","1909.8","0.5","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diaquatetraimidazolecobalt(II) dibromide","","- C12 H20 Br2 Co N8 O2 -","- C12 H20 Br2 Co N8 O2 -","- C48 H80 Br8 Co4 N32 O8 -","4","0.5","OM6244","Zhang, Hui; Fang, Liang; Yuan, Runzhang","Diaquatetraimidazolecobalt(II) dibromide","Acta Crystallographica Section E","2005","61","7","m1389","m1390","10.1107/S1600536805018611","","","0.71073","MoKα","","0.0252","0.0209","","","0.0487","0.05","","","","","","1.085","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206260","5.8988","0.001","7.935","0.002","13.903","0.004","97.762","0.01","91.487","0.01","106.146","0.015","618","0.3","105","","105","","","","","","","","","4","P -1","-P 1","2","2,2'-Bis-(3,5-dimethylphenyltellura)azobenzene","(μ-Diazenediyldiphenyl-κ^2^C^2^,N^2^:κ^2^C^2'^,N^1^)bis(3,5- dimethylphenyl)ditellurium(II)","","- C28 H26 N2 Te2 -","- C28 H26 N2 Te2 -","- C28 H26 N2 Te2 -","1","0.5","OM6247","Prabodhika Mallikaratchy; Richard E. Norman; Frank R. Fronczek; Thomas Junk","(μ-Diazenediyldiphenyl-κ^2^<i>C</i>^2^,<i>N</i>^2^:κ^2^<i>C</i>^2'^,<i>N</i>^1^)bis[(3,5-dimethylphenyl)tellurium(II)]","Acta Crystallographica Section E","2005","61","7","m1370","m1372","10.1107/S1600536805018659","","","0.71073","MoKα","","0.032","0.026","","","0.059","0.062","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206261","9.663","0.002","7.128","0.002","9.922","0.002","90","","98.42","0.03","90","","676","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","catena-Poly[[zinc(II)-μ-[2-(2-carboxylatophenyliminomethyl)phenolato- 1κ^3^O,N,O':1'κO''] methanol solvate]","","- C15 H13 N O4 Zn -","- C15 H13 N O4 Zn -","- C30 H26 N2 O8 Zn2 -","2","1","OM6248","Ju, Wen-Zheng; Shi, Lei; Xue, Jia-Yu","<i>catena</i>-Poly[[zinc(II)-μ-[2-(2-carboxylatophenyliminomethyl)phenolato-1κ^3^<i>O</i>,<i>N</i>,<i>O</i>':1'κ<i>O</i>'']] methanol solvate]","Acta Crystallographica Section E","2005","61","7","m1427","m1428","10.1107/S1600536805019823","","","0.71073","MoKα","","0.0317","0.0309","","","0.0856","0.0861","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206262","8.532","0.004","5.782","0.002","14.05","0.006","90","","102.784","0.007","90","","675.9","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(S)-3-[4-(Benzyloxy)phenyl]-2-hydroxypropanoic acid","","- C16 H16 O4 -","- C16 H16 O4 -","- C32 H32 O8 -","2","1","RN6049","Wang, He-Qing; Zeng, Qing-Le; Fang, Hua; Huang, Rong-Bin; Zhao, Yu-Fen","(<i>S</i>)-3-[4-(Benzyloxy)phenyl]-2-hydroxypropanoic acid","Acta Crystallographica Section E","2005","61","7","o2286","o2287","10.1107/S1600536805019100","","","0.71073","MoKα","","0.0727","0.0698","","","0.2","0.2038","","","","","","0.863","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206263","7.3871","0.0007","13.8981","0.0016","9.8971","0.0012","90","","108.441","0.008","90","","963.93","0.19","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(3-pyridylmethyl)benzene-1,4-dicarboxamide dihydrate","","- C20 H22 N4 O4 -","- C20 H22 N4 O4 -","- C40 H44 N8 O8 -","2","0.5","RN6050","Ge, Chun-Hua; Kou, Hui-Zhong; Wang, Ru-Ji; Jiang, Yun-Bo; Cui, Ai-Li","<i>N</i>,<i>N</i>'-Bis(3-pyridylmethyl)benzene-1,4-dicarboxamide dihydrate","Acta Crystallographica Section E","2005","61","7","o2024","o2026","10.1107/S1600536805017046","","","0.71073","MoKα","","0.0655","0.0392","","","0.0993","0.1291","","","","","","1.092","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206264","8.9163","0.0012","9.5613","0.0013","12.0628","0.0017","102.881","0.003","90.646","0.003","109.411","0.003","941.4","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","Methyl 2-[2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfanylmethyl)phenyl]- 3-methoxyacrylate","","- C19 H20 N4 O3 S -","- C19 H20 N4 O3 S -","- C38 H40 N8 O6 S2 -","2","1","RN6051","De-You Teng; Feng-Qin Ji; Wei Huang","Methyl 2-[2-(5,7-dimethyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-2-ylsulfanylmethyl)phenyl]-3-methoxyacrylate","Acta Crystallographica Section E","2005","61","7","o1992","o1993","10.1107/S1600536805016703","","","0.71073","MoKα","","0.0887","0.0603","","","0.1566","0.1891","","","","","","1.105","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206265","9.814","0.003","5.9232","0.0017","9.701","0.003","90","","112.07","0.004","90","","522.6","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Butyramide","Butyramide","","- C4 H9 N O -","- C4 H9 N O -","- C16 H36 N4 O4 -","4","1","RN6052","Thomas C. Lewis; Derek A. Tocher","A low-temperature determination of butyramide","Acta Crystallographica Section E","2005","61","7","o1985","o1986","10.1107/S1600536805017022","","","0.71073","MoKα","","0.0533","0.041","","","0.1044","0.1112","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206266","11.5254","0.0014","14.5357","0.0018","15.769","0.002","90","","90","","90","","2641.8","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6α-Hydroxy-12-oleanen-3-one","","- C30 H48 O2 -","- C30 H48 O2 -","- C120 H192 O8 -","4","1","RZ6077","Kui-Wu Wang; Cui-Rong Sun; Xiao-Ji Cao; Yuan-Jiang Pan","6α-Hydroxy-12-oleanen-3-one: a triterpenoid from the stalks of <i>Celastrus hypoleucus</i>","Acta Crystallographica Section E","2005","61","7","o2022","o2023","10.1107/S1600536805017216","","","0.71073","MoKα","","0.047","0.0372","","","0.1011","0.1069","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206267","11.5212","0.0018","7.9018","0.0012","30.551","0.005","90","","90","","90","","2781.3","0.8","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ethyl 3-[(1,5-dimethylpyrazol-4-yl)carbonylhydrazino]butyrate","","- C12 H18 N4 O3 -","- C12 H18 N4 O3 -","- C96 H144 N32 O24 -","8","1","RZ6079","Li-Rong Wen; Zi-Qin Ke; Bo Qu; Ming Li","Ethyl 3-[(1,5-dimethylpyrazol-4-yl)carbonylhydrazino]butyrate","Acta Crystallographica Section E","2005","61","7","o2018","o2019","10.1107/S160053680501679X","","","0.71073","MoKα","","0.0718","0.0513","","","0.1447","0.1556","","","","","","0.992","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206268","15.054","0.007","6.538","0.003","36.23","0.015","90","","95.8","0.006","90","","3548","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(N-Salicylaldehyde-p-nitrobenzoylhydrazonato-κ^3^O,N,O') (morpholine-κN)copper(II)","","- C18 H18 Cu N4 O5 -","- C18 H18 Cu N4 O5 -","- C144 H144 Cu8 N32 O40 -","8","1","RZ6081","Yuan, Li-Hui; Wu, Qiong-Jie; Liu, Shi-Xiong","(Morpholine-κ<i>N</i>)(salicylaldehyde 4-nitrobenzoylhydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2005","61","7","m1310","m1312","10.1107/S1600536805017642","","","0.71073","MoKα","","0.0923","0.0537","","","0.109","0.1198","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206269","11.629","0.003","9.927","0.002","14.019","0.003","90","","106.897","0.004","90","","1548.5","0.6","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Methoxyphenyl)-3-methyl-5-(2-pyridyl)-4H-1,2,4-triazole dihydrate","","- C15 H18 N4 O3 -","- C15 H18 N4 O3 -","- C60 H72 N16 O12 -","4","1","RZ6085","Zuo-Xiang Wang; Yan Lan; Lu-Tong Yuan; Chun-Yi Liu","4-(4-Methoxyphenyl)-3-methyl-5-(2-pyridyl)-4<i>H</i>-1,2,4-triazole dihydrate","Acta Crystallographica Section E","2005","61","7","o2033","o2034","10.1107/S1600536805017137","","","0.71073","MoKα","","0.0657","0.0482","","","0.1113","0.1148","","","","","","0.968","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206270","10.4672","0.0002","11.2549","0.0002","17.1109","0.0004","92.235","0.0012","106.562","0.001","94.86","0.0012","1921","0.07","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","5,10,15,20-Tetrakis(4-pyridyl)porphyrin triacetic acid clathrate","","- C46 H38 N8 O6 -","- C46 H38 N8 O6 -","- C92 H76 N16 O12 -","2","1","RZ6086","Sumod George; Israel Goldberg","5,10,15,20-Tetrakis(4-pyridyl)porphyrin tris(acetic acid) clathrate","Acta Crystallographica Section E","2005","61","7","o1973","o1975","10.1107/S1600536805016867","","","0.71073","MoKα","","0.0657","0.0473","","","0.1204","0.1338","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206271","11.4533","0.0014","12.9875","0.0015","6.259","0.0007","90","","99.191","0.002","90","","919.07","0.19","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-trans-trans-Dibromobis(4-fluoroaniline)bis(acetonitrile)nickel(II)","","- C16 H18 Br2 F2 N4 Ni -","- C16 H18 Br2 F2 N4 Ni -","- C32 H36 Br4 F4 N8 Ni2 -","2","0.5","RZ6087","John Fawcett; Fabrizio Sicilia; Gregory A Solan","<i>trans</i>,<i>trans</i>,<i>trans</i>-Diacetonitriledibromobis(4-fluoroaniline)nickel(II)","Acta Crystallographica Section E","2005","61","7","m1256","m1257","10.1107/S1600536805016995","","","0.71073","MoKα","","0.0294","0.027","","","0.068","0.0689","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206272","9.1778","0.0018","14.768","0.003","7.6109","0.0015","90","","90","","90","","1031.6","0.4","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Trans-1,2-bis(4-pyridyl)ethylene monohydrate","","- C12 H12 N2 O -","- C12 H12 N2 O -","- C48 H48 N8 O4 -","4","1","RZ6088","Huang, Wei; Qian, Hui-Fen","<i>trans</i>-1,2-Bis(4-pyridyl)ethylene monohydrate","Acta Crystallographica Section E","2005","61","7","o2050","o2052","10.1107/S1600536805017666","","","0.71073","MoKα","","0.0367","0.0362","","","0.0894","0.0895","","","","","","1.168","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206273","9.414","0.002","11.041","0.002","12.347","0.002","105.83","0.03","103.87","0.03","107.4","0.03","1103.7","0.6","290","2","290","2","","","","","","","","7","P -1","-P 1","2","","9-(2,6-Dibromophenoxycarbonyl)-10-methylacridinium trifluoromethanesulfonate","","- C22 H14 Br2 F3 N O5 S -","- C22 H14 Br2 F3 N O5 S -","- C44 H28 Br4 F6 N2 O10 S2 -","2","1","RZ6089","Artur Sikorski; Karol Krzymiński; Antoni Konitz; Jerzy Błażejowski","9-(2,6-Dibromophenoxycarbonyl)-10-methylacridinium trifluoromethanesulfonate","Acta Crystallographica Section E","2005","61","7","o2131","o2133","10.1107/S1600536805017952","","","0.71073","MoKα","","0.147","0.0461","","","0.1008","0.1227","","","","","","0.94","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206274","26.088","0.004","37.204","0.006","6.5952","0.0011","90","","90","","90","","6401.2","1.8","294","2","294","2","","","","","","","","6","F d d 2","F 2 -2d","43","","(Z)-1-(2,5-dichlorophenyl)-2-(3-phenylthiazolidin-2-ylidene)ethanone","","- C17 H13 Cl2 N O S -","- C17 H13 Cl2 N O S -","- C272 H208 Cl32 N16 O16 S16 -","16","1","RZ6091","Xu, Liang-Zhong; Yu, Guan-Ping; Zhang, Pu-Yong; Li, Chun-Li","(<i>Z</i>)-1-(2,5-Dichlorophenyl)-2-(3-phenylthiazolidin-2-ylidene)ethanone","Acta Crystallographica Section E","2005","61","7","o2104","o2105","10.1107/S1600536805017964","","","0.71073","MoKα","","0.0832","0.0402","","","0.0764","0.0915","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206275","28.455","0.006","13.737","0.003","19.396","0.004","90","","115.46","0.03","90","","6845","3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","di-μ~2~-chloro-bis[bis(triphenylphosphito)copper(I)]","","- C72 H60 Cl2 Cu2 O12 P4 -","- C72 H60 Cl2 Cu2 O12 P4 -","- C288 H240 Cl8 Cu8 O48 P16 -","4","0.5","RZ6092","Fang-Fang Jian; Ke-Fei Wang; Hai-Lian Xiao; Yuan-Biao Qiao","A dinuclear chloro(triphenylphosphito)copper(I) complex, di-μ~2~-chloro-bis[bis(triphenylphosphito)copper(I)]","Acta Crystallographica Section E","2005","61","7","m1324","m1325","10.1107/S1600536805018325","","","0.71073","MoKα","","0.093","0.0519","","","0.1238","0.1459","","","","","","1.066","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206276","11.67","0.002","13.466","0.003","14.792","0.003","94.77","0.03","90.82","0.03","96.26","0.03","2302","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Tris(5,5'-dimethyl-2,2'-bipyridyl-κ^2^N,N')iron(II) bis(perchlorate) 5,5'-dimethyl-2,2'-bipyridyl solvate","","- C48 H48 Cl2 Fe N8 O8 -","- C48 H48 Cl2 Fe N8 O8 -","- C96 H96 Cl4 Fe2 N16 O16 -","2","1","RZ6093","Albada, Gerard A. van; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","Tris(5,5'-dimethyl-2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')iron(II) bis(perchlorate) 5,5'-dimethyl-2,2'-bipyridyl solvate","Acta Crystallographica Section E","2005","61","7","m1411","m1412","10.1107/S1600536805019574","","","0.71073","MoKα","","0.1311","0.0778","","","0.2036","0.238","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206277","10.3988","0.0009","8.7056","0.0008","17.5354","0.0016","90","","102.184","0.002","90","","1551.7","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(2-Ethoxyphenyl)-6-phenyl-1,2,4-triazolo[3,4-b][1,3,4]thiadiazole","","- C17 H14 N4 O S -","- C17 H14 N4 O S -","- C68 H56 N16 O4 S4 -","4","1","RZ6094","Xiao-Bo Huang; Miao-Chang Liu; Li-Xue Zhang; An-Jiang Zhang; Ya-li Xu; Miao-lin Hu","3-(2-Ethoxyphenyl)-6-phenyl-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazole","Acta Crystallographica Section E","2005","61","7","o2233","o2234","10.1107/S160053680501901X","","","0.71073","MoKα","","0.053","0.0453","","","0.1113","0.1162","","","","","","1.042","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206278","8.1173","0.0013","9.8449","0.0015","13.6802","0.0017","90","","122.944","0.007","90","","917.4","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N^1^,N^4^-bis(pyridin-4-ylmethyl)terephthalamide dihydrate","","- C20 H22 N4 O4 -","- C20 H22 N4 O4 -","- C40 H44 N8 O8 -","2","0.5","SG6010","Zhang, Hong-Tao; You, Xiao-Zeng","<i>N</i>,<i>N</i>'-Bis(pyridin-4-ylmethyl)terephthalamide dihydrate: a self-interpenetrating hydrogen-bonding network","Acta Crystallographica Section E","2005","61","7","o2055","o2057","10.1107/S1600536805017563","","","0.71073","MoKα","","0.0907","0.0497","","","0.1019","0.113","","","","","","0.908","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206279","11.795","0.002","16.976","0.002","8.7656","0.0014","90","","99.764","0.003","90","","1729.7","0.5","294","2","294","2","","","","","","","","4","C 1 c 1","C -2yc","9","","4-[(4-Hydroxy-3-methoxybenzylidene)amino]-1,5-dimethyl-2-phenylpyrazolidin- 3-one","","- C19 H19 N3 O3 -","- C19 H19 N3 O3 -","- C76 H76 N12 O12 -","4","1","SG6011","Chun-Hua Diao; Zhi Fan; Ming Yu; Xin Chen; Zuo-Liang Jing; Qi-Liang Deng","4-[(4-Hydroxy-3-methoxybenzylidene)amino]-1,5-dimethyl-2-phenylpyrazolidin-3-one","Acta Crystallographica Section E","2005","61","7","o2322","o2323","10.1107/S1600536805019938","","","0.71073","MoKα","","0.0393","0.0306","","","0.08","0.0831","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206280","21.883","0.002","8.7246","0.0006","7.2407","0.0006","90","","90","","90","","1382.4","0.2","273","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","7-Amino-3-(3-aminophenyl)-1H-quinazoline-2,4-dithione","","- C14 H12 N4 S2 -","- C14 H12 N4 S2 -","- C56 H48 N16 S8 -","4","1","SG6012","Yu, Yun; Yang, Kai-Bin; Lin, Li-Rong; Huang, Rong-Bin; Zheng, Lan-Sun","7-Amino-3-(3-aminophenyl)-1<i>H</i>-quinazoline-2,4-dithione","Acta Crystallographica Section E","2005","61","7","o2310","o2311","10.1107/S1600536805019926","","","0.71073","MoKα","","0.0925","0.0662","","","0.1501","0.1644","","","","","","0.991","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206281","20.6025","0.0004","12.4769","0.0002","29.709","0.0006","90","","90","","90","","7636.9","0.2","173","2","173","2","","","","","","","","9","P c a 21","P 2c -2ac","29","","","","- C37 H41 Cl Fe N2 Ni O2 P2 S3 -","- C37 H41 Cl Fe N2 Ni O2 P2 S3 -","- C296 H328 Cl8 Fe8 N16 Ni8 O16 P16 S24 -","8","2","SG6013","Duff, S. E.; Hitchcock, P. B.; Davies, S. C.; Barclay, J. E.; Evans, D. J.","1,3-Bis(diphenylphosphino)propane-2κ^2^<i>P</i>,<i>P</i>'-dicarbonyl-1κ^2^<i>C</i>-chloro-2κ<i>Cl</i>-{μ-2,2',2''-nitrilotriethanethiolato(3‒)-1κ^4^<i>N</i>,<i>S</i>,<i>S</i>',<i>S</i>'':2κ^2^<i>S</i>,<i>S</i>'}iron(II)nickel(II) acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","m1316","m1319","10.1107/S1600536805018088","","","0.71073","MoKα","","0.066","0.0522","","","0.1006","0.1069","","","","","","1.069","","","","has coordinates,has disorder,has Fobs","194481","2020-10-21","18:00:00",""
"2206282","9.5123","0.0012","9.2752","0.0011","24.424","0.003","90","","95.967","0.002","90","","2143.2","0.5","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1'-tert-Butyl-2'-(2,2-dimethyl-4-oxochroman-6-carbonyl)benzohydrazide","","- C23 H26 N2 O4 -","- C23 H26 N2 O4 -","- C92 H104 N8 O16 -","4","1","SG6014","Pei-Liang Zhao; Wei Huang; Guang-Fu Yang","1'-<i>tert</i>-Butyl-2'-(2,2-dimethyl-4-oxochroman-6-carbonyl)benzohydrazide","Acta Crystallographica Section E","2005","61","7","o2139","o2141","10.1107/S1600536805018398","","","0.71073","MoKα","","0.0954","0.0558","","","0.1212","0.138","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206283","11.9182","0.0005","16.5293","0.0007","21.1391","0.0009","90","","90","","90","","4164.4","0.3","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","catena-Poly[[tri-μ~2~-benzoato-dizinc(II)]-μ~2~-hydroxy]","","- C21 H16 O7 Zn2 -","- C21 H16 O7 Zn2 -","- C168 H128 O56 Zn16 -","8","1","SG6015","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","<i>catena</i>-Poly[[tri-μ~2~-benzoato-dizinc(II)]-μ~2~-hydroxy]","Acta Crystallographica Section E","2005","61","7","m1340","m1342","10.1107/S1600536805018404","","","0.71073","MoKα","","0.069","0.051","","","0.119","0.129","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206284","7.752","0.002","9.238","0.003","9.304","0.003","104.062","0.005","107.942","0.005","95.651","0.005","603.9","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","3-[(4,5-Dibromo-1-methyl-1H-pyrrole-2-carbonyl)amino]propanoic acid","","- C9 H10 Br2 N2 O3 -","- C9 H10 Br2 N2 O3 -","- C18 H20 Br4 N4 O6 -","2","1","SG6016","Yu-Xia Li; Po-Run Liu; Xiang-Chao Zeng; Shi-Hai Xu; Fen-Ni Liu","3-[(4,5-Dibromo-1-methyl-1<i>H</i>-pyrrole-2-carbonyl)amino]propanoic acid","Acta Crystallographica Section E","2005","61","7","o2150","o2151","10.1107/S1600536805018416","","","0.71073","MoKα","","0.0495","0.0345","","","0.0774","0.0852","","","","","","1.022","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206285","7.4688","0.0015","9.6157","0.0019","39.192","0.008","90","","90","","90","","2814.7","1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(25R)-spirost-5-en-3-ol dimethyl sulfoxide solvate","","- C29 H48 O4 S -","- C29 H48 O4 S -","- C116 H192 O16 S4 -","4","1","SG6018","Xiufeng Zhang; Yan Cui; Lanfen Wang; Shiwei Zhang; Baozhen Yan; Yang Liu","(25<i>R</i>)-Spirost-5-en-3-ol dimethyl sulfoxide solvate","Acta Crystallographica Section E","2005","61","7","o2324","o2325","10.1107/S1600536805019884","","","0.71073","MoKα","","0.1408","0.0626","","","0.1546","0.1989","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206286","9.2771","0.0005","16.0667","0.0009","14.5453","0.0008","90","","97.034","0.001","90","","2151.7","0.2","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(diisopropylamino)(9-fluorenyl)(tert-butylamino)borane","(tert-butylamino)(diisopropylamino)(9-fluorenyl)borane","","- C23 H33 B N2 -","- C23 H33 B N2 -","- C92 H132 B4 N8 -","4","1","SG6020","Braunschweig, Holger; Breitling, Frank Michael; Seeler, Fabian","<i>rac</i>-(<i>tert</i>-Butylamino)(diisopropylamino)(9-fluorenyl)borane","Acta Crystallographica Section E","2005","61","7","o2303","o2304","10.1107/S1600536805019902","","","0.71073","MoKα","","0.0624","0.0543","","","0.1186","0.123","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206287","12.3616","0.0012","12.3616","0.0012","11.1685","0.0011","90","","90","","90","","1706.6","0.3","173","1","173","1","","","","","","","","4","P 41","P 4w","76","","(2S,3R,4R,5R)-2-(tert-Butyldimethylsilyloxymethyl)-2,4,5- trimethyltetrahydrofuran-3,4-diol","","- C14 H30 O4 Si -","- C14 H30 O4 Si -","- C56 H120 O16 Si4 -","4","1","SJ6091","Fan, Hong-Tao; Schürmann, Markus; Preut, Hans; Krause, Norbert","(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>R</i>)-2-(<i>tert</i>-Butyldimethylsilyloxymethyl)-2,4,5-trimethyltetrahydrofuran-3,4-diol","Acta Crystallographica Section E","2005","61","7","o1987","o1988","10.1107/S1600536805016831","","","0.71073","MoKα","","0.0839","0.0671","","","0.1781","0.1816","","","","","","1.146","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206288","28.869","0.007","3.76","0.001","15.403","0.006","90","","118.04","0.03","90","","1475.7","0.9","298","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-(3,5-Dichloro-2-pyridyl)formamide","","- C6 H4 Cl2 N2 O -","- C6 H4 Cl2 N2 O -","- C48 H32 Cl16 N16 O8 -","8","1","SJ6093","Resinger, Ales; Wentrup, Curt; Karl A. Byriel; Colin H. L. Kennard","<i>N</i>-(3,5-Dichloro-2-pyridyl)formamide","Acta Crystallographica Section E","2005","61","7","o2053","o2054","10.1107/S1600536805017605","","","0.71073","MoKα","","0.0814","0.041","","","0.1054","0.1295","","","","","","0.872","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206289","5.1656","0.001","7.9102","0.0016","17.669","0.003","83.721","0.015","82.709","0.015","75.683","0.015","691.6","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","4-Chloro-2-[(2-nitro-phenyl)-hydrazono]-3-oxo-butyric acid ethyl ester","","- C12 H12 Cl N3 O5 -","- C12 H12 Cl N3 O5 -","- C24 H24 Cl2 N6 O10 -","2","1","SJ6095","Odabas̨oǧlu, Mustafa; Özdamar, Özgür; Büyükgüngör, Orhan","Ethyl 4-chloro-2-[(2-nitrophenyl)hydrazono]-3-oxobutyrate","Acta Crystallographica Section E","2005","61","7","o2065","o2067","10.1107/S1600536805017617","","","0.71073","MoKα","","0.103","0.061","","","0.172","0.19","","","","","","1.03","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2206290","9.0131","0.0008","9.4161","0.0009","9.8932","0.0009","62.458","0.007","66.52","0.007","86.438","0.007","675.08","0.13","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","4-Chloro-2-[(4-nitrophenyl)hydrazono]-3-oxo-butyric acid ethyl ester","","- C12 H12 Cl N3 O5 -","- C12 H12 Cl N3 O5 -","- C24 H24 Cl2 N6 O10 -","2","1","SJ6096","Odabaşoğlu, Mustafa; Özdamar, Özgür; Büyükgüngör, Orhan","Ethyl 4-chloro-2-[(4-nitrophenyl)hydrazono]-3-oxobutyrate","Acta Crystallographica Section E","2005","61","7","o2068","o2070","10.1107/S1600536805017629","","","0.71073","MoKα","","0.038","0.032","","","0.08","0.083","","","","","","1.04","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2206291","22.383","0.0017","7.4043","0.0006","23.3675","0.0018","90","","112.224","0.001","90","","3585","0.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,3'-(Quinoxaline-2,3-diyldimethylene)bis(pentane-2,4-dione)","","- C20 H22 N2 O4 -","- C20 H22 N2 O4 -","- C160 H176 N16 O32 -","8","1","SJ6097","Liliana Dobrzańska; Gareth O. Lloyd","3,3'-(Quinoxaline-2,3-diyldimethylene)bis(pentane-2,4-dione)","Acta Crystallographica Section E","2005","61","7","o2114","o2116","10.1107/S1600536805018131","","","0.71073","MoKα","","0.0561","0.0443","","","0.11","0.1165","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206292","8.09","0.002","9.576","0.002","11.456","0.003","85.739","0.004","81.378","0.004","79.82","0.005","862.6","0.4","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","Bis(2,4'-bipyridin-1'-ium) 2,5-dicarboxybenzene-1,4-carboxylate benzene-1,2,4,5-tetracarboxylic acid","","- C40 H28 N4 O16 -","- C40 H28 N4 O16 -","- C40 H28 N4 O16 -","1","0.5","SJ6098","Shu-Xin Cui; Jing-Ping Zhang; Lei Wang; Yu-Long Zhao","Bis(2,4'-bipyridin-1'-ium) 2,5-dicarboxybenzene-1,4-carboxylate benzene-1,2,4,5-tetracarboxylic acid","Acta Crystallographica Section E","2005","61","7","o2193","o2195","10.1107/S1600536805018593","","","0.71073","MoKα","","0.0933","0.0498","","","0.0998","0.1155","","","","","","0.875","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206293","9.651","0.003","10.584","0.003","10.681","0.003","82.24","0.02","84.87","0.02","68.06","0.02","1001.8","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","bis[trans-(μ~2~-pentafluoroanilino-κ^2^N:N)]bis[dimethylaluminium(III)]","","- C16 H14 Al2 F10 N2 -","- C16 H14 Al2 F10 N2 -","- C32 H28 Al4 F20 N4 -","2","1","SJ6099","Niemeyer, Mark; Hoffmann, Michael","A dimeric aluminium amide, bis(<i>trans</i>-μ~2~-pentafluoroanilino-κ^2^<i>N</i>:<i>N</i>)bis[dimethylaluminium(III)]","Acta Crystallographica Section E","2005","61","7","m1334","m1336","10.1107/S1600536805017915","","","0.71073","MoKα","","0.04","0.037","","","0.105","0.107","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206294","17.608","0.003","17.608","0.003","17.224","0.003","90","","90","","90","","5340.2","1.6","298","2","298","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","Bis[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]manganese(III) nitrate","","- C26 H20 Br2 Mn N5 O5 -","- C26 H20 Br2 Mn N5 O5 -","- C208 H160 Br16 Mn8 N40 O40 -","8","1","SJ6100","Wang, Nong","Bis[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]manganese(III) nitrate","Acta Crystallographica Section E","2005","61","7","m1304","m1306","10.1107/S1600536805017757","","","0.71073","MoKα","","0.0873","0.0463","","","0.1045","0.1252","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206295","14.8348","0.0012","11.1902","0.0009","16.0909","0.0013","90","","112.479","0.001","90","","2468.2","0.3","293","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2,2''-dioxo-2,3,5,6,7,7a-hexahydroacenaphthene- 1-spiro-3'-1'H-pyrrolizine-2'spiro-1''-acenaphthene-1-carboxylate","","- C32 H25 N O4 -","- C32 H25 N O4 -","- C128 H100 N4 O16 -","4","1","SJ6101","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; R. Rathna Durga; R. Raghunathan","Ethyl 2,2''-dioxo-2',3',5',6',7',7a'-hexahydroacenaphthene-1-spiro-3'-1'<i>H</i>-pyrrolizine-2'spiro-1''-acenaphthene-1-carboxylate","Acta Crystallographica Section E","2005","61","7","o2267","o2269","10.1107/S1600536805019276","","","0.71073","Mo-Kα","","0.0817","0.061","","","0.1615","0.1775","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206296","11.775","0.002","7.0646","0.0014","24.362","0.005","90","","94.777","0.004","90","","2019.5","0.7","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(1-Benzylpiperidin-4-yl)-N'-(4-methoxybenzoyl)thiourea","","- C21 H25 N3 O2 S -","- C21 H25 N3 O2 S -","- C84 H100 N12 O8 S4 -","4","1","SJ6102","Yusof, Sukeri M.; Yamin, Bohari M.","<i>N</i>-(1-Benzylpiperidin-4-yl)-<i>N</i>'-(4-methoxybenzoyl)thiourea","Acta Crystallographica Section E","2005","61","7","o2265","o2266","10.1107/S1600536805019434","","","0.71073","MoKα","","0.091","0.068","","","0.125","0.133","","","","","","1.18","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206297","13.938","0.004","10.414","0.003","19.311","0.004","90","","131.108","0.013","90","","2112","1.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2-Diphenylphosphanylbenzylidene)-4-methylphenylamine","","- C26 H22 N P -","- C26 H22 N P -","- C104 H88 N4 P4 -","4","1","SJ6103","Shamsuddin, Mustaffa; Nur, Abdul Malik M.; Yamin, Bohari M.","<i>N</i>-[2-(Diphenylphosphanyl)benzylidene]-4-methylaniline","Acta Crystallographica Section E","2005","61","7","o2263","o2264","10.1107/S1600536805019422","","","0.71073","MoKα","","0.098","0.067","","","0.13","0.14","","","","","","1.19","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206298","9.9969","0.0006","16.5736","0.001","14.6322","0.0009","90","","109.248","0.001","90","","2288.8","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[copper(I)-di-μ-trans-1-(2-pyridyl)-2-(4-pyridyl)ethylene- κ^2^N^2^:N^4^;κ^2^N^4^:N^2^] tetrafluoroborate]","","- C24 H20 B Cu F4 N4 -","- C24 H20 B Cu F4 N4 -","- C96 H80 B4 Cu4 F16 N16 -","4","1","SJ6104","Kai-Long Zhong; Wen-Jie Lu","<i>catena</i>-Poly[[copper(I)-di-μ-<i>trans</i>-1-(2-pyridyl)-2-(4-pyridyl)ethylene-κ^2^<i>N</i>^2^:<i>N</i>^4^;κ^2^<i>N</i>^4^:<i>N</i>^2^] tetrafluoroborate]","Acta Crystallographica Section E","2005","61","7","m1416","m1418","10.1107/S1600536805019501","","","0.71073","Mo-Kα","","0.0883","0.0459","","","0.0993","0.1105","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206299","8.4629","0.0013","8.753","0.0013","9.5926","0.0014","110.489","0.002","94.886","0.002","108.3","0.002","616.57","0.16","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","1,2,3,4-Tetraphenylbutane-1,4-dione benzene solvate","","- C34 H28 O2 -","- C34 H28 O2 -","- C34 H28 O2 -","1","0.5","SJ6105","Amit Jhawar; Ilia A. Guzei; Vitaliy I. Timokhin; Robert West","1,2,3,4-Tetraphenylbutane-1,4-dione benzene solvate and a brief analysis of the solvated organic structures in the Cambridge Structural Database","Acta Crystallographica Section E","2005","61","7","o2291","o2293","10.1107/S1600536805019513","","","0.71073","Mo-Kα","","0.0687","0.0537","","","0.1277","0.1385","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206300","12.6529","0.001","12.6529","0.001","12.6529","0.001","90","","90","","90","","2025.7","0.3","173","2","173","2","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","Tetrakis(trimethylsilyl)methane","","- C13 H36 Si4 -","- C13 H36 Si4 -","- C52 H144 Si16 -","4","0.333333","SJ6109","Lerner, Hans-Wolfram; Bolte, Michael","Tetrakis(trimethylsilyl)methane","Acta Crystallographica Section E","2005","61","7","o2326","o2327","10.1107/S1600536805020015","","","0.71073","Mo-Kα","","0.096","0.094","","","0.2311","0.2373","","","","","","1.181","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206301","9.8153","0.0016","10.4218","0.0017","10.5894","0.0017","110.538","0.002","93.864","0.002","97.819","0.002","997.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate","","- C21 H20 Cl N O5 S -","- C21 H20 Cl N O5 S -","- C42 H40 Cl2 N2 O10 S2 -","2","1","SU6202","Suchada Chantrapromma; Boonwasana Jindawong; Hoong-Kun Fun; Shazia Anjum; Chatchanok Karalai","4-(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate","Acta Crystallographica Section E","2005","61","7","o2096","o2098","10.1107/S1600536805017769","","","0.71073","MoKα","","0.0491","0.0451","","","0.1213","0.1257","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206302","4.0743","0.0007","11.154","0.002","14.778","0.004","90","","94.651","0.017","90","","669.4","0.2","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,6-dihydrothieno[2,3-d][1,3]dithiol-2-one","","- C5 H4 O S3 -","- C5 H4 O S3 -","- C20 H16 O4 S12 -","4","1","SU6203","Santos, Isabel C.; Belo, Dulce; Mendonça, Joana; Figueira, Mauro João; Almeida, Manuel; Rovira, Concepcion","5,6-Dihydrothieno[2,3-<i>d</i>][1,3]dithiol-2-one","Acta Crystallographica Section E","2005","61","7","o2161","o2163","10.1107/S1600536805018234","","","0.71073","MoKα","","0.0555","0.0394","","","0.093","0.0992","","","","","","1.086","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206303","17.1422","0.0012","6.9643","0.0003","18.2627","0.0013","90","","106.961","0.005","90","","2085.4","0.2","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Benzyl-3-[2-(1-piperidinio)ethyl]benzimidazolium dichloride monohydrate","","- C21 H29 Cl2 N3 O -","- C21 H29 Cl2 N3 O -","- C84 H116 Cl8 N12 O4 -","4","1","SU6204","Selvi Karaca; Mehmet Akkurt; Ülkü Yılmaz; Hasan Küçükbay; Orhan Büyükgüngör","1-Benzyl-3-[2-(1-piperidinio)ethyl]benzimidazolium dichloride monohydrate","Acta Crystallographica Section E","2005","61","7","o2128","o2130","10.1107/S1600536805018337","","","0.71073","MoKα","","0.0386","0.0305","","","0.0755","0.0783","","","","","","1.037","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206304","7.621","0.0004","10.4049","0.0006","13.155","0.0008","68.003","0.001","85.642","0.001","78.651","0.001","948.28","0.09","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[[tetraaquacopper(II)]-μ-4,4'-bipyridine-κ^2^N:N'] 4-sulfonatobenzoate]","","- C17 H20 Cu N2 O9 S -","- C17 H20 Cu N2 O9 S -","- C34 H40 Cu2 N4 O18 S2 -","2","1","TK6226","Zhang, Li-Ping; Zhu, Long-Guan","<i>catena</i>-Poly[[[tetraaquacopper(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 4-sulfonatobenzoate]","Acta Crystallographica Section E","2005","61","7","m1264","m1265","10.1107/S1600536805017125","","","0.71073","MoKα","","0.034","0.031","","","0.081","0.083","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206305","7.27","0.002","11.927","0.004","18.528","0.006","90","","98.24","0.005","90","","1590","0.9","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-tert-Butyl-3-(trifluoromethyl)-1H-pyrazol-5-yl 4-chlorobenzoate","","- C15 H14 Cl F3 N2 O2 -","- C15 H14 Cl F3 N2 O2 -","- C60 H56 Cl4 F12 N8 O8 -","4","1","TK6227","Li, Yang; Li, Jiang-Sheng; Huang, Peng-Mian; Duan, Xue-Ming; Dong, Chuan-Ming; Zeng, Tao","1-<i>tert</i>-Butyl-3-(trifluoromethyl)-1<i>H</i>-pyrazol-5-yl 4-chlorobenzoate","Acta Crystallographica Section E","2005","61","7","o2189","o2190","10.1107/S1600536805018477","","","0.71073","MoKα","","0.093","0.038","","","0.076","0.096","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206306","8.0521","0.0001","9.711","0.0001","35.8868","0.0004","90","","90","","90","","2806.13","0.06","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(p-Tolyl)-β-L-rhamnopyranosylamine 1.5-hydrate","","- C13 H22 N O5.5 -","- C13 H22 N O5.5 -","- C104 H176 N8 O44 -","8","2","TK6228","Punzo, Francesco; Watkin, David J.; Cook, Joseph M. D.; Hotchkiss, David; Fleet, George W. J.","<i>N</i>-(<i>p</i>-Tolyl)-β-<small>L</small>-rhamnopyranosylamine 1.5-hydrate","Acta Crystallographica Section E","2005","61","7","o2155","o2157","10.1107/S1600536805018489","","","0.71073","MoKα","","0.041","0.036","","0.096","0.093","0.096","","","","","","0.946","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206307","11.1653","0.0014","13.3535","0.0017","7.738","0.001","90","","107.082","0.002","90","","1102.8","0.2","292","2","292","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Diethyl 2,3-bis(benzo[1,3]dioxole-5-carbonyl)but-2-enedioate","","- C24 H20 O10 -","- C24 H20 O10 -","- C48 H40 O20 -","2","0.5","TK6229","Wang, Zhi-Guo; Chen, Ai-Hua; Yin, Guo-Dong; Wu, An-Xin","Diethyl 2,3-bis(benzo[1,3]dioxole-5-carbonyl)but-2-enedioate","Acta Crystallographica Section E","2005","61","7","o2320","o2321","10.1107/S1600536805020003","","","0.71073","MoKα","","0.065","0.054","","","0.139","0.147","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206308","7.4467","0.0016","6.1343","0.0011","22.72","0.003","90","","92.508","0.019","90","","1036.9","0.3","298","2","298","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","4-(2-Naphthyl)pyrimidine","","- C14 H10 N2 -","- C14 H10 N2 -","- C56 H40 N8 -","4","1","TK6230","Ingebrigtsen, Truls; Lejon, Tore; Hansen, Lars Kr.","4-(2-Naphthyl)pyrimidine","Acta Crystallographica Section E","2005","61","7","o2256","o2257","10.1107/S1600536805019306","","","0.71069","MoKα","","0.187","0.04","","","0.071","0.097","","","","","","0.82","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206309","9.801","0.003","15.549","0.004","26.142","0.007","90","","90","","90","","3983.9","1.9","273","2","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-[4,5-Bis(4-methoxyphenyl)-1H-imidazol-2-yl]benzonitrile","","- C24 H19 N3 O2 -","- C24 H19 N3 O2 -","- C192 H152 N24 O16 -","8","1","WK6050","Xu-Feng Liu; Zeng-Pei Zhong; Zun-Le Xu","4-[4,5-Bis(4-methoxyphenyl)-1<i>H</i>-imidazol-2-yl]benzonitrile","Acta Crystallographica Section E","2005","61","7","o1976","o1977","10.1107/S1600536805016946","","","0.71073","MoKα","","","0.0541","","","","0.1296","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206310","9.206","0.003","8.282","0.003","11.347","0.003","90","","123.255","0.017","90","","723.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(4-pyridylformyl)piperazine","","- C16 H16 N4 O2 -","- C16 H16 N4 O2 -","- C32 H32 N8 O4 -","2","0.5","WK6051","Cai-Feng Ding; Mei Zhu; Xue-Mei Li; Shu-Sheng Zhang; Hong Xu; Ping-Kai Ouyang","<i>N</i>,<i>N</i>'-Bis(4-pyridylformyl)piperazine","Acta Crystallographica Section E","2005","61","7","o1981","o1982","10.1107/S1600536805016958","","","0.71073","MoKα","","0.048","0.0442","","","0.1133","0.1173","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206311","5.5771","0.0001","14.6164","0.0003","19.2112","0.0004","90","","90","","90","","1566.04","0.05","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-O-Benzoyl-1,2-O-isopropylidene-β-D-fructopyranose","","- C16 H20 O7 -","- C16 H20 O7 -","- C64 H80 O28 -","4","1","WK6054","Langer, Vratislav; Mičová, Ju̇lia; Steiner, Bohumil; Koóš, Miroslav","3-<i>O</i>-Benzoyl-1,2-<i>O</i>-isopropylidene-β-<small>D</small>-fructopyranose","Acta Crystallographica Section E","2005","61","7","o2172","o2174","10.1107/S1600536805018520","","","0.71073","MoKα","","0.0642","0.0413","","","0.0881","0.1026","","","","","","0.988","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206312","34.33","0.003","7.038","0.0003","6.1666","0.0003","90","","91.377","0.006","90","","1489.51","0.16","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","Ammonium magnesium phosphite 18-hydrate","Diammonium trimagnesium tetrakis[hydrogenphosphate(III)] octadecahydrate","","- H48 Mg3 N2 O30 P4 -","- H48 Mg3 N2 O30 P4 -","- H96 Mg6 N4 O60 P8 -","2","0.25","WM6070","Messouri, Ibtissam; El Bali, Brahim; Capitelli, Francesco; Piniella, Juan F.; Lachkar, Mohammed; Slimani, Zineb","Diammonium tris[hexaaquamagnesium(II)] tetrakis[hydrogenphosphate(III)], (NH~4~)~2~[Mg(H~2~O)~6~]~3~(HPO~3~)~4~","Acta Crystallographica Section E","2005","61","7","i129","i131","10.1107/S160053680501723X","","","0.71073","MoKα","","0.0242","0.0221","","","0.0627","0.0637","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206313","4.9916","0.0009","6.2388","0.0011","37.342","0.007","90","","90","","90","","1162.9","0.4","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-(N-Phenylazo)aminobenzaldehyde","","- C13 H11 N3 O -","- C13 H11 N3 O -","- C52 H44 N12 O4 -","4","1","WN6356","Liu, Xin-Gang; Feng, Ya-Qing; Liu, Dong-Qing; Zhao, Yao","4-[(Phenyldiazenyl)amino]benzaldehyde","Acta Crystallographica Section E","2005","61","7","o2185","o2186","10.1107/S1600536805018751","","","0.71073","MoKα","","0.07","0.0373","","","","0.0939","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206314","9.9258","0.0011","20.089","0.002","11.8605","0.0013","90","","111.324","0.002","90","","2203.1","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","xanthone V1","5,9,10-Trihydroxy-2,2-dimethyl-12-(3-methylbut-2-enyl)-2H,6H- pyrano[3,2-b]xanthen-6-one methanol solvate","","- C24 H26 O7 -","- C24 H26 O7 -","- C96 H104 O28 -","4","1","WN6357","Suchada Chantrapromma; Nawong Boonnak; Hoong-Kun Fun; Shazia Anjum; Atta-ur-Rahman; Chatchanok Karalai","5,9,10-Trihydroxy-2,2-dimethyl-12-(3-methylbut-2-enyl)-2<i>H</i>,6<i>H</i>-pyrano[3,2-<i>b</i>]xanthen-6-one methanol solvate","Acta Crystallographica Section E","2005","61","7","o2136","o2138","10.1107/S1600536805018192","","","0.71073","MoKα","","0.0953","0.0868","","","0.2245","0.2298","","","","","","1.107","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206315","9.069","0.002","6.136","0.001","32.537","0.007","90","","96.87","0.03","90","","1797.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 2-amino-4-(3-fluorophenyl)-4H-benzo[h]chromene-3-carboxylate","","- C22 H18 F N O3 -","- C22 H18 F N O3 -","- C88 H72 F4 N4 O12 -","4","1","WN6358","Guo, Cheng; Gu, Xi-Feng; Zhang, Lian-Di; Li, Yan","Ethyl 2-amino-4-(3-fluorophenyl)-4<i>H</i>-benzo[<i>h</i>]chromene-3-carboxylate","Acta Crystallographica Section E","2005","61","7","o2125","o2127","10.1107/S1600536805018283","","","0.71073","MoKα","","0.1867","0.0837","","","0.2261","0.2894","","","","","","0.998","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206316","11.183","0.0009","13.9851","0.001","12.3419","0.0009","90","","116.445","0.001","90","","1728.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3-[3-(4-Chlorophenyl)-4-oxothiazolidin-2-yl]-6-methyl-4H-benzopyran-4-one","","- C19 H14 Cl N O3 S -","- C19 H14 Cl N O3 S -","- C76 H56 Cl4 N4 O12 S4 -","4","1","WW6378","Zhou, Zhong-Zhen; Huang, Wei; Zhao, Pei-Liang; Chen, Qiong; Yang, Guang-Fu","3-[3-(4-Chlorophenyl)-4-oxothiazolidin-2-yl]-6-methyl-4<i>H</i>-benzopyran-4-one","Acta Crystallographica Section E","2005","61","7","o2261","o2262","10.1107/S1600536805019355","","","0.71073","MoKα","","0.0551","0.0443","","","0.1252","0.1344","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206317","13.962","0.001","6.009","0.001","8.877","0.001","90","","90","","90","","744.76","0.16","295","2","295","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Diaquadithiocyanatocopper(II)","","- C2 H4 Cu N2 O2 S2 -","- C2 H4 Cu N2 O2 S2 -","- C8 H16 Cu4 N8 O8 S8 -","4","0.5","WW6382","Wu, Tao; Ma, Ming-Zhi; Zhou, Rui; Li, Dan; Ng, Seik Weng","Diaquadithiocyanatocopper(II)","Acta Crystallographica Section E","2005","61","7","m1401","m1402","10.1107/S1600536805019215","","","0.71073","MoKα","","0.033","0.032","","","0.085","0.086","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206318","8.2474","0.0016","8.4577","0.0017","10.488","0.002","70.05","0.03","76.83","0.03","62.73","0.03","609","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Bis(3-hydroxypyridine-κN)(nitrato-κ^2^O,O')silver(I)","","- C10 H10 Ag N3 O5 -","- C10 H10 Ag N3 O5 -","- C20 H20 Ag2 N6 O10 -","2","1","WW6388","Lu, Zhen-Zhong; Huo, Li-Hua; Gao, Shan; Zhao, Hui; Zhao, Jing-Gui","Bis(3-hydroxypyridine-κ<i>N</i>)(nitrato-κ^2^<i>O</i>,<i>O</i>')silver(I)","Acta Crystallographica Section E","2005","61","7","m1386","m1388","10.1107/S1600536805019240","","","0.71073","MoKα","","0.0302","0.0261","","","0.0645","0.0784","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206319","6.101","0.001","8.598","0.002","11.479","0.002","94.88","0.03","98.56","0.03","92.42","0.03","592.4","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","2,5-dibenzoyl-terephthalic acid","2,5-Dibenzoylterephthalic acid ethanol disolvate","","- C26 H26 O8 -","- C26 H26 O8 -","- C26 H26 O8 -","1","0.5","WW6389","Zhu, Hong-jun; Wang, Dan-Dan; Song, Guang-Liang; Wang, Jin-Tang; Lu, Wei-Wei; Yu, Rong","2,5-Dibenzoylterephthalic acid ethanol disolvate","Acta Crystallographica Section E","2005","61","7","o2237","o2238","10.1107/S1600536805019173","","","0.71073","MoKα","","0.0895","0.0548","","","0.1494","0.17","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206320","11.1332","0.0002","10.0822","0.0003","17.4142","0.0004","90","","104.058","0.001","90","","1896.15","0.08","106","2","106","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","butyltriphenylphosphonium bromide","Butyltriphenylphosphonium bromide","","- C22 H24 Br P -","- C22 H24 Br P -","- C88 H96 Br4 P4 -","4","1","WW6397","Czerwinski, Edmund W.","Butyltriphenylphosphonium bromide","Acta Crystallographica Section E","2005","61","7","o2272","o2273","10.1107/S160053680501929X","","","1.5418","CuKα","","0.0386","0.0339","","","","0.0948","","","","","","1.139","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206321","23.081","0.004","4.5554","0.0008","13.069","0.002","90","","108.741","0.002","90","","1301.3","0.4","294","2","294","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2-Chloro-4,6-di-morpholino-1,3,5-triazine","","- C11 H16 Cl N5 O2 -","- C11 H16 Cl N5 O2 -","- C44 H64 Cl4 N20 O8 -","4","1","WW6398","Zeng, Tao; Dong, Chuan-Ming; Shu, Xue-Gui; Li, Jiang-Sheng; Huang, Peng-Mian","2-Chloro-4,6-dimorpholino-1,3,5-triazine","Acta Crystallographica Section E","2005","61","7","o2211","o2212","10.1107/S1600536805019021","","","0.71073","MoKα","","0.0288","0.0262","","","0.0646","0.0664","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206322","7.655","0.0007","9.0221","0.0008","22.927","0.002","90","","92.811","0.002","90","","1581.5","0.2","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(2,4-Dichlorophenoxy)-N-[5-(3-pyridyl)-1,3,4-thiadiazol-2-yl]acetamide","","- C15 H10 Cl2 N4 O2 S -","- C15 H10 Cl2 N4 O2 S -","- C60 H40 Cl8 N16 O8 S4 -","4","1","WW6406","Song, Xin-Jian; Shi, Bo-An; Wang, Yan-Gang; Liu, Hong-Xia; Wang, Yan","2-(2,4-Dichlorophenoxy)-<i>N</i>-[5-(3-pyridyl)-1,3,4-thiadiazol-2-yl]acetamide","Acta Crystallographica Section E","2005","61","7","o2254","o2255","10.1107/S1600536805019343","","","0.71073","MoKα","","0.0503","0.0419","","","0.1076","0.1216","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206323","8.1827","0.0006","7.0914","0.0005","13.1674","0.0009","90","","101.154","0.001","90","","749.63","0.09","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ethylenediammonium hexaaquazinc(II) sulfate","Ethane-1,2-diaminium hexaaquazinc(II) sulfate","","- C2 H22 N2 O14 S2 Zn -","- C2 H22 N2 O14 S2 Zn -","- C4 H44 N4 O28 S4 Zn2 -","2","0.5","XU6014","Apinpus, Rujiwatra; Jumras, Limtrakul","Ethane-1,2-diaminium hexaaquazinc(II) sulfate","Acta Crystallographica Section E","2005","61","7","m1403","m1404","10.1107/S1600536805019604","","","0.71073","MoKα","","0.024","0.024","","","0.064","0.064","","","","","","1.139","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206324","16.5457","0.0009","16.7931","0.0009","22.4135","0.0012","90","","90","","90","","6227.7","0.6","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(Tris{2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)iron(II) diperchlorate acetonitrile solvate","","- C23 H33 Cl2 Fe N11 O8 -","- C23 H33 Cl2 Fe N11 O8 -","- C184 H264 Cl16 Fe8 N88 O64 -","8","1","XU6015","Chen, Hong-Mei; Yang, Shi-Ping; Chen, Qiong-Qiong; Chen, Jia-Min; Yu, Xi-Bin","(Tris{2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)iron(II) diperchlorate acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","m1277","m1279","10.1107/S1600536805017083","","","0.71073","MoKα","","0.078","0.053","","","0.15","0.163","","","","","","0.989","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206325","13.161","0.003","11.905","0.003","25.144","0.007","90","","98.794","0.004","90","","3893.3","1.7","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dichloro[bis(bis(benzimidazol-2-ylmethyl)-amine)] manganese(II) methanol trisolvate","","- C35 H42 Cl2 Mn N10 O3 -","- C35 H42 Cl2 Mn N10 O3 -","- C140 H168 Cl8 Mn4 N40 O12 -","4","1","XU6017","Zhou, Qing-Hua; Yang, Pin","Bis[bis(benzimidazol-2-ylmethyl)amine]-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'';κ^2^<i>N</i>,<i>N</i>'-chloromanganese(II) chloride methanol trisolvate","Acta Crystallographica Section E","2005","61","7","m1292","m1294","10.1107/S1600536805017678","","","0.71073","MoKα","","0.097","0.049","","","0.066","0.071","","","","","","0.925","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206326","6.9505","0.0007","7.6096","0.0007","15.225","0.0015","95.985","0.002","96.095","0.002","93.712","0.002","794","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H12 F2 N6 O2 S -","- C14 H12 F2 N6 O2 S -","- C28 H24 F4 N12 O4 S2 -","2","1","YA6246","Hu, Xiao-Wei; Chen, Qiong; Liu, Zu-Ming; Yang, Guang-Fu","The herbicide flumetsulam as the acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","o2083","o2085","10.1107/S1600536805017745","","","0.71073","MoKα","","0.048","0.044","","","0.121","0.134","","","","","","1.1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206327","22.0779","0.0017","11.0552","0.0009","18.9962","0.0015","90","","90","","90","","4636.5","0.6","292","2","292","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","1,3:4,6-Bis(1,4-diphenylethynyl-2,3-xylylene)tetrahydro-3a,6a- bis(ethoxycarbonyl)imidazo[4,5-d]imidazole-2,5(1H,3H)-dione","","- C58 H42 N4 O6 -","- C58 H42 N4 O6 -","- C232 H168 N16 O24 -","4","0.5","YA6247","Neng-Fang She; Hui-Zhen Guo; An-Xin Wu","1,3:4,6-Bis(1,4-diphenylethynyl-2,3-xylylene)tetrahydro-3a,6a-bis(ethoxycarbonyl)imidazo[4,5-<i>d</i>]imidazole-2,5(1<i>H</i>,3H)-dione, a molecular clip based on di(ethoxycarbonyl)glycoluril","Acta Crystallographica Section E","2005","61","7","o2003","o2004","10.1107/S1600536805017162","","","0.71073","MoKα","","0.101","0.062","","","0.155","0.174","","","","","","1.05","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206328","25.824","0.013","13.962","0.003","15.861","0.004","90","","124.93","0.04","90","","4689","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dipropyl 3,6-bis(4-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine-1,2-dicarboxylate","","- C22 H22 Cl2 N4 O4 -","- C22 H22 Cl2 N4 O4 -","- C176 H176 Cl16 N32 O32 -","8","1","YA6249","Guo-Wu Rao; Wei-Xiao Hu","Dipropyl 3,6-bis(4-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine-1,2-dicarboxylate","Acta Crystallographica Section E","2005","61","7","o2102","o2103","10.1107/S1600536805017101","","","0.71073","MoKα","","0.076","0.041","","","0.115","0.134","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206329","8.6588","0.0004","12.3368","0.0007","15.4441","0.0009","90","","90","","90","","1649.77","0.15","90","0.2","90","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","6-O-acetylcodeine","6α-Acetoxy-4,5α-epoxy-3-methoxy-17-methyl-morphin-7-ene","","- C20 H23 N O4 -","- C20 H23 N O4 -","- C80 H92 N4 O16 -","4","1","AC6177","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","6α-Acetoxy-4,5α-epoxy-3-methoxy-17-methylmorphin-7-ene","Acta Crystallographica Section E","2005","61","8","o2579","o2581","10.1107/S1600536805022130","","","0.71073","MoKα","","0.0962","0.0475","","","0.0943","0.1125","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206330","11.7235","0.0009","18.378","0.0013","14.1604","0.001","90","","109.903","0.001","90","","2868.7","0.4","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Dibenzyl-8b,8c-diphenyl-2,3a,4a,6,7a,8a- hexaazaperhydrocyclopenta[def]fluorene-4,8-dione","","- C34 H32 N6 O2 -","- C34 H32 N6 O2 -","- C136 H128 N24 O8 -","4","1","AC6178","Li, Yi-Tao; Long, Tao; Wu, An-Xin","2,6-Dibenzyl-8b,8c-diphenyl-2,3a,4a,6,7a,8a-hexaazaperhydrocyclopenta[<i>def</i>]fluorene-4,8-dione","Acta Crystallographica Section E","2005","61","8","o2374","o2375","10.1107/S1600536805020659","","","0.71073","MoKα","","0.1037","0.0626","","","0.1321","0.1513","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206331","9.192","0.004","6.996","0.004","10.869","0.005","90","","93.6","0.04","90","","697.6","0.6","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Aminopyridinium nitrate","","- C5 H7 N3 O3 -","- C5 H7 N3 O3 -","- C20 H28 N12 O12 -","4","1","AC6179","Rademeyer, Melanie","4-Aminopyridinium nitrate","Acta Crystallographica Section E","2005","61","8","o2496","o2498","10.1107/S1600536805020660","","","0.71073","MoKα","","0.086","0.0477","","","0.1019","0.1158","","","","","","0.943","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206332","8.628","0.002","12.727","0.002","15.4842","0.0019","90","","90","","90","","1700.3","0.5","290","2","290","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","6-O-acetylcodeine","6α-acetoxy-4,5α-epoxy-3-methoxy-17-methyl-morphin-7-ene","","- C20 H23 N O4 -","- C20 H23 N O4 -","- C80 H92 N4 O16 -","4","1","AC6180","Tsonko Kolev; Rumyana Bakalska; Boris Shivachev; Rosica Petrova","6-<i>O</i>-Acetylcodeine","Acta Crystallographica Section E","2005","61","8","o2582","o2584","10.1107/S1600536805022129","","","0.71073","MoKα","","0.1107","0.0489","","","0.1056","0.1264","","","","","","0.978","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206333","17.861","0.011","13.386","0.006","20.451","0.013","90","","91.744","0.005","90","","4887","5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,4-Bis{[(2Z)-2-(3-mesityl-3-methylcyclobutyl)-2-one thiosemicarbazono]ethyl} piperazine dimethylsulfoxide disolvate","","- C42 H68 N8 O2 S4 -","- C42 H68 N8 O2 S4 -","- C168 H272 N32 O8 S16 -","4","1","AT6012","Çiğdem Yüksektepe; Serkan Soylu; Hanife Saraçoğlu; Nezihe Çalışkan; Alaaddin Çukurovalı; Íbrahim Yılmaz; Cavit Kazaz","1,4-Bis[(<i>Z</i>)-2-(3-mesityl-3-methylcyclobutyl)-2-(thiosemicarbazono)ethyl]piperazine dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2005","61","8","o2384","o2386","10.1107/S1600536805020350","","","0.71069","MoKα","","0.117","0.058","","","0.148","0.174","","","","","","0.94","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206334","7.8929","0.0008","29.415","0.004","12.4679","0.0014","90","","90","","90","","2894.7","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-(2,3,5-Trimethylphenoxy)phthalonitrile","","- C17 H14 N2 O -","- C17 H14 N2 O -","- C136 H112 N16 O8 -","8","1","AT6019","Akbal, Tufan; Akdemir, Nesuhi; Ağar, Erbil; Kantar, Cihan; Erdönmez, Ahmet","4-(2,3,5-Trimethylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","8","o2630","o2631","10.1107/S1600536805022592","","","0.71073","MoKα","","0.082","0.036","","","0.089","0.1","","","","","","0.8","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206335","14.2841","0.0014","8.3753","0.0005","22.353","0.002","90","","90","","90","","2674.2","0.4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","4-(2-Bromo-4-chlorophenoxy)phthalonitrile","","- C14 H6 Br Cl N2 O -","- C14 H6 Br Cl N2 O -","- C112 H48 Br8 Cl8 N16 O8 -","8","1","AT6020","Atalay, Şehriman; Ocak Ískeleli, Nazan; Ağar, Erbil; Akdemir, Nesuhi","4-(2-Bromo-4-chlorophenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","8","o2654","o2655","10.1107/S1600536805021057","","","0.71073","MoKα","","0.112","0.057","","","0.123","0.144","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206336","14.929","0.005","8.2223","0.0016","18.737","0.006","90","","90","","90","","2300","1.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis[2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)ethoxy] ether","","- C20 H22 N8 O2 S2 -","- C20 H22 N8 O2 S2 -","- C80 H88 N32 O8 S8 -","4","0.5","AT6021","Wei Wang; Bing Zhao; Peng-Wu Zheng; Xue-Min Duan","Bis[2-(1-phenyl-1<i>H</i>-tetrazol-5-ylsulfanyl)ethoxy] ether","Acta Crystallographica Section E","2005","61","8","o2623","o2624","10.1107/S160053680502249X","","","0.71073","MoKα","","0.091","0.044","","","1.101","0.128","","","","","","1.01","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206337","8.2381","0.0014","12.269","0.002","12.937","0.002","90","","105.075","0.003","90","","1262.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2-Nitrophenyl)-1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane- 4-carboxamide","","- C11 H11 N2 O7 P -","- C11 H11 N2 O7 P -","- C44 H44 N8 O28 P4 -","4","1","AT6025","Zang, Hong-Jun; Guo, Ming-Lin","<i>N</i>-(2-Nitrophenyl)-1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxamide","Acta Crystallographica Section E","2005","61","8","o2772","o2774","10.1107/S1600536805023974","","","0.71073","MoKα","","0.065","0.041","","","0.099","0.115","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206338","9.1471","0.0011","12.1267","0.0014","17.475","0.002","90","","94.516","0.002","90","","1932.4","0.4","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Caesium bis[N-(carbamoylmethyl)iminodiacetato]chromium(III) dihydrate","","- C12 H20 Cr Cs N4 O12 -","- C12 H20 Cr Cs N4 O12 -","- C48 H80 Cr4 Cs4 N16 O48 -","4","1","BD6007","Visser, Hendrik G.; Purcell, Walter; Cloete, Nicoline; Muller, Alfred","Caesium bis[<i>N</i>-(carbamoylmethyl)iminodiacetato]chromate(III) dihydrate","Acta Crystallographica Section E","2005","61","8","m1668","m1670","10.1107/S160053680502101X","","","0.71073","MoKα","","","0.0317","","","","0.0803","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206339","9.3999","0.0018","20.274","0.004","9.7668","0.0019","90","","111.764","0.003","90","","1728.6","0.6","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-(Acetylamido)-N-(4-chlorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene- 3-carboxamide","","- C17 H17 Cl N2 O2 S -","- C17 H17 Cl N2 O2 S -","- C68 H68 Cl4 N8 O8 S4 -","4","1","BH6009","Chandrakumar, K.; Kokila, M. K.; Puttaraja; Mohan, S.; Manjunath Shetty, K. S.","2-(Acetylamido)-<i>N</i>-(4-chlorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","8","o2444","o2446","10.1107/S1600536805020970","","","0.71073","MoKα","","0.0731","0.0552","","","0.129","0.138","","","","","","1.088","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206340","4.7347","0.0001","32.651","0.0007","9.3959","0.0002","90","","109.031","0.0009","90","","1373.15","0.05","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzyl N-[1-(furan-2-yl)ethylidene]hydrazinecarbodithioate","","- C14 H14 N2 O S2 -","- C14 H14 N2 O S2 -","- C56 H56 N8 O4 S8 -","4","1","BH6010","Khoo, Teng-Jin; Cowley, Andrew R.; Watkin, David J.; Crouse, Karen A.; Tarafder, M. T. H.","Benzyl <i>N</i>-[1-(furan-2-yl)ethylidene]hydrazinecarbodithioate","Acta Crystallographica Section E","2005","61","8","o2441","o2443","10.1107/S1600536805020969","","","0.71073","MoKα","","0.0666","0.0393","","0.0571","0.0467","0.0467","","","","","","1.089","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206341","10.092","0.002","10.521","0.002","14.699","0.003","90","","90.43","0.03","90","","1560.7","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","α-Diphenylphosphoryl-o-cresol","2-[(diphenylphosphoryl)methyl]phenol","","- C19 H17 O2 P -","- C19 H17 O2 P -","- C76 H68 O8 P4 -","4","1","BH6014","Yulya V. Nelubina; Diana V. Alexanyan; Vladimir A. Kozlov; Konstantin A. Lyssenko; Irina L. Odinets","A monoclinic polymorph of α-diphenylphosphoryl-<i>o</i>-cresol","Acta Crystallographica Section E","2005","61","8","o2539","o2541","10.1107/S1600536805021811","","","0.71073","MoKα","","0.0693","0.0403","","","0.1063","0.1194","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206342","4.442","0.0009","12.953","0.003","12.677","0.003","90","","95.62","0.03","90","","725.9","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H11 N3 O3 -","- C4 H11 N3 O3 -","- C16 H44 N12 O12 -","4","1","BH6015","Perpétuo, Genivaldo Julio; Janczak, Jan","Piperazinium nitrate","Acta Crystallographica Section E","2005","61","8","o2531","o2533","10.1107/S1600536805021951","","","0.71073","MoKα","","0.1085","0.0426","","","0.0911","0.1077","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206343","9.9262","0.0008","22.549","0.0019","15.89","0.0013","90","","96.43","0.001","90","","3534.2","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(3,5-Dinitrobenzoato)tris(2-methyl-2-phenylpropyl)tin(IV)","","- C37 H42 N2 O6 Sn -","- C37 H42 N2 O6 Sn -","- C148 H168 N8 O24 Sn4 -","4","1","BH6016","Tian, Lai-Jin; Yu, Feng-Yang; Sun, Yu-Xi; Zhang, Bo","(3,5-Dinitrobenzoato)tris(2-methyl-2-phenylpropyl)tin(IV)","Acta Crystallographica Section E","2005","61","8","m1537","m1538","10.1107/S1600536805021458","","","0.71073","MoKα","","0.0525","0.0468","","","0.1008","0.1037","","","","","","1.185","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206344","8.81","0.002","8.81","0.002","8.81","0.002","90","","90","","90","","683.8","0.3","295","","295","","","","","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","Lanthanum Dimagnesium","","- La Mg2 -","- La Mg2 -","- La8 Mg16 -","8","0.0416667","BR6195","Belgacem, Besma; Yahyaoui, Samia; Demchenko, P. Yu.; Bodak, O. I.; Dusek, Michal; Petricek, Vaclav; Ben Hassen, Rached","Lanthanum dimagnesium","Acta Crystallographica Section E","2005","61","8","i155","i157","10.1107/S1600536805021343","","","0.71069","MoKα","","0.0093","0.0083","","","0.0242","0.0245","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206345","8.5386","0.0006","10.6333","0.0007","11.8912","0.0006","105.636","0.003","101.852","0.003","99.257","0.003","990.39","0.11","273","1","","","","","","","","","","5","P -1","-P 1","2","","poly[penta-μ-aqua-tetraaqua-μ-decavanadato-lithium(I)disodium(I)]","","- H36 Li2 Na4 O46 V10 -","- H36 Li2 Na4 O46 V10 -","- H36 Li2 Na4 O46 V10 -","1","0.5","BR6199","Chun-An Ma; Ai-Li Xie; Lian-Bang Wang","Polymeric bis(lithium disodium nonahydrate) decavanadate, {[LiNa~2~(H~2~O)~9~]~2~[V~10~O~28~]}~<i>n~</i>","Acta Crystallographica Section E","2005","61","8","i185","i187","10.1107/S1600536805023123","","","0.7107","MoKα","","","0.027","","","","0.097","","","","","","1.016","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206346","4.7586","0.001","8.253","0.0017","10.758","0.002","90","","92.845","0.002","90","","421.98","0.15","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dipotassium iron(III) {hydrogen bis[hydrogenphosphate(V)]} difluoride","","- F2 Fe H3 K2 O8 P2 -","- F2 Fe H3 K2 O8 P2 -","- F4 Fe2 H6 K4 O16 P4 -","2","0.5","BR6201","Mi, Jin-Xiao; Wang, Cheng-Xin; Wei, Zan-Bin; Chen, Fu-Jin; Xu, Chun-Yan; Mao, Shao-Yu","K~2~Fe[H(HPO~4~)~2~]F~2~","Acta Crystallographica Section E","2005","61","8","i143","i145","10.1107/S1600536805020635","","","0.71073","MoKα","","0.0232","0.0231","","","0.0636","0.0637","","","","","","1.272","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2206347","10.34657","0.00003","10.34657","0.00003","10.34657","0.00003","90","","90","","90","","1107.61","0.003","293","2","293","2","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","sodium cadmium dizinc heptafluoride","","- Cd F7 Na Zn2 -","- Cd F7 Na Zn2 -","- Cd8 F56 Na8 Zn16 -","8","0.0416667","BR6202","Friese, K.; Grzechnik, A.; Morgenroth, W.; Buth, G.; Doyle, S.; Gesland, J.-Y.","Synchrotron study of pyrochlore-related NaCdZn~2~F~7~","Acta Crystallographica, Section E","2005","61","8","i182","i184","10.1107/S160053680502297X","","","0.45","synchrotron","","0.0393","0.0317","","","0.023","0.0393","","","","","","2.3","","","","has coordinates","282068","2023-03-26","10:12:38",""
"2206348","19.6816","0.0015","7.2656","0.0006","12.571","0.0015","90","","117.82","0.01","90","","1589.9","0.3","150","","150","","","","","","","","Synthetic","4","C 1 2/c 1","-C 2yc","15","","Potassium sodium phyllosilicate","","- K1.33 Na0.67 O5 Si2 -","- K1.33333 Na0.666667 O5 Si2 -","- K16 Na8 O60 Si24 -","12","1.5","BR6203","Spek, Anthony L.; Jong, Bernard H. W. S. de","Potassium sodium phyllosilicate, K~1.33~Na~0.67~Si~2~O~5~","Acta Crystallographica Section E","2005","61","8","i188","i190","10.1107/S1600536805022348","","","0.71073","MoKα","","0.0633","0.0427","","","0.1075","0.1179","","","","","","1.091","","","","has coordinates,has Fobs","282068","2023-03-26","10:12:38",""
"2206349","4.4474","0.0008","4.4474","0.0008","10.73","0.004","90","","90","","90","","212.23","0.1","120","2","120","2","","","","","","","Synthetic","2","I 4/m m m","-I 4 2","139","Strontium tetragallide","Strontium tetragallide","","- Ga4 Sr -","- Ga4 Sr -","- Ga8 Sr2 -","2","0.0625","BR6204","Tobash, Paul H.; Yamasaki, Yuki; Bobev, Svilen","Strontium tetragallide","Acta Crystallographica Section E","2005","61","8","i174","i176","10.1107/S1600536805022439","","","0.71073","MoKα","","0.0189","0.017","","","0.0419","0.0424","","","","","","1.026","","","","has coordinates,has Fobs","282548","2023-04-10","20:38:56",""
"2206350","10.9614","0.0012","16.1352","0.0017","22.026","0.002","98.832","0.002","94.633","0.003","103.5","0.002","3715.4","0.7","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","bis{bis[2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18- triene]potassium(I)} bis(2-thioxo-4,5-dihydro-1,3-dithiole-4,5-dithiolato)zinc(II)","","- C62 H80 K2 O20 S10 Zn -","- C62 H80 K2 O20 S10 Zn -","- C124 H160 K4 O40 S20 Zn2 -","2","1","BR6206","Jie Liu; Jun-Hong Zhang; Da-Qi Wang; Jian-Min Dou","Bis{bis[2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene]potassium(I)} bis(2-thioxo-4,5-dihydro-1,3-dithiole-4,5-dithiolato)zinc(II)","Acta Crystallographica Section E","2005","61","8","m1652","m1654","10.1107/S1600536805023536","","","0.71073","MoKα","","0.153","0.0507","","","0.0543","0.0665","","","","","","0.813","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206351","8.1696","0.0006","12.4578","0.0008","14.8541","0.0009","101.277","0.004","90.134","0.005","96.332","0.005","1473.1","0.17","298","2","298","2","","","","","","","","6","P -1","-P 1","2","Ditalimphos","O,O-Diethyl phthalimidophosphonothioate","","- C12 H14 N O4 P S -","- C12 H14 N O4 P S -","- C48 H56 N4 O16 P4 S4 -","4","2","BT6684","Baughman, Russell G.; Paulos, Chrystal M.","<i>O</i>,<i>O</i>-Diethyl phthalimidophosphonothioate (Ditalimphos)","Acta Crystallographica Section E","2005","61","8","o2352","o2353","10.1107/S1600536805019872","","","0.71073","MoKα","","0.0962","0.0635","","","0.1749","0.2003","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206352","14.4439","0.0011","8.6837","0.0006","14.0031","0.001","90","","111.251","0.009","90","","1636.9","0.2","291","0.3","291","0.3","","","","","","","","4","C 1 2/c 1","-C 2yc","15","6-nitro-2,3-xylidine","2,3-dimethyl-6-nitroaniline","","- C8 H10 N2 O2 -","- C8 H10 N2 O2 -","- C64 H80 N16 O16 -","8","1","BT6688","Kruszynski, Rafal","Stacking and N—H···O interactions in 2,3-dimethyl-6-nitroaniline","Acta Crystallographica Section E","2005","61","8","o2379","o2381","10.1107/S1600536805020684","","","0.71073","MoKα","","0.0639","0.054","","","0.153","0.1634","","","","","","1.167","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206353","12.242","0.006","5.177","0.003","22.376","0.011","90","","105.181","0.007","90","","1368.6","1.2","566","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Benzyl 5-bromo-4-methylsalicylate","","- C15 H13 Br O3 -","- C15 H13 Br O3 -","- C60 H52 Br4 O12 -","4","1","BT6689","Ning-Juan Fan; Yi-Bin Wei; Xiao-Hua Pu; Wei Guo","Benzyl 5-bromo-4-methylsalicylate","Acta Crystallographica Section E","2005","61","8","o2393","o2394","10.1107/S1600536805020696","","","0.71073","MoKα","","0.0684","0.0442","","","0.099","0.1062","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206354","9.9316","0.0007","10.2786","0.0005","14.5778","0.001","75.785","0.004","83.778","0.006","85.529","0.006","1432.05","0.16","150","2","150","2","","","","","","","","4","P -1","-P 1","2","(oxydi-2,1-phenylen)bis(phenylphosphine) oxide","2-(Diphenylphosphino)phenyl 2-(diphenylphosphinoyl)phenyl ether","","- C36 H28 O2 P2 -","- C36 H28 O2 P2 -","- C72 H56 O4 P4 -","2","1","BT6691","Tooke, Duncan M.; Wilting, Jos; Vogt, Dieter; Spek, Anthony L.","2-(Diphenylphosphino)phenyl 2-(diphenylphosphinoyl)phenyl ether","Acta Crystallographica Section E","2005","61","8","o2406","o2407","10.1107/S1600536805020805","","","0.71073","MoKα","","0.0562","0.0389","","","0.0899","0.0983","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206355","24.139","0.002","8.3588","0.0006","11.8747","0.0012","90","","110.014","0.008","90","","2251.3","0.4","296","","296","","","","","","","","","6","C 1 c 1","C -2yc","9","","O,O-Bis(2-tert-butyl-4-methylphenyl) chlorothiophosphonate","","- C22 H30 Cl O2 P S -","- C22 H30 Cl O2 P S -","- C88 H120 Cl4 O8 P4 S4 -","4","1","BT6693","Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan; Albayrak, Çiǧdem","<i>O</i>,<i>O</i>-Bis(2-<i>tert</i>-butyl-4-methylphenyl) chlorothiophosphonate","Acta Crystallographica Section E","2005","61","8","o2525","o2527","10.1107/S1600536805021859","","","0.71073","MoKα","","0.0683","0.0354","","","0.0799","0.0904","","","","","","0.86","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206356","23.592","0.003","8.3111","0.0006","12.5067","0.0014","90","","105.74","0.009","90","","2360.3","0.4","150","","150","","","","","","","","","6","C 1 c 1","C -2yc","9","","O,O-Bis(2-tert-butyl-4-methoxyphenyl) chlorothiophosphonate","","- C22 H30 Cl O4 P S -","- C22 H30 Cl O4 P S -","- C88 H120 Cl4 O16 P4 S4 -","4","1","BT6694","Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan; Albayrak, Çiǧdem","<i>O</i>,<i>O</i>-Bis(2-<i>tert</i>-butyl-4-methoxyphenyl) chlorothiophosphonate","Acta Crystallographica Section E","2005","61","8","o2528","o2530","10.1107/S1600536805021860","","","0.71073","MoKα","","0.0303","0.0267","","","0.0716","0.0735","","","","","","1.115","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206357","10.6925","0.0016","14.875","0.002","17.2342","0.0008","90","","94.742","0.007","90","","2731.7","0.6","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","tetra-n-butylammonium (imidazolidine-2-thione-2κS)dioxo-1κ^2^O-di-μ-sulfido-1:2κ^4^S:S- copper(I)tungstate(VI)","","- C19 H42 Cu N3 O2 S3 W -","- C19 H42 Cu N3 O2 S3 W -","- C76 H168 Cu4 N12 O8 S12 W4 -","4","1","BT6695","Beheshti, Azizolla; Clegg, William; Dale, Sophie H.; Solimankhani, Ahmad","N—H···S and N—H···O hydrogen bonding in tetra-<i>n</i>-butylammonium (imidazolidine-2-thione-2κ<i>S</i>)dioxo-1κ^2^<i>O</i>-di-μ-sulfido-1:2κ^4^<i>S</i>:<i>S</i>-copper(I)tungstate(VI)","Acta Crystallographica Section E","2005","61","8","m1509","m1511","10.1107/S1600536805021628","","","0.71073","MoKα","","0.0524","0.0329","","","0.0664","0.0735","","","","","","1.074","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206358","37.007","0.004","7.7558","0.0008","17.214","0.002","90","","105.503","0.002","90","","4761","0.9","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-hydroxy-1-[2-(2-methyl-4-oxo-3,4,6,7,8,9- hexahydro-2H-pyrido[1,2-a]pyrimidin-3-yl)ethyl]piperidine N-oxide","","- C24 H33 F N4 O6 -","- C24 H33 F N4 O6 -","- C192 H264 F8 N32 O48 -","8","1","BT6696","K. Ravikumar; B. Sridhar; S. G. Manjunath; Saji Thomas","Risperidone <i>N</i>-oxide hydrogen peroxide methanol solvate","Acta Crystallographica Section E","2005","61","8","o2515","o2517","10.1107/S1600536805022002","","","0.71073","MoKα","","0.0628","0.054","","","0.1443","0.1564","","","","","","1.076","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206359","12.1813","0.0009","30.862","0.002","7.7875","0.0006","90","","93.4","0.002","90","","2922.5","0.4","130","2","130","2","","","","","","","","5","P 1 21 1","P 2yb","4","brucinium toluene-4-sulfonate trihydrate","2,3-dimethoxy-10-oxostrychnidinium toluene-4-sulfonate trihydrate","","- C30 H40 N2 O10 S -","- C30 H40 N2 O10 S -","- C120 H160 N8 O40 S4 -","4","2","BT6697","Graham Smith; Urs D. Wermuth; Peter C. Healy; David J. Young; Jonathan M. White","Brucinium toluene-4-sulfonate trihydrate at 130 K","Acta Crystallographica Section E","2005","61","8","o2646","o2648","10.1107/S1600536805022695","","","0.71073","MoKα","","0.0765","0.0495","","","0.0804","0.0879","","","","","","0.844","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206360","10.3359","0.0001","13.8339","0.0003","16.2254","0.0004","101.153","0.001","90.934","0.001","108.687","0.001","2148.53","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","10-Benzyl-3,3,6,6,9-pentamethyl-3,4,6,7,9,10-hexahydroacridine- 1,8(2H,5H)-dione","","- C25 H31 N O2 -","- C25 H31 N O2 -","- C100 H124 N4 O8 -","4","2","BT6699","M. Yogavel; D. Velmurugan; P. Murugan; S. Shanmuga Sundara Raj; H.-K. Fun","10-Benzyl-3,3,6,6,9-pentamethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","8","o2761","o2763","10.1107/S1600536805023500","","","0.71073","MoKα","","0.1164","0.065","","","0.1599","0.1968","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206361","9.969","0.002","13.8855","0.0018","10.2272","0.0017","90","","98.704","0.016","90","","1399.4","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","thiocytosinium chloride","","","- C4 H6 Cl N3 S -","- C4 H6 Cl N3 S -","- C32 H48 Cl8 N24 S8 -","8","2","BT6701","Prugovečki, Biserka; Matković-Čalogović, Dubravka; Sanković, Krešimir","2-Thiocytosinium chloride","Acta Crystallographica Section E","2005","61","8","o2706","o2708","10.1107/S1600536805023445","","","0.71073","MoKα","","0.0574","0.037","","","0.099","0.1073","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206362","9.2565","0.001","11.2224","0.0012","12.0629","0.0013","63.164","0.002","87.485","0.002","83.735","0.002","1111.4","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","Olanzapinium nicotinate","1-methyl-4-(2-methyl-10H-thieno[2,3-b][1,5]benzodiazepin-4- yl)hexahydropyrazin-1-ium nicotinate","","- C23 H25 N5 O2 S -","- C23 H25 N5 O2 S -","- C46 H50 N10 O4 S2 -","2","1","BT6703","K. Ravikumar; G. Y. S. K. Swamy; B. Sridhar; S. Roopa","Olazipinium nicotinate","Acta Crystallographica Section E","2005","61","8","o2720","o2723","10.1107/S160053680502369X","","","0.71073","MoKα","","0.0884","0.0629","","","0.13","0.1407","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206363","10.244","0.005","10.601","0.005","11.404","0.005","64.499","0.005","74.587","0.005","89.556","0.005","1069.5","0.9","296","","296","","","","","","","","","3","P -1","-P 1","2","","1-Benzyl-2-[1-(5-methyl-1H-pyrazol-3-yl)-2-phenylethyl]benzimidazole","","- C26 H24 N4 -","- C26 H24 N4 -","- C52 H48 N8 -","2","1","BT6704","Mehmet Akkurt; Şerife Pınar; Rachid Bouhfid; Ahmed Moussaif; El-Mokhtar Essassi; Orhan Büyükgüngör","1-Benzyl-2-[1-(5-methyl-1<i>H</i>-pyrazol-3-yl)-2-phenylethyl]benzimidazole","Acta Crystallographica, Section E","2005","61","8","o2718","o22719","10.1107/S1600536805023706","","","0.71073","MoKα","","0.0739","0.0461","","","0.1189","0.1303","","","","","","1.034","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2206364","10.1025","0.0006","17.3954","0.0011","20.3856","0.0013","102.267","0.005","103.752","0.005","93.744","0.005","3375","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Lithium‒tetrakis(pentafluorophenyl)borate‒benzene (1/1/2)","","- C36 H12 B F20 Li -","- C35.9995 H12 B F20 Li -","- C143.998 H48 B4 F80 Li4 -","4","2","BV6022","Bolte, Michael; Ruderfer, Ilya; Müller, Thomas","Lithium‒tetrakis(pentafluorophenyl)borate‒benzene (1/1/2)","Acta Crystallographica Section E","2005","61","8","m1581","m1582","10.1107/S1600536805022336","","","0.71073","MoKα","","0.1219","0.0939","","","0.2245","0.2458","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206365","6.0018","0.0002","8.0384","0.0003","12.4802","0.0003","90","","95.5132","0.0017","90","","599.32","0.03","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C5 H8 O3 -","- C5 H8 O3 -","- C20 H32 O12 -","4","1","CF6428","Shallard-Brown, Howard A.; Watkin, David J.; Cowley, Andrew R.","Methyl acetoacetate at 150 K","Acta Crystallographica Section E","2005","61","8","o2422","o2423","10.1107/S1600536805017654","","","0.71073","MoKα","","0.0417","0.0363","","0.0954","0.0924","0.0954","","","","","","1.0074","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206366","8.8118","0.0018","12.43","0.003","18.031","0.004","90","","97.749","0.002","90","","1956.9","0.8","293.2","0.2","293.2","0.2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-{[(2-alanine methyl ester)amino](phenyl)methylidene} -3-methyl-1-phenylpyrazol-5-one","","- C21 H21 N3 O3 -","- C21 H21 N3 O3 -","- C84 H84 N12 O12 -","4","2","CF6431","Zhu, Hualing; Zhang, Xin; Song, Yujing; Xu, Haizhen; Dong, Mei","4-{[1-(Methoxycarbonyl)ethylamino](phenyl)methylidene}-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2387","o2388","10.1107/S1600536805020349","","","0.71073","MoKα","","0.091","0.042","","","0.0933","0.1098","","","","","","1.057","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206367","17.572","0.003","9.588","0.005","30.126","0.003","90","","96.6","0.02","90","","5042","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetrasodium bis[tris(salicylato)titanate(IV)] undecahydrate, Na~4~[Ti(C~7~O~3~H~4~)~3~]~2~.11H~2~O","","- C21 H23 Na2 O14.5 Ti -","- C21 H12 Na2 O14.5 Ti -","- C168 H96 Na16 O116 Ti8 -","8","2","CF6434","Raja Dey; Kakoli Mukharjee; Vratislav Langer; Priyobroto Roychowdhury","A titanium salicylate, Na~4~[Ti(C~7~H~4~O~3~)~3~]~2~·11H~2~O","Acta Crystallographica Section E","2005","61","8","m1495","m1497","10.1107/S1600536805021276","","","0.71073","MoKα","","0.1468","0.0627","","","0.1509","0.17","","","","","","0.934","","","","has coordinates,has Fobs","283803","2023-05-16","08:05:53",""
"2206368","9.263","0.002","10.308","0.003","10.974","0.003","90","","112.872","0.003","90","","965.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-benzoyl alanine","","- C10 H11 N O3 -","- C10 H11 N O3 -","- C40 H44 N4 O12 -","4","1","CF6435","Ai-Yun Fu; Da-Qi Wang","<i>N</i>-Benzoylalanine","Acta Crystallographica Section E","2005","61","8","o2336","o2337","10.1107/S1600536805020283","","","0.71073","MoKα","","0.0579","0.0486","","","0.1359","0.1443","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206369","13.624","0.002","10.188","0.001","24.248","0.003","90","","98.53","0.01","90","","3328.4","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","4'-Hydroxy-4-methylstilbazolium tetraphenylborate dimethyl sulfoxide solvate","4'-Hydroxy-4-methylstilbazolium tetraphenylborate dimethyl sulfoxide solvate","","- C40 H40 B N O2 S -","- C40 H40 B N O2 S -","- C160 H160 B4 N4 O8 S4 -","4","1","CF6436","Wen Yang; Shu-Jin Li; De-Chun Zhang","4'-Hydroxy-4-methylstilbazolium tetraphenylborate dimethyl sulfoxide solvate","Acta Crystallographica Section E","2005","61","8","o2461","o2463","10.1107/S1600536805021446","","","0.71073","MoKα","","0.0856","0.0463","","","0.1092","0.121","","","","","","0.935","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206370","19.456","0.003","8.2838","0.0009","31.886","0.004","90","","101.212","0.004","90","","5041","1.1","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(R)-2,2'-Bis(diphenylphosphino)-6,6'-bis(tridecafluoro-n-hexyl)-1,1'-binaphthyl","","- C56 H30 F26 P2 -","- C56 H30 F26 P2 -","- C224 H120 F104 P8 -","4","0.5","CF6438","John Fawcett; Eric G. Hope; Alison M. Stuart; Andrew J. West","(<i>R</i>)-2,2'-Bis(diphenylphosphino)-6,6'-bis(tridecafluoro-<i>n</i>-hexyl)-1,1'-binaphthyl","Acta Crystallographica Section E","2005","61","8","o2484","o2485","10.1107/S1600536805021264","","","0.71073","MoKα","","0.0679","0.0582","","","0.1658","0.1736","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206371","11.656","0.003","7.326","0.002","14.012","0.002","90","","109.09","0.01","90","","1130.7","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(ethanol)(μ~3~-N-salicyclideneglycinato)nickel(II)","","- C11 H13 N Ni O4 -","- C11 H13 N Ni O4 -","- C44 H52 N4 Ni4 O16 -","4","1","CF6439","Yu-Zhou Yuan; Jian Zhou; Dong-Qing Li; Xing Liu; Zhen-Feng Chen; Kai-Bei Yu","The two-dimensional network polymer of (ethanol)(μ~3~-<i>N</i>-salicyclideneglycinato)nickel(II)","Acta Crystallographica Section E","2005","61","8","m1444","m1446","10.1107/S1600536805020593","","","0.71073","MoKα","","0.046","0.0342","","","0.0862","0.0898","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206372","5.9422","0.0002","28.3304","0.001","7.9071","0.0003","90","","90","","90","","1331.12","0.08","120","","120","","","","","","","","","5","P n a 21","P 2c -2n","33","p-bromophenyl p-toluenesulfonate","4-bromophenyl 4-toluenesulfonate","","- C13 H11 Br O3 S -","- C13 H11 Br O3 S -","- C52 H44 Br4 O12 S4 -","4","1","CF6440","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Frank R. Fronczek","4-Bromophenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions","Acta Crystallographica Section E","2005","61","8","o2736","o2738","10.1107/S1600536805023810","","","0.71073","MoKα","","0.0366","0.0348","","","0.0926","0.0944","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206373","7.6018","0.0005","7.7685","0.0005","11.6547","0.0007","77.106","0.003","81.047","0.003","64.506","0.003","604.19","0.07","293","2","293","2","","","","","","","","2","P -1","-P 1","2","2,3,3',4'-Tetramethylbiphenyl","2,3,3',4'-Tetramethylbiphenyl","","- C16 H18 -","- C16 H18 -","- C32 H36 -","2","1","CF6441","Andrew J. Robertson; Daniel J. Price","2,3,3',4'-Tetramethylbiphenyl","Acta Crystallographica Section E","2005","61","8","o2610","o2612","10.1107/S1600536805022476","","","0.71073","MoKα","","0.0861","0.0489","","","0.1113","0.1266","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206374","16.043","0.003","10.536","0.002","15.647","0.003","90","","104.31","0.03","90","","2562.7","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichlorobis[2-(o-tolyliminomethyl)phenolato]copper(II)","","- C28 H26 Cl2 Cu N2 O2 -","- C28 H26 Cl2 Cu N2 O2 -","- C112 H104 Cl8 Cu4 N8 O8 -","4","0.5","CF6444","Yang, Yu-Min","Dichlorobis[2-(<i>o</i>-tolyliminomethyl)phenolato]copper(II)","Acta Crystallographica Section E","2005","61","8","m1616","m1617","10.1107/S1600536805023305","","","0.71073","MoKα","","0.1305","0.0568","","","0.1114","0.1381","","","","","","0.952","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206375","10.323","0.002","10.63","0.002","11.018","0.002","90","","111.71","0.03","90","","1123.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(meso-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane)zinc(II) diperchlorate","","- C16 H32 Cl2 N4 O8 Zn -","- C16 H32 Cl2 N4 O8 Zn -","- C32 H64 Cl4 N8 O16 Zn2 -","2","0.5","CF6445","Yang, Yu-Min","(<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane)zinc(II) diperchlorate","Acta Crystallographica Section E","2005","61","8","m1618","m1619","10.1107/S1600536805023317","","","0.71073","MoKα","","0.0478","0.0441","","","0.1063","0.1086","","","","","","1.144","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206376","17.2952","0.0002","10.7468","0.0002","20.4914","0.0004","90","","100.786","0.0005","90","","3741.4","0.11","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","Isopropyl 2,5-anhydro-3,4-di-O-tert-butyldiphenylsilyl-L-ribonate","","- C40 H50 O5 Si2 -","- C40 H50 O5 Si2 -","- C160 H200 O20 Si8 -","4","2","CF6446","Andreas F. G. Glawar; David J. Watkin; Gangadhar J. Sanjayan; George E. Tranter; Alison A. Edwards; George W. J. Fleet","Isopropyl 2,5-anhydro-3,4-di-<i>O</i>-<i>tert</i>-butyldiphenylsilyl-<small>L</small>-ribonate","Acta Crystallographica Section E","2005","61","8","o2724","o2726","10.1107/S1600536805023822","","","0.71073","MoKα","","0.05","0.05","","0.096","0.096","0.096","","","","","","0.9663","","","","has coordinates,has disorder,has Fobs","201973","2020-10-21","18:00:00",""
"2206377","10.4312","0.0003","5.4469","0.0001","13.0536","0.0005","90","","93.4825","0.001","90","","740.31","0.04","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","(2R,3S,4S,5R)-Methyl 5-cyano-2,3:4,5-di-O-isopropylidene-2,3,4,5- tetrahydroxypentanoate","","- C13 H19 N O6 -","- C13 H19 N O6 -","- C26 H38 N2 O12 -","2","1","CF6447","Andreas Glawar; Benjamin A. Mayes; David Watkin; George W. J. Fleet","(2<i>R</i>,3<i>S</i>,4<i>S</i>,5<i>R</i>)-Methyl 5-cyano-2,3:4,5-di-<i>O</i>-isopropylidene-2,3,4,5-tetrahydroxypentanoate","Acta Crystallographica Section E","2005","61","8","o2727","o2729","10.1107/S1600536805023834","","","0.71073","MoKα","","0.0318","0.0318","","0.0693","0.0693","0.0693","","","","","","0.9885","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206378","7.691","0.002","14.882","0.004","16.948","0.005","77.2","0.014","77.262","0.014","80.658","0.014","1831.9","0.9","123.1","","","","","","","","","","","4","P -1","-P 1","2","","2-Amino-5-[4-(octylamino)phenyl]cyclohepta-2,4,6-trien-1-one","","- C21 H28 N2 O -","- C21 H28 N2 O -","- C84 H112 N8 O4 -","4","2","CF6449","Kubo, Kanji; Matsumoto, Taisuke; Katahira, Kouki; Mori, Akira","2-Amino-5-[4-(octylamino)phenyl]cyclohepta-2,4,6-trien-1-one","Acta Crystallographica Section E","2005","61","8","o2750","o2752","10.1107/S1600536805023792","","","0.7107","MoKα","","","0.0712","","","","0.2016","","","","","","1","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206379","13.4594","0.001","9.8855","0.0005","14.0878","0.0011","90","","91.08","0.006","90","","1874.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-[3-Methyl-3-(2,4,6-trimethylphenyl)cyclobutyl]-2-(thiomorpholin-4-yl)ethanone","","- C20 H29 N O S -","- C20 H29 N O S -","- C80 H116 N4 O4 S4 -","4","1","CI6593","Hanife Saraçoĝlu; Serkan Soylu; Nezihe Çalıs̨kan; Alaaddin Çukurovali; Ibrahim Yilmaz; Cavit Kazaz","1-[3-Methyl-3-(2,4,6-trimethylphenyl)cyclobutyl]-2-(thiomorpholin-4-yl)ethanone","Acta Crystallographica Section E","2005","61","8","o2401","o2402","10.1107/S1600536805020994","","","0.71073","MoKα","","0.0755","0.0489","","","0.1345","0.1463","","","","","","1.173","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206380","12.3572","0.0017","12.6676","0.0011","15.874","0.003","90","","90","","90","","2484.9","0.6","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(9R,13R,14R)-7-(E)-Benzylidene-14-hydroxy-3,4-dimethoxy-17-methylmorphinan-6-one","","- C29 H33 N O4 -","- C29 H33 N O4 -","- C116 H132 N4 O16 -","4","1","CI6602","Parrish, Damon A.; Thatcher, Linn N.; Wu, Hui-Fang; Coop, Andrew; Deschamps, Jeffrey R.","(9<i>R</i>,13<i>R</i>,14<i>R</i>)-7-(<i>E</i>)-Benzylidene-14-hydroxy-3,4-dimethoxy-17-methylmorphinan-6-one","Acta Crystallographica Section E","2005","61","8","o2617","o2618","10.1107/S1600536805019987","","","1.54178","CuKα","","0.0654","0.0533","","","0.1373","0.1475","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206381","8.6283","0.0003","10.6995","0.0004","11.0065","0.0004","100.161","0.001","94.482","0.001","103.168","0.001","966.42","0.06","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1,4,8,11-Tetrakis(carboxymethyl)-5,5,7,12,12,14-hexamethyl-1,4,8,11- tetraazoniacyclotetradecane tetrachloride octahydrate","","- C24 H64 Cl4 N4 O16 -","- C24 H64 Cl4 N4 O16 -","- C24 H64 Cl4 N4 O16 -","1","0.5","CI6606","Wang, Shi-Fan; Li, Huan-Qiu; Ruan, Ban-Feng; Zhu, Hai-Liang; Ng, Seik Weng","1,4,8,11-Tetrakis(carboxymethyl)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazoniacyclotetradecane tetrachloride octahydrate","Acta Crystallographica Section E","2005","61","8","o2413","o2414","10.1107/S1600536805020817","","","0.71073","MoKα","","0.045","0.044","","","0.12","0.121","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206382","9.1863","0.0006","13.8653","0.0009","19.987","0.001","90","","93.604","0.001","90","","2540.7","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-1,8- diacetato)nickel(II) tetrahydrate","","- C20 H46 N4 Ni O8 -","- C20 H46 N4 Ni O8 -","- C80 H184 N16 Ni4 O32 -","4","1","CI6607","Wang, Shi-Fan; Xue, Jia-Yu; Shi, Lei; Zhu, Hai-Liang; Ng, Seik Weng","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-1,8-diacetato)nickel(II) tetrahydrate","Acta Crystallographica Section E","2005","61","8","m1481","m1483","10.1107/S1600536805021033","","","0.71073","MoKα","","0.062","0.055","","","0.135","0.139","","","","","","1.15","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206383","5.6856","0.0008","10.9674","0.001","20.704","0.003","90","","92.306","0.012","90","","1290","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 4-chloro-3-oxo-2-(phenylhydrazono)butyrate","","- C12 H13 Cl N2 O3 -","- C12 H13 Cl N2 O3 -","- C48 H52 Cl4 N8 O12 -","4","1","CI6608","Alpaslan, Gökhan; Özdamar, Özgür; Odabas̨oǧlu, Mustafa; Ersanlı, Cem Cüneyt; Büyükgüngör, Orhan; Erdönmez, Ahmet","Ethyl 4-chloro-3-oxo-2-(phenylhydrazono)butyrate","Acta Crystallographica Section E","2005","61","8","o2428","o2430","10.1107/S1600536805021240","","","0.71073","MoKα","","0.07","0.035","","","0.083","0.092","","","","","","0.82","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2206384","12.34","0.002","8.7775","0.0014","17.678","0.003","90","","104.861","0.003","90","","1850.7","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(2-chlorophenyl)-N-(2-cyano-4-methyl-2-pentanyl)-5-methylisoxazole- 4-carboxamide","","- C18 H20 Cl N3 O2 -","- C18 H20 Cl N3 O2 -","- C72 H80 Cl4 N12 O8 -","4","1","CI6609","Bin Zhong; Zheng-Ming Li; Hai-Bin Song","3-(2-Chlorophenyl)-<i>N</i>-(2-cyano-4-methyl-2-pentyl)-5-methylisoxazole-4-carboxamide","Acta Crystallographica Section E","2005","61","8","o2621","o2622","10.1107/S1600536805022373","","","0.71073","MoKα","","0.0987","0.0451","","","0.1149","0.1496","","","","","","0.935","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206385","6.5207","0.0017","9.2488","0.0016","13.429","0.004","102.108","0.008","94.112","0.007","101.504","0.008","770.5","0.3","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","1-[4-(4-Methylpyrimidin-2-yl)piperazin-1-ylmethyl]-1H-benzotriazole","","- C16 H19 N7 -","- C16 H19 N7 -","- C32 H38 N14 -","2","1","CI6611","Feng-Qi He; Bao-Lei Wang; Zheng-Ming Li; Hai-Bin Song","1-[4-(4-Methylpyrimidin-2-yl)piperazin-1-ylmethyl]-1<i>H</i>-benzotriazole","Acta Crystallographica Section E","2005","61","8","o2602","o2604","10.1107/S1600536805022208","","","0.71073","MoKα","","0.0774","0.0481","","","0.1169","0.1353","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206386","10.617","0.001","11.399","0.001","13.691","0.001","90","","94.133","0.001","90","","1652.6","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Methanol[4-nitro-2-(pyridin-2-ylmethyliminomethyl)phenolato](thiocyanato) zinc(II)","","- C15 H14 N4 O4 S Zn -","- C15 H14 N4 O4 S Zn -","- C60 H56 N16 O16 S4 Zn4 -","4","1","CI6613","You, Zhong-Lu","Methanol[4-nitro-2-(pyridin-2-ylmethyliminomethyl)phenolato](thiocyanato)zinc(II)","Acta Crystallographica Section E","2005","61","8","m1571","m1573","10.1107/S160053680502218X","","","0.71073","MoKα","","0.0446","0.0371","","","0.1034","0.1083","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206387","10.371","0.003","16.447","0.004","11.07","0.003","90","","90","","90","","1888.2","0.9","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","[N,N'-Bis(3-methylsalicylidene)propane-1,3-diaminato]nickel(II) methanol solvate","","- C20 H24 N2 Ni O3 -","- C20 H24 N2 Ni O3 -","- C80 H96 N8 Ni4 O12 -","4","0.5","CI6614","You, Zhong-Lu","[<i>N</i>,<i>N</i>'-Bis(3-methylsalicylidene)propane-1,3-diaminato]nickel(II) methanol solvate","Acta Crystallographica Section E","2005","61","8","m1601","m1603","10.1107/S1600536805022956","","","0.71073","MoKα","","0.0721","0.0546","","","0.1499","0.1624","","","","","","1.062","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206388","12.5083","0.0015","6.9995","0.0005","17.885","0.002","90","","96.988","0.01","90","","1554.2","0.3","296","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Chloro-2-nitrophenyl)-N-methyl-N'-(quinolin-4-ylmethylene)hydrazine","","- C17 H13 Cl N4 O2 -","- C17 H13 Cl N4 O2 -","- C68 H52 Cl4 N16 O8 -","4","1","CI6616","Karadayı, Nevzat; Aydemir, Ercan; Kazak, Canan; Kirpi, Erdoğan; Tuğcu, F. Tülay; Gümüs̨, M. Kemal; Kaban, S̨eniz","<i>N</i>-(4-Chloro-2-nitrophenyl)-<i>N</i>-methyl-<i>N</i>'-(quinolin-4-ylmethylene)hydrazine","Acta Crystallographica Section E","2005","61","8","o2671","o2673","10.1107/S1600536805023020","","","0.71073","MoKα","","0.1332","0.0441","","","0.059","0.067","","","","","","0.937","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206389","7.529","0.002","10.399","0.002","21.555","0.003","90","","90","","90","","1687.6","0.6","298","2","298","2","","","","","","","","5","A 21 a m","A -2 2a","36","[N,N'-Bis(3-methylsalicylidene)-1,3-propanediaminato]nickel(II)","{6,6'-Dimethyl-2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]diphenolato}nickel(II)","","- C19 H20 N2 Ni O2 -","- C19 H20 N2 Ni O2 -","- C76 H80 N8 Ni4 O8 -","4","0.5","CI6619","You, Zhong-Lu","[<i>N</i>,<i>N</i>'-Bis(3-methylsalicylidene)-1,3-propanediaminato]nickel(II)","Acta Crystallographica Section E","2005","61","8","m1637","m1638","10.1107/S1600536805023470","","","0.71073","MoKα","","0.0384","0.035","","","0.085","0.0874","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206390","10.045","0.002","10.247","0.002","11.261","0.002","111.134","0.002","112.428","0.003","99.831","0.003","933.3","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","9-(4-Bromophenyl)-3,3,7-trimethyl-3,4-dihydroacridin-1(2H)-one","","- C22 H20 Br N O -","- C22 H20 Br N O -","- C44 H40 Br2 N2 O2 -","2","1","CV6527","Shujiang Tu; Bo Jiang; Xiang Zou; Tuanjie Li","9-(4-Bromophenyl)-3,3,7-trimethyl-3,4-dihydroacridin-1(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2570","o2572","10.1107/S1600536805022270","","","0.71073","MoKα","","0.0466","0.0323","","","0.0788","0.0856","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206391","6.8616","0.0006","5.8084","0.0006","25.6901","0.0018","90","","90.733","0.008","90","","1023.79","0.16","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-Histidinium Sulfate","L-Histidinium sulfate","","- C6 H11 N3 O6 S -","- C6 H11 N3 O6 S -","- C24 H44 N12 O24 S4 -","4","2","CV6532","R. Praveen Kumar; S. Athimoolam; S. Asath Bahadur; R. K. Rajaram","<small>L</small>-Histidinium sulfate","Acta Crystallographica Section E","2005","61","8","o2419","o2421","10.1107/S1600536805021021","","","0.71073","MoKα","","0.0632","0.0467","","","0.1302","0.1891","","","","","","1.151","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206392","17.7114","0.0013","7.8569","0.0006","14.3048","0.001","90","","110.589","0.001","90","","1863.5","0.2","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(p-Bromophenyl)-5-tosylperhydropyrrolo[3,4-b]pyrrole","","- C19 H21 Br N2 O2 S -","- C19 H21 Br N2 O2 S -","- C76 H84 Br4 N8 O8 S4 -","4","1","CV6533","S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Poornachandran; R. Raghunathan","1-(<i>p</i>-Bromophenyl)-5-<i>p</i>-tosylperhydropyrrolo[3,4-<i>b</i>]pyrrole","Acta Crystallographica Section E","2005","61","8","o2493","o2495","10.1107/S1600536805021665","","","0.71073","MoKα","","0.0557","0.0391","","","0.1074","0.1183","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206393","11.777","0.001","13.507","0.003","15.141","0.005","90","","95.81","0.02","90","","2396.1","1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Di-μ-chloro-bis[bis(cumylcyclopentadienyl)yttrium(III)]","","- C56 H60 Cl2 Y2 -","- C56 H60 Cl2 Y2 -","- C112 H120 Cl4 Y4 -","2","0.5","CV6537","Antonella Caterina Boccia; Fabia Grisi; Roberto Centore; Angela Tuzi","Di-μ-chloro-bis[bis(cumylcyclopentadienyl)yttrium(III)]","Acta Crystallographica Section E","2005","61","8","m1449","m1451","10.1107/S1600536805020556","","","0.71069","MoKα","","0.1178","0.0511","","","0.0787","0.0913","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206394","10.943","0.004","13.777","0.005","7.514","0.003","90","","90","","90","","1132.8","0.7","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1-(4-Methylphenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C12 H13 N3 O -","- C12 H13 N3 O -","- C48 H52 N12 O4 -","4","1","CV6538","Jun Wan; Chun-Li Li; Xue-Mei Li; Shi-Ying Wang; Shu-Sheng Zhang","1-(4-Methylphenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","8","o2391","o2392","10.1107/S1600536805020568","","","0.71073","MoKα","","0.0581","0.0368","","","0.1041","0.1075","","","","","","1.139","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206395","6.478","0.0001","16.309","0.0002","26.245","0.0005","90","","90","","90","","2772.78","0.08","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3S,5S,10S,13S,14S,17S)-Methyl l3β-acetyl-25,26,27-trisnorlanost-8-en-24-oate","","- C30 H48 O4 -","- C30 H48 O4 -","- C120 H192 O16 -","4","1","CV6539","Mazoir, N.; Giorgi, M.; Auhmani, A.","(3<i>S</i>,5<i>S</i>,10<i>S</i>,13<i>S</i>,14<i>S</i>,17<i>S</i>)-Methyl 3β-acetyl-25,26,27-trisnorlanost-8-en-24-oate","Acta Crystallographica Section E","2005","61","8","o2382","o2383","10.1107/S1600536805020726","","","0.71073","MoKα","","0.0888","0.0641","","","0.1522","0.1729","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206396","7.8486","0.0013","6.8254","0.0012","28.771","0.005","90","","90","","90","","1541.3","0.5","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N,N'-dibenzoylpiperazine","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C72 H72 N8 O8 -","4","0.5","CV6540","Zheng, Peng-Wu; Wang, Wei; Duan, Xue-Min","<i>N</i>,<i>N</i>'-Dibenzoylpiperazine","Acta Crystallographica Section E","2005","61","8","o2513","o2514","10.1107/S160053680502088X","","","0.71073","MoKα","","0.0576","0.0382","","","0.0941","0.1062","","","","","","1.02","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206397","15.043","0.002","4.9119","0.0007","17.1097","0.0017","90","","123.848","0.008","90","","1050","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Acetonyl morpholine-4-carbodithioate","","- C8 H13 N O2 S2 -","- C8 H13 N O2 S2 -","- C32 H52 N4 O8 S8 -","4","1","CV6541","Jun Wan; Chun-Li Li; Xue-Mei Li; Shu-Sheng Zhang","Acetonyl morpholine-4-carbodithioate","Acta Crystallographica Section E","2005","61","8","o2426","o2427","10.1107/S1600536805020891","","","0.71073","MoKα","","0.0378","0.0335","","","0.0951","0.0992","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206398","5.0999","0.0008","4.6273","0.0008","15.0106","0.0019","90","","107.093","0.005","90","","338.58","0.09","298","2","298","2","","","","","","","","4","P 1 c 1","P -2yc","7","","1-(Carboxymethyl)uracil","","- C6 H6 N2 O4 -","- C6 H6 N2 O4 -","- C12 H12 N4 O8 -","2","1","CV6542","Jing Xiong; Miao-Chang Liu; Ji-Xin Yuan","1-(Carboxymethyl)uracil","Acta Crystallographica Section E","2005","61","8","o2665","o2667","10.1107/S1600536805022774","","","0.71073","MoKα","","0.0675","0.0659","","","0.1472","0.1481","","","","","","1.265","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206399","10.9594","0.0012","8.7222","0.0009","11.5783","0.0012","90","","113.136","0.002","90","","1017.76","0.19","292","2","292","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Di-μ-oxo-bis[(histidinato-κ^3^N,N,O)oxomolybdenum(V)] trihydrate","","- C12 H22 Mo2 N6 O11 -","- C12 H22 Mo2 N6 O11 -","- C24 H44 Mo4 N12 O22 -","2","1","CV6543","Ping-Fan Wu; Dong-Sheng Li; Xiang-Gao Meng; Xiao-Lin Zhong; Jiang Chao; Yu-Lin Zhu; Yong-Ge Wei","Di-μ-oxo-bis[(histidinato-κ^3^<i>N</i>,<i>N</i>,<i>O</i>)oxomolybdenum(V)] trihydrate","Acta Crystallographica Section E","2005","61","8","m1553","m1555","10.1107/S1600536805021732","","","0.71073","MoKα","","0.02","0.0198","","","0.0485","0.0486","","","","","","1.126","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206400","9.2334","0.0009","9.3684","0.001","11.3028","0.0012","99.895","0.008","90.607","0.008","95.637","0.008","958.14","0.17","100","","100","","","","","","","","","5","P -1","-P 1","2","","1-Benzyl-3-(2-phenethyl)benzimidazolium bromide monohydrate","","- C22 H22 Br N2 O -","- C22 H22 Br N2 O -","- C44 H44 Br2 N4 O2 -","2","1","CV6545","Mehmet Akkurt; Selvi Karaca; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","1-Benzyl-3-(2-phenethyl)benzimidazolium bromide monohydrate","Acta Crystallographica Section E","2005","61","8","o2452","o2454","10.1107/S1600536805021653","","","0.71073","MoKα","","0.0394","0.0371","","","0.0981","0.1","","","","","","1.09","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206401","5.133","0.003","5.866","0.003","12.202","0.006","90","","99.779","0.007","90","","362.1","0.3","150","2","150","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Mercury(I) acetate","Mercury(I) acetate","","- C2 H3 Hg O2 -","- C2 H3 Hg O2 -","- C8 H12 Hg4 O8 -","4","0.5","CV6547","Prior, Timothy J.","A synchrotron study of mercury(I) acetate","Acta Crystallographica Section E","2005","61","8","m1523","m1524","10.1107/S160053680502163X","","","0.8464","synchrotron","","0.0431","0.0428","","","0.1084","0.1086","","","","","","1.101","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206402","11.0623","0.001","10.4086","0.0009","20.2368","0.0015","90","","110.737","0.004","90","","2179.2","0.3","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(4-Fluorophenyl)-2-(4-methylphenoxy)-5,8,9- trimethylthieno[3',2':5,6]pyrido[4,3-d]pyrimidin-4(3H)-one","","- C25 H20 F N3 O2 S -","- C25 H20 F N3 O2 S -","- C100 H80 F4 N12 O8 S4 -","4","1","CV6548","Zeping Cui; Mingtian Li; Jianchao Liu; Hongwu He","3-(4-Fluorophenyl)-2-(4-methylphenoxy)-5,8,9-trimethylthieno[3',2':5,6]pyrido[4,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2663","o2664","10.1107/S1600536805022968","","","0.71073","MoKα","","0.0883","0.0502","","","0.1028","0.1166","","","","","","0.89","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206403","36.589","0.005","5.3932","0.0007","7.9572","0.0011","90","","96.689","0.002","90","","1559.5","0.4","292","2","292","2","","","","","","","","4","C 1 c 1","C -2yc","9","","N-[4-(Phenylethynyl)phenyl]benzamide","","- C21 H15 N O -","- C21 H15 N O -","- C84 H60 N4 O4 -","4","1","CV6549","Yin, Guodong; Hu, Shengli; Li, Yitao; Wu, Anxin","<i>N</i>-[4-(Phenylethynyl)phenyl]benzamide","Acta Crystallographica Section E","2005","61","8","o2561","o2562","10.1107/S1600536805022105","","","0.71073","MoKα","","0.0604","0.0451","","","0.1086","0.1331","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206404","7.22","0.0014","10.14","0.002","12.08","0.002","93.79","0.03","103.21","0.03","104.21","0.03","827.6","0.3","298","2","293","2","","","","","","","","7","P -1","-P 1","2","","polymeric hexaaquacobalt(II) diaquadioxodi-μ~2~-pyrazine- bis[μ~3~-N-(phosphonomethyl)iminodiacetato]cobaltdivanadium dihydrate","","- C14 H36 Co2 N4 O26 P2 V2 -","- C14 H36 Co2 N4 O26 P2 V2 -","- C14 H36 Co2 N4 O26 P2 V2 -","1","0.5","CV6554","Almeida Paz, Filipe A.; Shi, Fa-Nian; Mafra, Luis; Makal, Anna; Wozniak, Krysztof; Trindade, Tito; Klinowski, Jacek; Rocha, João","[Co(H~2~O)~6~]{[Co(C~4~H~4~N~2~)(H~2~O)~2~][V~2~O~2~(pmida)~2~]}·2H~2~O [H~4~pmida is <i>N</i>-(phosphonomethyl)iminodiacetic acid]: the first two-dimensional hybrid framework containing [V~2~O~2~(pmida)~2~]^4{-^} building blocks","Acta Crystallographica Section E","2005","61","8","m1628","m1632","10.1107/S1600536805023263","","","0.71073","MoKα","","0.0285","0.0248","","","0.0656","0.0676","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206405","11.452","0.003","8.859","0.002","19.352","0.008","90","","90","","90","","1963.3","1.1","296","1","296","1","","","","","","","","4","P n a 21","P 2c -2n","33","","N-(2-Cyanopropan-2-yl)-isobutyramide","","- C8 H14 N2 O -","- C8 H14 N2 O -","- C64 H112 N16 O8 -","8","2","CV6555","Rodríguez, Verónica; Barba, Victor; Bernès, Sylvain; Quintero, Leticia; Sartillo-Piscil, Fernando","<i>N</i>-(2-Cyanopropan-2-yl)isobutyramide","Acta Crystallographica Section E","2005","61","8","o2733","o2735","10.1107/S1600536805023330","","","0.71073","MoKα","","0.0881","0.0519","","","0.1303","0.1515","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206406","18.893","0.004","11.214","0.003","6.573","0.001","90","","90","","90","","1392.6","0.5","298","2","298","2","","","","","","","","4","C m c m","-C 2c 2","63","","tricesium diiron(III) tris(arsenate)","","- As3 Cs3 Fe2 O12 -","- As3 Cs3 Fe2 O12 -","- As12 Cs12 Fe8 O48 -","4","0.25","DN6220","Ouerfelli, Najoua; Zid, Mohamed Faouzi; Jouini, Tahar","Un nouveau diarséniate Cs~3~Fe~2~(AsO~4~)~3~ à environnement exclusivement pentagonal du fer","Acta Crystallographica Section E","2005","61","8","i165","i167","10.1107/S1600536805021616","","","0.71073","MoKα","","0.0316","0.0244","","","0.0675","0.07","","","","","","1.246","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206407","12.524","0.003","13.027","0.002","13.008","0.004","90","","90.47","0.02","90","","2122.2","0.9","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","sodium lithium decavanadate eicosahydrate","","- H40 Li0.78 Na5.22 O48 V10 -","- H40 Li0.78 Na5.22 O48 V10 -","- H80 Li1.56 Na10.44 O96 V20 -","2","0.5","DN6227","Ksiksi, Regaya; Graia, Mohsen; Jouini, Tahar","Sel mixte de lithium et de sodium eicosahydrate, Na~5.22~Li~0.78~[V~10~O~28~]·20H~2~O","Acta Crystallographica Section E","2005","61","8","i177","i179","10.1107/S160053680502060X","","","0.71073","MoKα","","0.0385","0.0286","","","0.0671","0.0709","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206408","16.872","0.008","11.144","0.003","11.266","0.005","90","","128.55","0.03","90","","1656.6","1.4","293","","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2-amino-5-chloropyridinium) dihydrogenodiphosphate","","- C10 H14 Cl2 N4 O7 P2 -","- C10 H14 Cl2 N4 O7 P2 -","- C40 H56 Cl8 N16 O28 P8 -","4","0.5","DN6233","Akriche, Samah; Rzaigui, Mohamed","Bis(2-amino-5-chloropyridinium) dihydrogendiphosphate","Acta Crystallographica Section E","2005","61","8","o2607","o2609","10.1107/S1600536805022403","","","0.5608","AgKα","","0.0446","0.0377","","","0.1076","0.1122","","","","","","1.131","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206409","9.4153","0.0012","9.8326","0.0014","11.2069","0.0019","90","","96.391","0.012","90","","1031.1","0.3","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2-Bromoethyl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside","","- C16 H23 Br O10 -","- C16 H23 Br O10 -","- C32 H46 Br2 O20 -","2","1","DN6234","Ivan Halasz; Renata Odžak; Srđanka Tomić; Dubravka Matković-Čalogović","2-Bromoethyl 2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2005","61","8","o2644","o2645","10.1107/S1600536805022555","","","0.71073","MoKα","","0.0624","0.0465","","","0.1191","0.1422","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206410","6.041","0.002","10.875","0.004","12.819","0.005","73.78","0.02","81.29","0.03","82.77","0.03","796.2","0.5","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","4-[(2-Chloro-4-nitrophenyl)diazenyl]phenol dimethylformamide solvate","","- C15 H15 Cl N4 O4 -","- C15 H15 Cl N4 O4 -","- C30 H30 Cl2 N8 O8 -","2","1","DN6235","Xiu-Li You; Yan Zhang; Yong Zhang; De-Chun Zhang","4-[(2-Chloro-4-nitrophenyl)diazenyl]phenol dimethylformamide solvate","Acta Crystallographica Section E","2005","61","8","o2656","o2658","10.1107/S1600536805023093","","","0.7107","MoKα","","0.0844","0.0733","","","0.1631","0.1698","","","","","","1.164","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206411","21.349","0.006","5.2657","0.0014","21.303","0.006","90","","97.6","0.004","90","","2373.8","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-(1H-Imidazol-1-yl)-1-(4-methoxyphenyl)propan-1-one","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C104 H112 N16 O16 -","8","1","DN6236","Jun Wan; Zheng-Zhong Peng; Xue-Mei Li; Ping-Kai Ouyang; Shu-Sheng Zhang","3-(1<i>H</i>-Imidazol-1-yl)-1-(4-methoxyphenyl)propan-1-one","Acta Crystallographica Section E","2005","61","8","o2585","o2586","10.1107/S1600536805022385","","","0.71073","MoKα","","0.0571","0.0449","","","0.1134","0.1238","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206412","6.6684","0.0002","9.8585","0.0003","12.9149","0.0004","87.046","0.002","78.017","0.002","70.872","0.002","784.55","0.04","123","2","123","2","","","","","","","","6","P -1","-P 1","2","Hydrochlorothiazide‒1,4-dioxane (1/1)","6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide‒1,4-dioxane (1/1)","","- C11 H16 Cl N3 O6 S2 -","- C11 H16 Cl N3 O6 S2 -","- C22 H32 Cl2 N6 O12 S4 -","2","1","DN6237","Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","Hydrochlorothiazide‒1,4-dioxane (1/1)","Acta Crystallographica Section E","2005","61","8","o2573","o2575","10.1107/S1600536805022464","","","0.71073","MoKα","","0.0432","0.0311","","","0.0728","0.0782","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206413","10.4902","0.0009","8.1611","0.0007","13.8691","0.0012","90","","107.252","0.001","90","","1133.94","0.17","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Chlorophenyl)-3-(1H-imidazol-1-yl)propan-1-one","","- C12 H11 Cl N2 O -","- C12 H11 Cl N2 O -","- C48 H44 Cl4 N8 O4 -","4","1","DN6238","Jun Wan; Zheng-Zhong Peng; Xue-Mei Li; Ping-Kai Ouyang; Shu-Sheng Zhang","1-(4-Chlorophenyl)-3-(1<i>H</i>-imidazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","8","o2659","o2660","10.1107/S160053680502310X","","","0.71073","MoKα","","0.0493","0.0411","","","0.1057","0.1118","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206414","3.623","0.0003","11.975","0.0002","20.2509","0.0002","90","","91.484","0.003","90","","878.3","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","cytosinium oxalate monohydrate","cytosinium oxalate monohydrate","","- C6 H9 N3 O6 -","- C6 H9 N3 O6 -","- C24 H36 N12 O24 -","4","1","DN6240","Karim Bouchouit; Nourredine Benali-Cherif; Dahaoui, Slimane; Bendeif, El-Eulmi; Lecomte, Claude","Cytosinium oxalate monohydrate","Acta Crystallographica Section E","2005","61","8","o2755","o2757","10.1107/S1600536805023494","","","0.71073","MoKα","","0.0817","0.05","","","0.1054","0.1202","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206415","6.487","0.0005","6.656","0.0004","11.5588","0.0008","81.227","0.004","76.733","0.003","65.037","0.005","439.5","0.06","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","5-tert-butyl-4-nitro-1H-pyrazol-3-ol","","- C7 H11 N3 O3 -","- C7 H11 N3 O3 -","- C14 H22 N6 O6 -","2","1","ER6016","Daniel E. Lynch; Ian McClenaghan","5-<i>tert</i>-Butyl-4-nitro-1<i>H</i>-pyrazol-3-ol","Acta Crystallographica Section E","2005","61","8","o2347","o2348","10.1107/S1600536805020544","","","0.71073","MoKα","","0.067","0.0587","","","0.1476","0.1532","","","","","","1.191","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206416","14.206","0.004","14.015","0.004","22.639","0.006","90","","90","","90","","4507","2","298","","298","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Hexacarbonyl-bis(μ~2~-2-methoxyphenylthiolato)diiron(I)(Fe—Fe)","","- C20 H14 Fe2 O8 S2 -","- C20 H14 Fe2 O8 S2 -","- C160 H112 Fe16 O64 S16 -","8","1","ER6017","Si, You-Tao; Ma, Cheng-Bing; Hu, Ming-Qiang; Chen, Chang-Neng","Hexacarbonylbis(μ~2~-2-methoxyphenylthiolato)diiron(I)(<i>Fe</i>—<i>Fe</i>)","Acta Crystallographica Section E","2005","61","8","m1447","m1448","10.1107/S1600536805020313","","","0.71073","MoKα","","","0.032","","","0.0858","0.0877","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206417","11.1","0.04","12.38","0.03","15.88","0.04","90.08","0.05","102.24","0.05","113.59","0.06","1945","10","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis[hydrotris(4-chloro-3,5-dimethylpyrazolyl)borato]nickel(II)","","- C30 H38 B2 Cl6 N12 Ni -","- C30 H38 B2 Cl6 N12 Ni -","- C60 H76 B4 Cl12 N24 Ni2 -","2","1","FL6170","Desrochers, Patrick J.; Brown, Josh R.; Arvin, Michael E.; Jones, Gavin D.; Vicic, David A.","Bis[hydrotris(4-chloro-3,5-dimethylpyrazolyl)borato]nickel(II)","Acta Crystallographica Section E","2005","61","8","m1455","m1458","10.1107/S160053680502012X","","","0.7107","MoKα","","0.0628","0.0486","","","0.1106","0.1186","","","","","","1.101","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206418","10.7715","0.0004","11.0565","0.0004","20.9841","0.0007","90","","101.121","0.002","90","","2452.18","0.15","105","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Bis(2-methylphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","","- C31 H28 N2 O2 -","- C31 H28 N2 O2 -","- C124 H112 N8 O8 -","4","1","FL6171","J. Suresh; V. P. Alex Raja; R. V. Krishnakumar; S. Natarajan; S. Perumal; A. Mostad","2,6-Bis(2-methylphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","Acta Crystallographica Section E","2005","61","8","o2458","o2460","10.1107/S1600536805021112","","","0.71073","MoKα","","0.0413","0.0381","","","0.098","0.1011","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206419","24.3956","0.0016","12.04","0.0008","14.7848","0.001","90","","93.529","0.001","90","","4334.4","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[2-(benz(othia/oxa)zol-2-yl)phenolato-κ^2^N,O]beryllium(II)","","- C26 H16 Be N2 O2.53 S1.47 -","- C26 H16 Be N2 O2.532 S1.468 -","- C208 H128 Be8 N16 O20.256 S11.744 -","8","1","FL6172","Tong, Yi-Ping","Bis[2-(benz(othia/oxa)zol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>]beryllium(II)","Acta Crystallographica Section E","2005","61","8","m1472","m1474","10.1107/S1600536805020933","","","0.71073","MoKα","","0.0585","0.0468","","","0.1213","0.1299","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206420","10.4009","0.0015","11.3173","0.0018","15.353","0.003","90","","103.427","0.005","90","","1757.8","0.5","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-(4-Nitrobenzoyloxy)-N-methyl-2-nitro-1-phenylpropan-1-amine","","- C17 H17 N3 O6 -","- C17 H17 N3 O6 -","- C68 H68 N12 O24 -","4","1","FL6174","Chu, Ji-Cheng; Li, Wei; Liu, Dong-Zhi","<i>N</i>-Methyl-2-nitro-<i>N</i>-(4-nitrobenzoyloxy)-1-phenylpropan-1-amine","Acta Crystallographica Section E","2005","61","8","o2661","o2662","10.1107/S1600536805022701","","","0.71073","MoKα","","0.0767","0.0381","","","0.0868","0.106","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206421","13.9313","0.0002","10.9888","0.0002","18.128","0.0004","90","","108.065","0.0008","90","","2638.38","0.09","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H25 Cl2 N5 O8 -","- C24 H25 Cl2 N5 O8 -","- C96 H100 Cl8 N20 O32 -","4","1","FL6176","L. Mihiri D. Ariyananda; Richard E. Norman","2-{[<i>N</i>-(Pyridinium-2-ylmethyl)-<i>N</i>-(pyridin-2-ylmethyl)amino]methyl}-1-(pyridin-2-ylmethyl)pyridinium diperchlorate","Acta Crystallographica Section E","2005","61","8","o2679","o2681","10.1107/S1600536805022828","","","0.71073","MoKα","","0.0938","0.0733","","0.2029","","0.1606","","","0.93605","","","1.0343","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206422","10.716","0.003","10.979","0.003","13.307","0.004","75.67","0.01","71.87","0.01","77.49","0.01","1424.9","0.7","299","2","299","2","","","","","","","","6","P -1","-P 1","2","","(Hydridotripyrazolylborato)iodo{(1,2,5,6-η)-1-[(Z)-1-iodo-2- phenylethenyl]cycloocta-1,5-diene}ruthenium(II)‒diiodine (2/1)","","- C25 H27 B I3 N6 Ru -","- C25 H27 B I3 N6 Ru -","- C50 H54 B2 I6 N12 Ru2 -","2","1","FL6177","Slugovc, Christian; Kirchner, Karl; Mereiter, Kurt","(Hydridotripyrazolylborato)iodo{(1,2,5,6-η)-1-[(<i>Z</i>)-1-iodo-2-phenylethenyl]cycloocta-1,5-diene}ruthenium(II)‒diiodine (2/1)","Acta Crystallographica Section E","2005","61","8","m1646","m1648","10.1107/S1600536805022944","","","0.71073","MoKα","","0.0389","0.0299","","","0.0674","0.0718","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206423","11.287","0.006","11.606","0.006","9.864","0.006","90","","112.39","0.07","90","","1194.7","1.3","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","O-Ethyl S-(3-oxoindan-1-yl) dithiocarbonate","","- C12 H12 O2 S2 -","- C12 H12 O2 S2 -","- C48 H48 O8 S8 -","4","1","FL6178","Hartung, Jens; Daniel, Kristina; Svoboda, Ingrid; Fuess, Hartmut","<i>O</i>-Ethyl <i>S</i>-(3-oxoindan-1-yl) dithiocarbonate","Acta Crystallographica Section E","2005","61","8","o2768","o2769","10.1107/S1600536805023901","","","0.71073","MoKα","","0.0733","0.0466","","","0.1259","0.1449","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206424","9.41","0.001","12.605","0.001","23.229","0.002","90","","90","","90","","2755.3","0.4","303","2","303","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-trans-Bromo-5-cis-fluoro-2,6,6-trimethyl-2-phenyltetrahydropyran","","- C14 H18 Br F O -","- C14 H18 Br F O -","- C112 H144 Br8 F8 O8 -","8","1","FL6180","Hartung, Jens; Greb, Marco; Svoboda, Ingrid; Fuess, Hartmut","3-<i>trans</i>-Bromo-5-<i>cis</i>-fluoro-2,6,6-trimethyl-2-phenyltetrahydropyran","Acta Crystallographica Section E","2005","61","8","o2770","o2771","10.1107/S1600536805023913","","","0.71073","MoKα","","0.1133","0.0733","","","0.1661","0.1878","","","","","","1.197","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206425","19.06","0.003","6.6887","0.0011","9.3752","0.0016","90","","90","","90","","1195.2","0.3","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","(1S,3aR,4S,6aR)-1-(4-Hydroxy-3-methoxyphenyl)-4-(4-hydroxy-3- methylphenyl)perhydrofuro[3,4-c]furan-3a,6a-diol hexahydrate","","- C20 H34 O14 -","- C20 H26 O14 -","- C40 H52 O28 -","2","0.5","GH6022","Ying-Qian Xu; Bing Zhao; Li-Xin Yang","(1<i>S</i>,3a<i>R</i>,4<i>S</i>,6a<i>R</i>)-1-(4-Hydroxy-3-methoxyphenyl)-4-(4-hydroxy-3-methylphenyl)perhydrofuro[3,4-<i>c</i>]furan-3a,6a-diol hexahydrate","Acta Crystallographica Section E","2005","61","8","o2559","o2560","10.1107/S1600536805022117","","","0.71073","MoKα","","0.0618","0.0428","","","0.1182","0.1287","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206426","7.0515","0.0009","10.2953","0.0012","11.0039","0.0013","113.247","0.002","91.839","0.002","92.225","0.002","732.46","0.15","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","3-(4,6-Dimethylpyrimidin-2-yl)-2-methylchromen-4-one","","- C16 H14 N2 O2 S -","- C16 H14 N2 O2 S -","- C32 H28 N4 O4 S2 -","2","1","GH6025","Wei Huang; Deyou Teng; Zhongzhen Zhou; Guangfu Yang","3-(4,6-Dimethylpyrimidin-2-yl)-2-methylchromen-4-one","Acta Crystallographica Section E","2005","61","8","o2510","o2512","10.1107/S1600536805021938","","","0.71073","MoKα","","0.0743","0.056","","","0.1661","0.1921","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206427","5.7593","0.0001","10.6881","0.0001","12.3122","0.0001","98.857","0.001","100.208","0.001","95.51","0.001","731.05","0.016","84","1","84","1","","","","","","","","3","P -1","-P 1","2","","5,8'-Dimethoxy-3H-1-benzofuran-2-spiro-2'-chroman","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","1","GH6027","George R. Clark; Kit Yee Tsang; Margaret A. Brimble","5,8'-Dimethoxy-3<i>H</i>-1-benzofuran-2-spiro-2'-chroman","Acta Crystallographica Section E","2005","61","8","o2748","o2749","10.1107/S1600536805023731","","","0.71073","MoKα","","0.0512","0.0404","","","0.0996","0.1074","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206428","24.9892","0.0015","16.622","0.0009","30.8299","0.0019","90","","110.506","0.003","90","","11994.4","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Diethanolaminium cyclo-octa-μ~2~-fluoro-hexadeca-μ~2~-trimethylacetato-κ^2^O:O'- heptachromium(III)nickel(II) ethyl acetate 0.5-solvate","","- C86 H160 Cr7 F8 N Ni O35 -","- C85.488 H155.47 Cr8 F8 N0.997 O35.494 -","- C341.952 H621.88 Cr32 F32 N3.988 O141.976 -","4","1","HB6196","Larsen, Finn K.; Muryn, Christopher A.; Overgaard, Jacob; Timco, Grigore A.; Winpenny, Richard E. P.","Diethanolaminium <i>cyclo</i>-octa-μ~2~-fluoro-hexadeca-μ~2~-trimethylacetato-κ^32^<i>O</i>:<i>O</i>'-heptachromium(III)nickel(II) ethyl acetate 0.5-solvate","Acta Crystallographica Section E","2005","61","8","m1525","m1527","10.1107/S1600536805019562","","","0.71073","MoKα","","0.1209","0.0907","","","0.2378","0.2577","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206429","20.566","0.005","20.174","0.005","14.243","0.003","90","","108.614","0.003","90","","5600","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis(3,5-diphenyl-4-amino-4H-1,2,4-triazole-κN^1^)zinc(II) bis(perchlorate)","","- C56 H48 Cl2 N16 O8 Zn -","- C56 H48 Cl2 N16 O8 Zn -","- C224 H192 Cl8 N64 O32 Zn4 -","4","1","HB6215","Yuan-Yuan Liu","Tetrakis(3,5-diphenyl-4-amino-4<i>H</i>-1,2,4-triazole-κ<i>N</i>^1^)zinc(II) bis(perchlorate)","Acta Crystallographica Section E","2005","61","8","m1486","m1488","10.1107/S1600536805020714","","","0.71073","MoKα","","0.1298","0.0554","","","0.1205","0.149","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206430","10.8491","0.0003","14.2301","0.0003","13.3928","0.0003","90","","94.671","0.001","90","","2060.76","0.09","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tetraaquabis(2-hydroxy-3,5-dinitrobenzoic acid)bis(2-oxido-3,5- dinitrobenzoato)tricopper‒diaquabis(2-hydroxy-3,5-dinitrobenzoato)copper‒water (0.54/0.92/4)","","- C28 H26.92 Cu2.54 N8 O36 -","- C28 H26.92 Cu2.54 N8 O36 -","- C56 H53.84 Cu5.08 N16 O72 -","2","0.5","HB6222","Jian-Rong Su; Duan-Jun Xu","The co-crystal tetraaquabis(2-oxido-3,5-dinitrobenzoato)bis(2-oxido-3,5-dinitrobenzoic acid)tricopper‒diaquabis(2-hydroxy-3,5-dinitrobenzoato)(2-oxido-3,5-dinitrobenzoic acid)copper‒water (0.54/0.92/4): a reformulation?","Acta Crystallographica Section E","2005","61","8","m1503","m1505","10.1107/S1600536805021069","","","0.71073","MoKα","","0.043","0.039","","","0.095","0.097","","","","","","1.199","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206431","24.463","0.004","14.818","0.002","15.911","0.003","90","","121.138","0.002","90","","4936.6","1.4","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Fe^III^(Salpn)(μ~2~-Salpn)Fe^III^(Salpn)","μ~2~-bis(salicylidene)propane-1,3-diaminato-bis{[bis(salicylidene)propane- 1,3-diaminato]iron(III)}","","- C51 H48 Fe2 N6 O6 -","- C51 H48 Fe2 N6 O6 -","- C204 H192 Fe8 N24 O24 -","4","0.5","HB6225","Bakir, Mohammed; Dasgupta, Tara P.; Dutta, Sujit K.; Ngah, Nurziana; Yamin, Bohari M.","Porous solvent-free μ~2~-bis(salicylidene)propane-1,3-diaminato-bis{[bis(salicylidene)propane-1,3-diaminato]iron(III)}","Acta Crystallographica Section E","2005","61","8","m1464","m1466","10.1107/S1600536805020611","","","0.71073","MoKα","","0.0572","0.0395","","","0.0945","0.1021","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206432","10.4595","0.0004","12.5105","0.0005","13.6969","0.0006","81.169","0.001","77.571","0.001","83.037","0.001","1722.3","0.12","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","Dichlorobis[2-(3,5-dimethylpyrazolyl-1-carbonyl)furan]palladium(II) bis[tris(pentafluorophenyl)borane] tetrahydrate dichloromethane disolvate","","- C58 H32 B2 Cl6 F30 N4 O8 Pd -","- C56 H28 B2 Cl2 F30 N4 O8 Pd -","- C56 H28 B2 Cl2 F30 N4 O8 Pd -","1","0.5","HB6228","Ilia A. Guzei; Stephen O. Ojwach; James Darkwa","Dichlorobis[2-(3,5-dimethylpyrazolyl-1-carbonyl)furan]palladium(II) bis[aquatris(pentafluorophenyl)boron] dihydrate dichloromethane disolvate","Acta Crystallographica Section E","2005","61","8","m1492","m1494","10.1107/S1600536805020520","","","0.71073","MoKα","","0.0321","0.0298","","","0.083","0.0849","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206433","19.6755","0.0016","9.7855","0.0008","9.9593","0.0008","90","","101.498","0.001","90","","1879","0.3","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dirubidium tricadmium tetrakis(sulfate) pentahydrate","","- Cd3 H10 O21 Rb2 S4 -","- Cd3 H10 O21 Rb2 S4 -","- Cd12 H40 O84 Rb8 S16 -","4","1","HB6229","Swain, Diptikanta; Guru Row, T. N.","Dirubidium tricadmium tetrakis(sulfate) pentahydrate","Acta Crystallographica Section E","2005","61","8","i163","i164","10.1107/S1600536805021252","","","0.71073","MoKα","","0.023","0.0219","","","0.0586","0.0591","","","","","","1.096","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206434","15.0179","0.0005","16.2881","0.0005","18.5719","0.0007","90","","102.964","0.0013","90","","4427.1","0.3","150","1","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","poly[[diperchloratocopper(II)]-bis[μ~2~-1,3-bis(4-pyridyl)propane]]","","- C26 H28 Cl2 Cu N4 O8 -","- C26 H28 Cl2 Cu N4 O8 -","- C156 H168 Cl12 Cu6 N24 O48 -","6","1.5","HB6230","Ryu, Ji Young; Kim, Cheal; Park, Dae Won; Park, Lae Ok; Kim, Youngmee; Lough, Alan J.","The two-dimensional structure of poly[[diperchloratocopper(II)]-bis[μ~2~-1,3-bis(4-pyridyl)propane]]","Acta Crystallographica Section E","2005","61","8","m1489","m1491","10.1107/S1600536805020878","","","0.71073","MoKα","","0.0943","0.0569","","","0.1342","0.1585","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206435","8.07","0.005","9.644","0.005","18.125","0.005","100.28","0.05","96.2","0.05","112.12","0.05","1261.8","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","(2,2'-Bipyridyl-κ^2^N,N')nitrato(triphenylphosphine-κP)silver(I)","","- C28 H23 Ag N3 O3 P -","- C28 H23 Ag N3 O3 P -","- C56 H46 Ag2 N6 O6 P2 -","2","1","HB6231","Amirnasr, Mehdi; Welter, Richard; Khalaji, Aliakbar Dehno","(2,2'-Bipyridyl-κ^2^<i>N</i>,<i>N</i>')nitrato(triphenylphosphine-κ<i>P</i>)silver(I)","Acta Crystallographica Section E","2005","61","8","m1452","m1454","10.1107/S160053680502057X","","","0.71069","MoKα","","0.0423","0.0315","","","0.0829","0.0946","","","","","","1.064","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206436","9.1896","0.0006","13.8731","0.0009","20.001","0.001","90","","93.641","0.001","90","","2544.7","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-1,8- diacetato)cobalt(II) tetrahydrate","","- C20 H46 Co N4 O8 -","- C20 H46 Co N4 O8 -","- C80 H184 Co4 N16 O32 -","4","1","HB6232","Wang, Shi-Fan; Ruan, Ban-Feng; Li, Huang-Qiu; Zhu, Hai-Liang; Ng, Seik Weng","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-1,8-diacetato)cobalt(II) tetrahydrate","Acta Crystallographica Section E","2005","61","8","m1484","m1485","10.1107/S1600536805020532","","","0.71073","MoKα","","0.0723","0.0624","","","0.1435","0.1485","","","","","","1.176","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206437","5.5931","0.0006","8.8605","0.001","14.0427","0.0015","90.206","0.002","96.662","0.002","96.181","0.002","687.11","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[dibromozinc(II)]-μ-1,2-bis(4-pyridyl)ethane]","","- C12 H12 Br2 N2 Zn -","- C12 H12 Br2 N2 Zn -","- C24 H24 Br4 N4 Zn2 -","2","1","HB6233","Hong, Sung Jin; Lee, Jung Hwan; Lee, Eun Yong; Kim, Cheal; Kim, Youngmee; Kim, Sung-Jin","<i>catena</i>-Poly[[dibromozinc(II)]-μ-1,2-bis(4-pyridyl)ethane], a one-dimensional coordination polymer","Acta Crystallographica Section E","2005","61","8","m1561","m1562","10.1107/S1600536805022026","","","0.71073","MoKα","","0.0577","0.0555","","","0.1443","0.1461","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206438","7.1352","0.0004","8.7869","0.0005","13.186","0.0007","88.659","0.001","85.782","0.001","88.145","0.001","823.86","0.08","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[bis(ethane-1,2-diaminium) [ferrate(III)-μ-hydroxo-κ^2^O:O-di-μ-sulfato-κ^4^O:O']] sulfate monohydrate]","","- C4 H23 Fe N4 O14 S3 -","- C4 H23 Fe N4 O14 S3 -","- C8 H46 Fe2 N8 O28 S6 -","2","1","HB6234","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[[bis(ethane-1,2-diaminium) [ferrate(III)-μ-hydroxo-κ^2^<i>O</i>:<i>O</i>-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>']] sulfate monohydrate]","Acta Crystallographica Section E","2005","61","8","m1478","m1480","10.1107/S1600536805020866","","","0.71073","MoKα","","0.032","0.028","","","0.079","0.081","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206439","12.7839","0.0005","12.9973","0.0006","18.0683","0.0008","100.725","0.002","98.363","0.002","90.364","0.002","2916.6","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","Chloro[η^5^-1-(dimethylaminoethyl)indenyl](triphenylphosphine)nickel(II) diethyl ether hemisolvate","","- C33 H36 Cl N Ni O0.5 P -","- C33 H36 Cl N Ni O0.5 P -","- C132 H144 Cl4 N4 Ni4 O2 P4 -","4","2","HB6236","Castonguay, Annie; Beauchamp, André L.; Vachon, Jason; Zargarian, Davit","Chloro[η^5^-1-(dimethylaminoethyl)indenyl](triphenylphosphine)nickel(II) diethyl ether hemisolvate","Acta Crystallographica Section E","2005","61","8","m1512","m1513","10.1107/S160053680502129X","","","1.54178","CuKα","","0.0836","0.048","","","0.1064","0.1184","","","","","","0.947","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206440","9.9384","0.0004","9.9384","0.0004","9.9384","0.0004","90","","90","","90","","981.63","0.07","295","2","295","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","ammonium oxonium dititanium(III,IV) tris(phosphate)","","- H7 N O13 P3 Ti2 -","- H7 N O13 P3 Ti2 -","- H28 N4 O52 P12 Ti8 -","4","0.333333","HB6237","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Langbeinite-type mixed-valence (NH~4~)(H~3~O)Ti^III^Ti^IV^(PO~4~)~3~","Acta Crystallographica Section E","2005","61","8","i158","i159","10.1107/S1600536805021392","","","0.71073","MoKα","","0.022","0.022","","","0.065","0.065","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206441","11.355","0.001","17.568","0.002","16.102","0.002","90","","90","","90","","3212.1","0.6","295","2","295","2","","","","","","","","6","C m c 21","C 2c -2","36","","Tetrapyridinium tetrasulfatozirconate(IV) monohydrate","","- C20 H26 N4 O17 S4 Zr -","- C20 H26 N4 O17 S4 Zr -","- C80 H104 N16 O68 S16 Zr4 -","4","0.5","HB6238","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Tetrapyridinium tetrasulfatozirconate(IV) monohydrate","Acta Crystallographica Section E","2005","61","8","m1520","m1522","10.1107/S1600536805021409","","","0.71073","MoKα","","0.075","0.055","","","0.131","0.143","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206442","13.684","0.0004","13.684","0.0004","21.4734","0.0008","90","","90","","90","","4020.9","0.2","150","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","5-tert-Butyl-4-bromo-1,2-dihydro-1H-pyrazol-3(2H)-one monohydrate","","- C7 H13 Br N2 O2 -","- C7 H13 Br N2 O2 -","- C112 H208 Br16 N32 O32 -","16","1","HG6180","Daniel E. Lynch; Ian McClenaghan","5-<i>tert</i>-Butyl-4-bromo-1,2-dihydro-1<i>H</i>-pyrazol-3(2<i>H</i>)-one monohydrate","Acta Crystallographica Section E","2005","61","8","o2349","o2351","10.1107/S1600536805012791","","","0.71073","MoKα","","0.0419","0.0301","","","0.0641","0.0692","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206443","7.2196","0.0005","12.9481","0.0009","15.1436","0.0009","90","","90","","90","","1415.63","0.16","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(1R,2R,5R)-(+)-2α-Hydroxypinan-3-one ketimine","(1R,2R,5R)-2-hydroxy-2,6,6-trimethyl-3-[(3- pyridyl)methylimino]bicyclo[3.1.1]heptane","","- C16 H22 N2 O -","- C16 H22 N2 O -","- C64 H88 N8 O4 -","4","1","HG6205","Ayers, Joshua T.; Sonar, Vijayakumar N.; Parkin, Sean; Dwoskin, Linda P.; Crooks, Peter A.","(1<i>R</i>,2<i>R</i>,5<i>R</i>)-(+)-2α-Hydroxypinan-3-one ketimine","Acta Crystallographica, Section E","2005","61","8","2682","o2684","10.1107/S1600536805023287","","","0.71073","MoKα","","0.0771","0.0474","","","0.097","0.1089","","","","","","1.018","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2206444","8.1321","0.0002","10.6922","0.0003","26.8033","0.0007","90","","90","","90","","2330.55","0.11","295","1","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6-Acetoxymethyl-2-(2-methoxyphenoxy)tetrahydropyran-3,4,5-triyl triacetate","","- C21 H26 O11 -","- C21 H26 O11 -","- C84 H104 O44 -","4","1","HG6206","Zhou, Feng-Yan; Zhong, Jian-Hua","6-Acetoxymethyl-2-(2-methoxyphenoxy)tetrahydropyran-3,4,5-triyl triacetate","Acta Crystallographica, Section E: Structure Reports Online","2005","61","8","o2701","o2703","10.1107/S1600536805022804","","","0.7107","MoKα","","","0.04","","","","0.118","","","","","","1.012","","","","has coordinates,has Fobs","209472","2020-10-21","18:00:00",""
"2206445","11.9054","0.0008","10.8101","0.0006","13.6064","0.0009","90","","112.957","0.007","90","","1612.4","0.2","173","","173","1","","","","","","","","5","P 1 21 1","P 2yb","4","","(3R)-Methyl 6-tert-butoxycarbonylamino-5-oxo- 2,3-dihydro-5H-1,3-thiazolo[3,2-a]pyridine-3-carboxylate","","- C14 H18 N2 O5 S -","- C14 H18 N2 O5 S -","- C56 H72 N8 O20 S4 -","4","2","HG6207","Seger, Harald; Stempfhuber, Sabine; Zabel, Manfred; Marsch, Michael; Geyer, Armin; Harms, Klaus","(3<i>R</i>)-Methyl 6-<i>tert</i>-butoxycarbonylamino-5-oxo-2,3-dihydro-5<i>H</i>-1,3-thiazolo[3,2-<i>a</i>]pyridine-3-carboxylate","Acta Crystallographica Section E","2005","61","8","o2576","o2578","10.1107/S1600536805022245","","","0.71073","MoKα","","0.0345","0.0338","","","0.0852","0.0856","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206446","7.624","0.005","10.436","0.006","12.791","0.008","99.096","0.007","98.257","0.007","98.981","0.007","977.7","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-{(2-chlorophenyl)[(4-methylphenyl)imino]methyl}ferrocene","","- C24 H20 Cl Fe N -","- C24 H20 Cl Fe N -","- C48 H40 Cl2 Fe2 N2 -","2","1","HG6208","Hong-Xing Wang; Hui-Chao Zhou; Hong-Fei Wu","1-{(2-Chlorophenyl)[(4-methylphenyl)imino]methyl}ferrocene","Acta Crystallographica Section E","2005","61","8","m1623","m1624","10.1107/S1600536805023299","","","0.71073","MoKα","","0.0333","0.0289","","","0.0778","0.08","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206447","18.159","0.002","7.8122","0.0009","21.777","0.003","90","","106.724","0.002","90","","2958.7","0.6","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","Bis(triphenylsilyl)selenide","","- C36 H30 Se Si2 -","- C36 H30 Se Si2 -","- C144 H120 Se4 Si8 -","4","1","HG6210","Medina, Iliana; Mague, Joel T.; Donahue, James P.; Fink, Mark J.","Bis(triphenylsilyl)selenide","Acta Crystallographica Section E","2005","61","8","o2687","o2688","10.1107/S1600536805023275","","","0.71073","MoKα","","0.027","0.0255","","","0.0592","0.0597","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206448","8.7101","0.0006","11.8947","0.0008","15.1194","0.001","109.92","0.001","102.599","0.001","98.444","0.001","1394.87","0.16","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","Diaquatetrakis(1H-imidazole)copper(II) bis[tris(1H-imidazole)(pyridine-2,4,6-tricarboxylato- κ^3^N,O^2^:O^6^)cuprate(II)] dihydrate","","- C46 H52 Cu3 N22 O16 -","- C46 H52 Cu3 N22 O16 -","- C46 H52 Cu3 N22 O16 -","1","0.5","HG6216","Houser, Robert P.; Cheng, Deping","Diaquatetrakis(1<i>H</i>-imidazole)copper(II) bis[tris(1<i>H</i>-imidazole)(pyridine-2,4,6-tricarboxylato-κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>^6^)cuprate(II)] dihydrate","Acta Crystallographica Section E","2005","61","8","m1649","m1651","10.1107/S1600536805023780","","","0.71073","MoKα","","0.0257","0.025","","","0.0692","0.0696","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206449","7.5449","0.0019","9.187","0.002","9.5884","0.0019","79.358","0.003","78.13","0.002","70.887","0.003","609.6","0.2","298","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[3-dimethylamino-l-(2-pyridyl)prop-2-enonato]diperchloratozinc(II)","","- C20 H24 Cl2 N4 O10 Zn -","- C20 H24 Cl2 N4 O10 Zn -","- C20 H24 Cl2 N4 O10 Zn -","1","0.5","HK6010","Wang, Ping; Xu, Xiao-Nan; Zheng, Lan-Fang; Bao, Yan-Qing","Bis[3-dimethylamino-1-(2-pyridyl)prop-2-enonato]diperchloratozinc(II)","Acta Crystallographica Section E","2005","61","8","m1462","m1463","10.1107/S1600536805020623","","","0.71073","MoKα","","0.037","0.0343","","","0.0988","0.1012","","","","","","1.124","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206450","7.1327","0.0002","16.8046","0.0006","7.9402","0.0002","90","","113.253","0.002","90","","874.42","0.05","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Propane-1,3-diaminium hydrogenarsenate monohydrate","","- C3 H15 As N2 O5 -","- C3 H15 As N2 O5 -","- C12 H60 As4 N8 O20 -","4","1","HK6019","Todd, Malcolm J.; Harrison, William T. A.","Propane-1,3-diaminium hydrogenarsenate monohydrate","Acta Crystallographica Section E","2005","61","8","m1459","m1461","10.1107/S1600536805020702","","","0.71073","MoKα","","0.0273","0.0223","","","0.0534","0.0552","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206451","12.959","0.005","10.908","0.005","23.797","0.005","90","","90","","90","","3364","2","100","","100","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","6-Methyl-N-(3-oxo-1-thia-4-azaspiro[4.4]non-4-yl)imidazo[2,1-b][1,3]thiazole- 5-carboxamide monohydrate","","- C14 H18 N4 O3 S2 -","- C14 H18 N4 O3 S2 -","- C112 H144 N32 O24 S16 -","8","1","HK6020","Sema Öztürk Yıldırım; Mehmet Akkurt; Fusun Ur; Zafer Cesur; Nesrin Cesur; Frank W. Heinemann","6-Methyl-<i>N</i>-(3-oxo-1-thia-4-azaspiro[4.4]non-4-yl)imidazo[2,1-<i>b</i>][1,3]thiazole-5-carboxamide monohydrate","Acta Crystallographica Section E","2005","61","8","o2357","o2359","10.1107/S1600536805020088","","","0.71069","MoKα","","0.052","0.0345","","","0.0702","0.0762","","","","","","1.036","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206452","11.648","0.006","5.777","0.003","15.852","0.008","90","","100.74","0.009","90","","1048","0.9","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-(1,4-Phenylenedivinylene)diquinolin-8-ol","","- C28 H20 N2 O2 -","- C28 H20 N2 O2 -","- C56 H40 N4 O4 -","2","0.5","HK6021","Cui, Jian-Zhong; Zhang, Dan; Hai-Bin Song; Tang, Xiang-Yang","2,2'-(1,4-Phenylenedivinylene)diquinolin-8-ol","Acta Crystallographica Section E","2005","61","8","o2372","o2373","10.1107/S1600536805020672","","","0.71073","MoKα","","0.0832","0.0444","","","0.0975","0.1184","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206453","12.8335","0.0013","13.217","0.002","14.148","0.003","90","","94.239","0.011","90","","2393.2","0.7","299","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetra-n-butylammonium di-μ-hydroxo-bis[dinitratodioxouranium(VI)]","","- C32 H74 N6 O18 U2 -","- C32 H74 N6 O18 U2 -","- C64 H148 N12 O36 U4 -","2","0.5","HK6022","Andreas Fischer; Giuseppe Palladino","Tetra-<i>n</i>-butylammonium di-μ-hydroxo-bis[dinitratodioxouranate(VI)]","Acta Crystallographica Section E","2005","61","8","m1542","m1544","10.1107/S1600536805021045","","","0.71073","MoKα","","0.094","0.052","","","0.084","0.101","","","","","","1.27","","","","has coordinates,has Fobs","189213","2020-10-21","18:00:00",""
"2206454","12.0665","0.0011","10.305","0.001","17.4969","0.0017","90","","108.371","0.002","90","","2064.8","0.3","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diethyl 6,9-dibromo-1,4-dioxo-1,2,3,4,5,10-hexahydro-2,3,4a,10a-tetraazabenzo[g] cyclopenta[cd]azulene-2a,10b-dicarboxylate","","- C18 H18 Br2 N4 O6 -","- C18 H18 Br2 N4 O6 -","- C72 H72 Br8 N16 O24 -","4","1","HK6024","Nengfang She; Huizhen Guo; Zhiguo Wang; Anxin Wu","Diethyl 6,9-dibromo-1,4-dioxo-1,2,3,4,5,10-hexahydro-2,3,4a,10a-tetraazabenzo[<i>g</i>]cyclopenta[<i>cd</i>]azulene-2a,10b-dicarboxylate","Acta Crystallographica Section E","2005","61","8","o2549","o2550","10.1107/S1600536805022075","","","0.71073","MoKα","","0.0714","0.0575","","","0.1452","0.1571","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206455","9.7757","0.0003","10.5004","0.0003","15.6093","0.0004","90","","91.692","0.002","90","","1601.58","0.08","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","hydrochlorothiazide aniline solvate","Hydrochlorothiazide‒aniline (1/1)","","- C13 H15 Cl N4 O4 S2 -","- C13 H15 Cl N4 O4 S2 -","- C52 H60 Cl4 N16 O16 S8 -","4","1","HK6025","Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","Hydrochlorothiazide‒aniline (1/1)","Acta Crystallographica Section E","2005","61","8","o2520","o2522","10.1107/S1600536805021914","","","0.71073","MoKα","","0.0514","0.0335","","","0.0767","0.0836","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206456","8.633","0.002","10.924","0.003","13.296","0.004","109.334","0.004","90.305","0.005","111.828","0.004","1086.5","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","cis-(Carbonato-κ^2^O,O')(rac-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^N)chromium(III) bromide monohydrate","","- C17 H38 Br Cr N4 O4 -","- C17 H38 Br Cr N4 O4 -","- C34 H76 Br2 Cr2 N8 O8 -","2","1","HK6026","Liliana Dobrzańska","<i>cis</i>-(Carbonato-κ^2^<i>O</i>,<i>O</i>')(<i>rac</i>-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)chromium(III) bromide monohydrate","Acta Crystallographica Section E","2005","61","8","m1625","m1627","10.1107/S1600536805023172","","","0.71073","MoKα","","0.0719","0.0502","","","0.108","0.1174","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206457","7.318","0.002","9.736","0.003","15.433","0.005","90","","98.178","0.005","90","","1088.4","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9,10-Bis[(phenylthio)methyl]anthracene '","","- C28 H22 S2 -","- C28 H22 S2 -","- C56 H44 S4 -","2","0.5","HK6027","Chunbo Liu; Guangbo Che; Chuanbi Li; Yuncheng Cui","9,10-Bis[(phenylsulfanyl)methyl]anthracene","Acta Crystallographica Section E","2005","61","8","o2537","o2538","10.1107/S160053680502204X","","","0.71073","MoKα","","0.0709","0.0404","","","0.0882","0.0995","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206458","11.7991","0.0009","10.0206","0.0008","18.423","0.001","90","","101.352","0.002","90","","2135.6","0.3","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(quinolinium) tetrachlorozincate dihydrate","","- C18 H20 Cl4 N2 O2 Zn -","- C18 H20 Cl4 N2 O2 Zn -","- C72 H80 Cl16 N8 O8 Zn4 -","4","0.5","HK6028","Valdés Martínez, Jesús; Muñoz, Orneli; Toscano, Rubén A.","π‒π Stacking in bis(quinolinium) tetrachlorozincate dihydrate","Acta Crystallographica Section E","2005","61","8","m1590","m1592","10.1107/S1600536805022506","","","0.71073","MoKα","","0.0831","0.0487","","","0.0789","0.0873","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206459","9.9906","0.0008","7.2954","0.0006","10.2946","0.0009","90","","91.893","0.001","90","","749.92","0.11","292","2","292","2","","","","","","","","5","P 1 21 1","P 2yb","4","[Zn(phen)(mal)(H~2~O)]~n~","catena-Poly[[aqua(1,10-phenanthroline)zinc(II)]-μ-maleate-κ^3^O,O,O']","","- C16 H12 N2 O5 Zn -","- C16 H12 N2 O5 Zn -","- C32 H24 N4 O10 Zn2 -","2","1","IS6086","Li, Ming-Tian; Fu, Xu-Cheng; Wang, Cheng-Gang","<i>catena</i>-Poly[[aqua(1,10-phenanthroline)zinc(II)]-μ-maleato-κ^3^<i>O</i>,<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","8","m1436","m1438","10.1107/S1600536805020271","","","0.71073","MoKα","","0.0229","0.0223","","","0.0645","0.0648","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206460","7.4111","0.0016","8.7821","0.0019","15.545","0.003","75.292","0.003","84.626","0.002","78.163","0.003","956.9","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{2-[2-(1H-1,3-Benzimidazol-2-yl)ethyliminomethyl]-4- bromophenolato}thiocyanatocopper(II) methanol solvate","","- C18 H17 Br Cu N4 O2 S -","- C18 H17 Br Cu N4 O2 S -","- C36 H34 Br2 Cu2 N8 O4 S2 -","2","1","IS6091","Xiao-Hang Qiu; Xiao-lan Tong","{2-[2-(1<i>H</i>-1,3-Benzimidazol-2-yl)ethyliminomethyl]-4-bromophenolato}thiocyanatocopper(II) methanol solvate","Acta Crystallographica Section E","2005","61","8","m1470","m1471","10.1107/S1600536805020477","","","0.71073","MoKα","","0.043","0.034","","","0.092","0.098","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206461","7.7453","0.0009","16.2325","0.0019","7.3667","0.0009","90","","98.908","0.002","90","","915.01","0.19","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","o-(2-Bromoethoxy)benzaldehyde","","- C9 H9 Br O2 -","- C9 H9 Br O2 -","- C36 H36 Br4 O8 -","4","1","IS6092","Bang-Tun Zhao; Jian-Ge Wang; Pu-Zhou Hu; Lu-Fang Ma; Li-Ya Wang","<i>o</i>-(2-Bromoethoxy)benzaldehyde","Acta Crystallographica Section E","2005","61","8","o2398","o2400","10.1107/S1600536805020799","","","0.71073","MoKα","","0.0432","0.0383","","","0.0967","0.1001","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206462","12.1705","0.0017","11.0375","0.0015","15.078","0.002","90","","107.232","0.003","90","","1934.5","0.5","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(5-Benzyloxy-2,4-dichlorophenyl)-4,5,6,7-tetrahydro -isoindole-1,3-dione","","- C21 H17 Cl2 N O3 -","- C21 H17 Cl2 N O3 -","- C84 H68 Cl8 N4 O12 -","4","1","IS6093","Neng-Xue Wang; Yan-Ping Luo; Qiong Chen; Guang-Fu Yang","2-(5-Benzyloxy-2,4-dichlorophenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione","Acta Crystallographica Section E","2005","61","8","o2332","o2333","10.1107/S1600536805020246","","","0.71073","MoKα","","0.0822","0.0484","","","0.1134","0.1293","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206463","5.8384","0.0001","9.6253","0.0002","25.7216","0.0004","90","","93.421","0.001","90","","1442.88","0.04","293","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1',3,3'-Tetrabenzyl-2,2'-biimidazolidine","","- C34 H38 N4 -","- C34 H38 N4 -","- C68 H76 N8 -","2","0.5","IS6094","Yliana López; Rosa Santillan; M. Eugenia Ochoa; Norberto Farfán; Efrén V. García-Báez; Itzia I. Padilla-Martínez","1,1',3,3'-Tetrabenzyl-2,2'-biimidazolidine","Acta Crystallographica Section E","2005","61","8","o2464","o2466","10.1107/S1600536805021136","","","0.71073","MoKα","","0.074","0.0482","","","0.1246","0.1396","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206464","10.257","0.004","23.04","0.008","7.424","0.003","90","","127.771","0.004","90","","1386.8","0.9","294","2","294","2","","","","","","","","4","C 1 c 1","C -2yc","9","","N-Ethyl-5-(pyrrol-1-yl)-1,8-naphthalimide","","- C18 H14 N2 O2 -","- C18 H14 N2 O2 -","- C72 H56 N8 O8 -","4","1","IS6096","Yu-Quan Shi; Dan Xu; Ming-Jian Cai; Bin Chen","<i>N</i>-Ethyl-5-(pyrrol-1-yl)-1,8-naphthalimide","Acta Crystallographica Section E","2005","61","8","o2436","o2437","10.1107/S1600536805021185","","","0.71073","MoKα","","0.0406","0.0328","","","0.0821","0.089","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206465","19.064","0.004","7.6978","0.0016","24.864","0.005","90","","98.261","0.004","90","","3611","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetra-μ-phenoxyacetato-bis[(acetonitrile)copper(II)](Cu—Cu)","","- C36 H34 Cu2 N2 O12 -","- C36 H34 Cu2 N2 O12 -","- C144 H136 Cu8 N8 O48 -","4","0.5","IS6097","Jiang, Guo-Qing; Li, Yi-Zhi; Wang, Su-Na; Li, Fei-Fei; Bai, Jun-Feng","Tetra-μ-phenoxyacetato-bis[(acetonitrile)copper(II)](<i>Cu</i>—<i>Cu</i>)","Acta Crystallographica Section E","2005","61","8","m1517","m1519","10.1107/S1600536805021197","","","0.71073","MoKα","","0.0858","0.0534","","","0.1071","0.1144","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206466","33.126","0.009","5.7499","0.0015","9.258","0.003","90","","90.305","0.005","90","","1763.4","0.9","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,6-Bis(4-methoxybenzyloxy)pyridazine","","- C20 H20 N2 O4 -","- C20 H20 N2 O4 -","- C80 H80 N8 O16 -","4","0.5","IS6098","Fang-Zhong Hu; Min Zhang; Hai-Bin Song; Xiao-Mao Zou; Hua-Zheng Yang","3,6-Bis(4-methoxybenzyloxy)pyridazine","Acta Crystallographica Section E","2005","61","8","o2486","o2488","10.1107/S1600536805021173","","","0.71073","MoKα","","0.0846","0.04","","","0.0948","0.1146","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206467","5.482","0.003","5.381","0.002","43.859","0.002","90","","93.07","0.02","90","","1291.9","0.9","296","1","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,24-Dibromotetracosane","","- C24 H48 Br2 -","- C24 H48 Br2 -","- C48 H96 Br4 -","2","0.5","IS6099","Naotake Nakamura; Akira Ohishi","1,24-Dibromotetracosane","Acta Crystallographica Section E","2005","61","8","o2447","o2449","10.1107/S1600536805021379","","","1.5418","CuKα","","","0.056","","","","0.108","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206468","9.0195","0.0018","10.402","0.002","20.289","0.004","90","","97.477","0.003","90","","1887.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-[2-({[(4-methoxybenzoyl)amino]carbonothioyl}amino)ethyl]morpholin-4-ium thiocyanate","","- C16 H22 N4 O3 S2 -","- C16 H22 N4 O3 S2 -","- C64 H88 N16 O12 S8 -","4","1","IS6100","Yusof, M. Sukeri M.; Yamin, Bohari M.","<i>N</i>-(4-Methoxybenzoyl)-<i>N</i>'-[2-(morpholinium-1-yl)ethyl]thiourea thiocyanate","Acta Crystallographica Section E","2005","61","8","o2433","o2435","10.1107/S1600536805021124","","","0.71073","MoKα","","0.063","0.054","","","0.12","0.125","","","","","","1.17","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206469","13.0125","0.0012","8.5957","0.0006","15.4586","0.0012","90","","112.655","0.006","90","","1595.7","0.2","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-Bis[5-oxo-3-(n-propyl)-4,5-dihydro-3H-1,2,4-triazol-4-yl]ethane dihydrate","","- C12 H24 N6 O4 -","- C12 H24 N6 O4 -","- C48 H96 N24 O16 -","4","0.5","IS6101","Gonca Özdemir; Şamil I şık; Kemal Sancak; Selami Şaşmaz; Nazmi Turan Okumuşoğlu","1,2-Bis[5-oxo-3-(<i>n</i>-propyl)-4,5-dihydro-3<i>H</i>-1,2,4-triazol-4-yl]ethane dihydrate","Acta Crystallographica Section E","2005","61","8","o2699","o2700","10.1107/S1600536805022853","","","0.71073","MoKα","","0.0588","0.0464","","","0.1126","0.1195","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206470","9.7963","0.0007","11.3007","0.0008","24.0399","0.0017","90","","93.922","0.001","90","","2655.1","0.3","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N,N'-Bis(N,N-dimethyl-p-toluidine)bis(ethoxycarbonyl)glycoluril","Diethyl 4,8-dioxo-2,6-di-p-tolyl-1,3,5,7-tetrahydro-2,3a,4a,6,7a,8a- hexaazacyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C28 H32 N6 O6 -","- C28 H32 N6 O6 -","- C112 H128 N24 O24 -","4","1","IS6102","Yin, Guo-Dong; Zhou, Bao-Han; Chen, Yun-Feng; Wu, An-Xin","<i>N</i>,<i>N</i>'-Bis(<i>N</i>,<i>N</i>-dimethyl-<i>p</i>-toluidine)bis(ethoxycarbonyl)glycoluril","Acta Crystallographica Section E","2005","61","8","o2632","o2634","10.1107/S1600536805022725","","","0.71073","MoKα","","0.072","0.0479","","","0.1194","0.1321","","","","","","1.025","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206471","15.1182","0.001","14.0027","0.0009","17.3551","0.0012","90","","107.173","0.002","90","","3510.2","0.4","291","2","291","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","mer-Bis(2,3-dimethyl-5-oxo-1-phenyl-2,5-dihydro-1H-pyrazole-4-carbaldehyde 4,4-dimethylthiosemicarbazonato-κ^3^S,N,O)cobalt(III) tetrafluoroborate","","- C30 H36 B Co F4 N10 O2 S2 -","- C30 H36 B Co F4 N10 O2 S2 -","- C120 H144 B4 Co4 F16 N40 O8 S8 -","4","1","IS6103","Valdés Martínez, Jesús; Hernández-Ortega, Simón; West, Douglas X.; El-Sawaf, Ayman K.; El-Bahanasawy, Ramadan M.; El-Saied, Fathy A.","<i>mer</i>-Bis(2,3-dimethyl-5-oxo-1-phenyl-2,5-dihydro-1<i>H</i>-pyrazole-4-carbaldehyde 4,4-dimethylthiosemicarbazonato-κ^3^<i>S</i>,<i>N</i>,<i>O</i>)cobalt(III) tetrafluoroborate","Acta Crystallographica Section E","2005","61","8","m1593","m1594","10.1107/S1600536805022488","","","0.71073","MoKα","","0.0581","0.0432","","","0.1048","0.1089","","","","","","0.94","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206472","14.3102","0.0008","7.6342","0.0004","18.5783","0.001","90","","107.637","0.001","90","","1934.22","0.18","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[cis-diaqua(1,10-phenanthroline-κ^2^N,N')cobalt(II)]- μ~2~-5-sulfonatosalicylato-κ^2^O:O']","","- C19 H16 Co N2 O8 S -","- C19 H16 Co N2 O8 S -","- C76 H64 Co4 N8 O32 S4 -","4","1","IS6104","Fan, Sai-Rong; Zhu, Long-Guan","<i>catena</i>-Poly[[<i>cis</i>-diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ~2~-5-sulfonatosalicylato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","8","m1598","m1600","10.1107/S1600536805022920","","","0.71073","MoKα","","0.0693","0.0667","","","0.1348","0.1359","","","","","","1.302","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206473","17.543","0.001","9.0676","0.0006","13.7592","0.0009","90","","96.67","0.001","90","","2173.9","0.2","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","4,4'-Bipyridinium(2+) hexaaquairon(II) disulfate dihydrate","","- C10 H26 Fe N2 O16 S2 -","- C10 H26 Fe N2 O16 S2 -","- C40 H104 Fe4 N8 O64 S8 -","4","0.5","IS6106","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","4,4'-Bipyridinium(2+) hexaaquairon(II) disulfate dihydrate","Acta Crystallographica Section E","2005","61","8","m1639","m1640","10.1107/S1600536805023391","","","0.71073","MoKα","","0.059","0.054","","","0.126","0.13","","","","","","1.21","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206474","7.0983","0.0006","10.469","0.0009","10.5212","0.0009","60.421","0.001","76.616","0.001","76.797","0.002","655.44","0.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[piperazinium(2+) [ferrate(III)-μ-hydroxo-κ^2^O:O-di-μ-sulfato-κ^4^O:O'] dihydrate]","","- C4 H17 Fe N2 O11 S2 -","- C4 H17 Fe N2 O11 S2 -","- C8 H34 Fe2 N4 O22 S4 -","2","1","IS6107","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[piperazinium(2+) [ferrate(III)-μ-hydroxo-κ^2^<i>O</i>:<i>O</i>-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2005","61","8","m1641","m1643","10.1107/S1600536805023408","","","0.71073","MoKα","","0.042","0.035","","","0.107","0.134","","","","","","1.22","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206475","8.52","0.002","12.646","0.003","12.917","0.003","90","","90","","90","","1391.7","0.6","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(1R,4R)-(+)-3-benzoylcamphor","(+)-(1R,4R)-3-(hydroxy-benzylidene)-1,7,7-trimethyl- bicyclo[2.2.1]heptan-2-one","","- C17 H20 O2 -","- C17 H20 O2 -","- C68 H80 O8 -","4","1","JH6011","Niemeyer, Mark; Gan, Min","The enol form of (+)-(1<i>R</i>,4<i>R</i>)-3-benzoylcamphor","Acta Crystallographica Section E","2005","61","8","o2363","o2365","10.1107/S1600536805020404","","","0.71073","MoKα","","0.04","0.035","","","0.089","0.092","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206476","24.5562","0.001","9.2464","0.0004","11.9764","0.0005","90","","91.559","0.002","90","","2718.3","0.2","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2-[(Dimethylamino)(phenyl)methyl]benzoic acid","[(2-carboxylatophenyl)(phenyl)methyl]-N,N-dimethylammonium","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C128 H136 N8 O16 -","8","1","JH6012","Yvette L. Dann; Andrew R. Cowley; Harry L. Anderson","2-[(Dimethylamino)(phenyl)methyl]benzoic acid","Acta Crystallographica Section E","2005","61","8","o2502","o2503","10.1107/S1600536805021215","","","0.71073","MoKα","","0.1117","0.0505","","0.1188","0.0582","0.0582","","","","","","1.1413","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206477","10.2783","0.0011","11.4013","0.0011","11.593","0.0012","90","","90","","90","","1358.5","0.2","292","2","292","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(E)-3-Isopropyl-5,5-dimethyl-2-(phenylimino)imidazolidin-4-one","","- C14 H19 N3 O -","- C14 H19 N3 O -","- C56 H76 N12 O4 -","4","1","KP6052","Ju-Zhen Yuan; Yang-Gen Hu; Jia-Jia Wei; Ming-Wu Ding","(<i>E</i>)-3-Isopropyl-5,5-dimethyl-2-(phenylimino)imidazolidin-4-one","Acta Crystallographica Section E","2005","61","8","o2640","o2641","10.1107/S1600536805022749","","","0.71073","MoKα","","0.0428","0.0389","","","0.1002","0.1027","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206478","9.7926","0.0004","14.6633","0.0007","11.6359","0.0004","90","","100.576","0.002","90","","1642.44","0.12","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-3-Methoxyacetophenone 2,4,6-trinitrophenylhydrazone","","- C15 H13 N5 O7 -","- C15 H13 N5 O7 -","- C60 H52 N20 O28 -","4","1","KP6053","Zheng Fan; Shang Shan; Duan-Jun Xu","(<i>E</i>)-3-Methoxyacetophenone 2,4,6-trinitrophenylhydrazone","Acta Crystallographica Section E","2005","61","8","o2758","o2760","10.1107/S1600536805023949","","","0.71073","MoKα","","0.087","0.052","","","0.121","0.134","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206479","9.713","0.002","12.025","0.003","35.703","0.003","90","","94.23","0.03","90","","4158.7","1.4","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Trimethoprim dipicolinate pentahydrate","(2,4-diamino-5-(3',4',5'-trimethoxybenzyl)pyrimidinium dipicolinate pentahydrate","","- C35 H51 N9 O15 -","- C35 H51 N9 O15 -","- C140 H204 N36 O60 -","4","1","LH6416","Madhukar Hemamalini; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Hydrogen-bonding patterns in bis(trimethoprim) dipicolinate pentahydrate","Acta Crystallographica Section E","2005","61","8","o2368","o2371","10.1107/S1600536805020167","","","0.71069","MoKa","","0.1425","0.0574","","","0.1294","0.1595","","","","","","0.958","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206480","10.212","0.003","10.051","0.002","16.611","0.003","90","","90","","90","","1705","0.7","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Propyl 3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine-1-carboxylate","","- C18 H18 N4 O2 -","- C18 H18 N4 O2 -","- C72 H72 N16 O8 -","4","1","LH6426","Guo-Wu Rao; Wei-Xiao Hu","Propyl 3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine-1-carboxylate","Acta Crystallographica Section E","2005","61","8","o2431","o2432","10.1107/S1600536805019653","","","0.71073","MoKα","","0.0835","0.0356","","","0.0895","0.1055","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206481","14.4162","0.0016","8.5691","0.001","17.0016","0.0019","90","","105.365","0.001","90","","2025.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-Azido-3,3-dimethyl-2-oxo-1-thia-4,6-diazaindan 1,1-dioxide","","- C7 H7 N5 O3 S -","- C7 H7 N5 O3 S -","- C56 H56 N40 O24 S8 -","8","1","LH6452","Li Tian; Da-Xiang Wang","5-Azido-3,3-dimethyl-2-oxo-1-thia-4,6-diazaindan 1,1-dioxide","Acta Crystallographica Section E","2005","61","8","o2518","o2519","10.1107/S1600536805021781","","","0.71073","MoKα","","0.0336","0.0297","","","0.0838","0.0871","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206482","5.57","0.002","7.943","0.003","22.953","0.007","82.82","0.03","85.05","0.03","89.55","0.03","1003.8","0.6","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","1,10-Bis(phenylthio)decane","","- C22 H30 S2 -","- C22 H30 S2 -","- C44 H60 S4 -","2","1","LH6453","Awaleh, Mohamed Osman; Badia, Antonnella; Brisse, François","1,10-Bis(phenylsulfanyl)decane","Acta Crystallographica Section E","2005","61","8","o2473","o2475","10.1107/S1600536805020180","","","1.54178","CuKα","","0.0701","0.0499","","","0.1374","0.1465","","","","","","0.914","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206483","6.7577","0.0019","8.799","0.003","9.89","0.004","83.17","0.04","76.17","0.03","71.1","0.03","539.7","0.3","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","3-[(Z)-1-hydroxy-3-oxobutenyl]-2H-chromen-2-one","","- C13 H10 O4 -","- C13 H10 O4 -","- C26 H20 O8 -","2","1","LH6456","Xiangshan Wang; Zhaosen Zeng; Yuling Li; Daqing Shi","Redetermination of 3-[(<i>Z</i>)-1-hydroxy-3-oxobutenyl]-2<i>H</i>-chromen-2-one at 193 K","Acta Crystallographica Section E","2005","61","8","o2599","o2601","10.1107/S1600536805022361","","","0.7107","MoKα","","0.0776","0.0583","","","0.1526","0.1703","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206484","5.8654","0.0001","7.5638","0.0001","14.0472","0.0002","90","","97.6","0.001","90","","617.726","0.016","220","2","220","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2-Bis(phenylthio)ethane","","- C14 H14 S2 -","- C14 H14 S2 -","- C28 H28 S4 -","2","0.5","LH6460","Awaleh, Mohamed Osman; Badia, Antonnella; Brisse, François","1,2-Bis(phenylsulfanyl)ethane","Acta Crystallographica Section E","2005","61","8","o2479","o2481","10.1107/S1600536805020192","","","1.54178","CuKα","","0.0379","0.0361","","","0.1055","0.1074","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206485","5.627","0.002","7.862","0.003","18.486","0.006","94.55","0.03","91.36","0.03","90.46","0.03","815","0.5","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","1,6-Bis(phenylsulfanyl)hexane","","- C18 H22 S2 -","- C18 H22 S2 -","- C36 H44 S4 -","2","1","LH6461","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","1,6-Bis(phenylsulfanyl)hexane","Acta Crystallographica Section E","2005","61","8","o2476","o2478","10.1107/S1600536805020465","","","1.54178","CuKα","","0.1076","0.0359","","","0.0584","0.0684","","","","","","0.663","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206486","4.783","0.0005","21.54","0.002","7.7599","0.0008","90","","105.911","0.002","90","","768.84","0.13","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","α-lactose monohydrate","α-4-O-(β-D-galactopyranosido)-D-glucopyranose","","- C12 H24 O12 -","- C12 H24 O12 -","- C24 H48 O24 -","2","1","LH6465","Smith, Joanne H.; Dann, Sandra E.; Elsegood, Mark R. J.; Dale, Sophie H.; Blatchford, Chris. G","α-Lactose monohydrate: a redetermination at 150 K","Acta Crystallographica Section E","2005","61","8","o2499","o2501","10.1107/S1600536805021367","","","0.71073","MoKα","","0.0385","0.0332","","","0.0762","0.0788","","","","","","1.104","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206487","21.6122","0.0008","5.0393","0.0002","12.7868","0.0005","90","","90","","90","","1392.61","0.09","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","2-Nitrobenzaldehyde 2-iodobenzoylhydrazone","","- C14 H10 I N3 O3 -","- C14 H10 I N3 O3 -","- C56 H40 I4 N12 O12 -","4","1","LH6467","Glidewell, Christopher; Low, John N.; Wardell, James L.","2-Nitrobenzaldehyde 2-iodobenzoylhydrazone","Acta Crystallographica Section E","2005","61","8","o2438","o2440","10.1107/S1600536805021355","","","0.71073","MoKα","","0.0306","0.0257","","","0.0514","0.0535","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206488","8.6831","0.0004","9.8249","0.0005","9.6824","0.0005","90","","110.766","0.002","90","","772.35","0.07","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1,2,3-Tri-O-acetyl-5-deoxy-5-methylthio-β-D-ribofuranose","","- C12 H18 O7 S -","- C12 H18 O7 S -","- C24 H36 O14 S2 -","2","1","LH6468","Jeckelmann, Jean-Marc; Lüthi Nyffeler, Therese; Altmann, Michael; Bürgi, Hans-Beat; Renaud, Philippe; Hauser, Jürg","1,2,3-Tri-<i>O</i>-acetyl-5-deoxy-5-methylthio-β-<small>D</small>-ribofuranose","Acta Crystallographica Section E","2005","61","8","o2689","o2690","10.1107/S1600536805022683","","","0.71073","MoKα","","0.0516","0.0351","","","0.0802","0.0866","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206489","6.748","0.0013","6.9559","0.0013","23.45","0.004","90","","90","","90","","1100.7","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Synepherine hydrochloride","2-hydroxy-2-(4-hydroxyphenyl)-N-methylethanaminium chloride","","- C9 H14 Cl N O2 -","- C9 H14 Cl N O2 -","- C36 H56 Cl4 N4 O8 -","4","1","LH6469","Muhammad Sajid; M. Iqbal Choudhary; Atta-ur-Rahman; Masood Parvez; Ietidal Eltahir Mohamed; Shazia Anjum","Absolute configuration of (<i>R</i>)-synephrine hydrochloride","Acta Crystallographica Section E","2005","61","8","o2534","o2536","10.1107/S160053680502180X","","","0.71073","MoKα","","0.097","0.067","","","0.109","0.12","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206490","8.256","0.003","10.219","0.005","11.053","0.005","90","","111.09","0.002","90","","870.1","0.7","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","tert-Butylamidodichlorophosphine oxide","tert-Butylamidodichlorophosphine oxide","","- C4 H10 Cl2 N O P -","- C4 H10 Cl2 N O P -","- C16 H40 Cl8 N4 O4 P4 -","4","1","LH6470","Chivers, Tristram; Grebinski, James; Parvez, Masood; Fu, Zhiyong","<i>tert</i>-Butylamidodichlorophosphine oxide","Acta Crystallographica Section E","2005","61","8","o2491","o2492","10.1107/S1600536805021495","","","0.71073","MoKα","","0.078","0.059","","","0.155","0.165","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206491","9.5877","0.0005","9.8541","0.0005","11.705","0.0004","105.982","0.002","103.57","0.002","108.433","0.002","943.75","0.08","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","3-tert-butyl-4-(4-nitrophenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridine","","- C22 H20 N4 O2 -","- C22 H20 N4 O2 -","- C44 H40 N8 O4 -","2","1","LH6471","Abonia, Rodrigo; Rengifo, Emerson; Cobo, Justo; Low, John N.; Glidewell, Christopher","3-<i>tert</i>-Butyl-4-(4-nitrophenyl)-1-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine","Acta Crystallographica Section E","2005","61","8","o2625","o2627","10.1107/S160053680502177X","","","0.71073","MoKα","","0.1093","0.0572","","","0.1176","0.1368","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206492","7.7798","0.0001","11.0645","0.0002","15.4006","0.0003","85.256","0.001","82.988","0.001","88.068","0.001","1310.88","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","trans-Dichlorobis[(phenylsulfanyl)methane-κS]palladium(II)","","- C26 H24 Cl2 Pd S4 -","- C26 H24 Cl2 Pd S4 -","- C52 H48 Cl4 Pd2 S8 -","2","1","LH6472","Awaleh, Mohamed Osman; Badia, Antonnella; Brisse, François","<i>trans</i>-Dichlorobis[(phenylsulfanyl)methane-κ<i>S</i>]palladium(II)","Acta Crystallographica Section E","2005","61","8","m1586","m1587","10.1107/S160053680502235X","","","1.54178","CuKα","","0.0428","0.0399","","","0.1045","0.1061","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206493","10.4449","0.0004","10.912","0.0005","20.9707","0.0009","81.311","0.001","80.278","0.001","73.004","0.001","2239.76","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Poly[[bis[(dimethyl sulfoxide)zinc(II)]-di-μ~4~-benzene-1,4-dicarboxylato] dimethyl sulfoxide pentasolvate]","","- C30 H50 O15 S7 Zn2 -","- C30 H50 O15 S7 Zn2 -","- C60 H100 O30 S14 Zn4 -","2","1","LH6473","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Poly[[bis[(dimethyl sulfoxide)zinc(II)]-di-μ~4~-benzene-1,4-dicarboxylato] dimethyl sulfoxide pentasolvate]","Acta Crystallographica Section E","2005","61","8","m1671","m1673","10.1107/S1600536805023986","","","0.71073","MoKα","","0.049","0.045","","","0.118","0.121","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206495","3.605","0.002","9.445","0.004","9.653","0.004","90","","90","","90","","328.7","0.3","297","1","297","1","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Al2 O5 Ti -","- Al2 O5 Ti -","- Al8 O20 Ti4 -","4","0.25","MG6041","Stefan T. Norberg; Nobuo Ishizawa; Stefan Hoffmann; Masahiro Yoshimura","Redetermination of β-Al~2~TiO~5~ obtained by melt casting","Acta Crystallographica Section E","2005","61","8","i160","i162","10.1107/S1600536805021331","","","0.71073","MoKα","","0.03","0.028","","0.029","0.028","0.028","","","1.093","","","1.112","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206496","18.012","0.005","5.356","0.005","12.937","0.005","90","","108.786","0.005","90","","1181.6","1.2","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H12 N4 O5 -","- C9 H12 N4 O5 -","- C36 H48 N16 O20 -","4","1","NC6036","Joussef, Antonio C.; Silva, Liuz Everson da; Bortoluzzi, Adailton J.; Foro, Sabine","2,2-Dimethyl-5-(4<i>H</i>-1,2,4-triazol-4-ylaminomethylene)-1,3-dioxane-4,6-dione monohydrate","Acta Crystallographica Section E","2005","61","8","o2642","o2643","10.1107/S1600536805022750","","","0.71069","MoKα","","0.0689","0.0379","","","0.0908","0.1029","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206497","18.363","0.004","5.2852","0.0014","12.509","0.002","90","","90","","90","","1214","0.5","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","(2-Chloroanilino)acetophenone","","- C14 H12 Cl N O -","- C14 H12 Cl N O -","- C56 H48 Cl4 N4 O4 -","4","1","NC6038","Anilkumar, Haleyur G.; Yathirajan, Hemmige S.; Nagaraja, Padmarajaiah; Bolte, Michael","(2-Chloroanilino)acetophenone","Acta Crystallographica Section E","2005","61","8","o2551","o2552","10.1107/S1600536805022051","","","0.71073","MoKα","","0.0615","0.05","","","0.1341","0.1457","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206498","6.9881","0.0006","8.9148","0.0006","16.6251","0.001","98.91","0.005","95.882","0.006","112.244","0.006","932.24","0.13","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","N,N'-Dimethylpiperazinium(2+) bis[methylenehydrogendiphosphonate(1-)]","","- C8 H26 N2 O12 P4 -","- C8 H26 N2 O12 P4 -","- C16 H52 N4 O24 P8 -","2","1","NC6040","Yuan, Zhan-Hui; Clegg, William","<i>N</i>,<i>N</i>'-Dimethylpiperazinium(2+) bis[methylenehydrogendiphosphonate(1{-})]","Acta Crystallographica Section E","2005","61","8","o2635","o2637","10.1107/S1600536805022737","","","0.71073","MoKα","","0.0344","0.0276","","","0.0711","0.0746","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206499","8.7063","0.0012","14.7402","0.0016","24.965","0.002","90","","90","","90","","3203.8","0.6","292","1","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","catena-Poly[[[(acetonitrile-κN)silver(I)]-μ-[bis(pyrimidin-2- ylsulfanyl)methane-κ^2^N^1^:N^1'^] tetrafluoroborate]","","- C11 H11 Ag B F4 N5 S2 -","- C11 H11 Ag B F4 N5 S2 -","- C88 H88 Ag8 B8 F32 N40 S16 -","8","1","NG6148","Hou, Bao-Hong; Zhou, Li-Na; Wei, Hong-Yuan; Wang, Jing-Kang; Chen, Wei","<i>catena</i>-Poly[[[(acetonitrile-κ<i>N</i>)silver(I)]-μ-bis(pyrimidin-2-ylsulfanyl)methane-κ^2^<i>N</i>^1^:<i>N</i>^1'^] tetrafluoroborate]","Acta Crystallographica Section E","2005","61","8","m1658","m1659","10.1107/S1600536805019288","","","0.71073","MoKα","","0.0696","0.0431","","","0.1059","0.1273","","","","","","1.181","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206500","6.5799","0.0006","27.775","0.003","7.0321","0.0006","90","","103.19","0.004","90","","1251.3","0.2","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ-N,N'-bis(pyridin-4-ylmethylene)hydrazine- bis[diaqua(iminodiacetato)copper(II)]","","- C20 H28 Cu2 N6 O12 -","- C20 H28 Cu2 N6 O12 -","- C40 H56 Cu4 N12 O24 -","2","0.5","NG6155","Kundu, Nabanita; Chatterjee, Pabitra Baran; Chaudhury, Muktimoy; Tiekink, Edward R. T.","A binuclear iminodiacetato‒copper(II) complex with the <i>N</i>,<i>N</i>'-bis(pyridin-4-ylmethylene)hydrazine ligand as spacer","Acta Crystallographica Section E","2005","61","8","m1583","m1585","10.1107/S1600536805021549","","","0.71069","MoKα","","0.076","0.047","","","0.105","0.116","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206501","10.328","0.001","7.732","0.001","23.656","0.002","90","","114.38","0.01","90","","1720.6","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis(3-methylsalicylidene)propane-1,3-diaminato]copper(II)","","- C19 H20 Cu N2 O2 -","- C19 H20 Cu N2 O2 -","- C76 H80 Cu4 N8 O8 -","4","1","NG6159","You, Zhong-Lu","[<i>N</i>,<i>N</i>'-Bis(3-methylsalicylidene)propane-1,3-diaminato]copper(II)","Acta Crystallographica Section E","2005","61","8","m1559","m1560","10.1107/S1600536805021823","","","0.71073","MoKα","","0.1257","0.0666","","","0.1453","0.1749","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206502","8.2351","0.0003","25.3931","0.0008","8.654","0.0003","90","","104.851","0.001","90","","1749.23","0.1","295","3","295","3","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tris(1H-imidazole-κN^3^)(thiodiacetato-κ^3^O,S,O')nickel(II) monohydrate","","- C13 H18 N6 Ni O5 S -","- C13 H18 N6 Ni O5 S -","- C52 H72 N24 Ni4 O20 S4 -","4","1","NG6161","Tian-Tian Pan; Jian-Rong Su; Duan-Jun Xu","Tris(1<i>H</i>-imidazole-κ<i>N</i>^3^)(thiodiacetato-κ^3^<i>O</i>,<i>S</i>,<i>O</i>')nickel(II) monohydrate","Acta Crystallographica Section E","2005","61","8","m1576","m1578","10.1107/S160053680502194X","","","0.71073","MoKα","","0.06","0.049","","","0.107","0.111","","","","","","1.177","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206503","15.0412","0.0001","12.5376","0.0001","23.243","0.0002","90","","103.191","0.001","90","","4267.53","0.06","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Nonacarbonyl-μ~3~N,N-diethyldithiocarbamato-κ^3^S:S:S'-μ-hydrido- triosmium(3 Os—Os)","","- C14 H11 N O9 Os3 S2 -","- C14 H11 N O9 Os3 S2 -","- C112 H88 N8 O72 Os24 S16 -","8","2","NG6168","Garcia-Orozco, Ivan; Pastor, Cesar J.; Souto, Beatriz; Delgado, Esther; Hernández, Elisa; Alvarez-Toledano, Cecilio","Nonacarbonyl-μ~3~-<i>N</i>,<i>N</i>-diethyldithiocarbamato-κ^3^<i>S</i>:<i>S</i>:<i>S</i>'-μ-hydrido-triosmium(3 <i>Os</i>—<i>Os</i>)","Acta Crystallographica Section E","2005","61","8","m1644","m1645","10.1107/S160053680502338X","","","1.54178","CuKα","","0.0298","0.0283","","","0.0658","0.0668","","","","","","1.18","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206504","5.7135","0.0005","12.6191","0.001","17.1549","0.0014","90","","90","","90","","1236.86","0.18","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Methylphenyl benzyl sulfone","","- C14 H14 O2 S -","- C14 H14 O2 S -","- C56 H56 O8 S4 -","4","1","OB6530","Yong-Shu Li; Wei-Ke Su","4-Methylphenyl benzyl sulfone","Acta Crystallographica Section E","2005","61","8","o2450","o2451","10.1107/S1600536805021434","","","0.71073","MoKα","","0.0348","0.0332","","","0.0847","0.0857","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206505","8.652","0.002","19.808","0.009","20.934","0.004","90","","90","","90","","3588","2","295","2","295","2","","","","","","","","5","F 2 d d","F -2d 2","43","","","","- C5 H11 N O5 S -","- C5 H11 N O5 S -","- C80 H176 N16 O80 S16 -","16","1","OB6532","Wei Zhou; Chun-Nian Xia; Wen Feng; Wei-Xiao Hu","2-Methyl-2-nitropropyl methanesulfonate","Acta Crystallographica Section E","2005","61","8","o2523","o2524","10.1107/S160053680501799X","","","0.71073","MoKα","","0.0319","0.027","","","0.0747","0.0781","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206506","4.01","0.001","14.829","0.005","6.111","0.002","90","","93.274","0.002","90","","362.79","0.19","123.1","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C7 H4 Br2 O -","- C7 H4 Br2 O -","- C14 H8 Br4 O2 -","2","0.5","OB6539","Kubo, Kanji; Matsumoto, Taisuke; Mori, Akira","2,7-Dibromo-2,4,6-cycloheptatrien-1-one (2,7-dibromotropone)","Acta Crystallographica Section E","2005","61","8","o2542","o2544","10.1107/S1600536805020210","","","0.7107","MoKα","","","0.019","","","","0.047","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206507","17.9107","0.0008","11.2522","0.0003","18.9011","0.0007","90","","121.181","0.001","90","","3258.9","0.2","295","1","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C17 H19 N5 -","- C17 H19 N5 -","- C136 H152 N40 -","8","1","OB6540","Tang, Gu-Ping; Gu, Jian-Ming","2-[3-(2-Cyano-2-propyl)-5-(1,2,4-triazol-1-yl)phenyl]-2-methylpropiononitrile","Acta Crystallographica Section E","2005","61","8","o2330","o2331","10.1107/S1600536805020143","","","0.7107","MoKα","","","0.063","","","","0.203","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206508","8.3372","0.0008","9.0754","0.0008","10.1261","0.0009","99.709","0.001","114.142","0.001","104.871","0.001","642.4","0.1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Tetrakis(2-thiopyridone)platinum(II) dichloride","","- C20 H20 Cl2 N4 Pt S4 -","- C20 H20 Cl2 N4 Pt S4 -","- C20 H20 Cl2 N4 Pt S4 -","1","0.5","OB6541","Mizota, Mina; Yokoyama, Yoshimi; Sakai, Ken","Tetrakis[pyridine-2(1<i>H</i>)-thione-κ<i>S</i>]platinum(II) dichloride","Acta Crystallographica Section E","2005","61","8","m1433","m1435","10.1107/S1600536805020209","","","0.71073","MoKα","","0.0192","0.0186","","","0.0407","0.0408","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206509","9.9393","0.0011","12.778","0.0014","13.989","0.0015","64.306","0.008","80.219","0.009","87.01","0.009","1577.3","0.3","93.1","","","","","","","","","","","4","P -1","-P 1","2","","n-Propyl gallate‒chloroform (3/0.5)","","- C30.5 H36.5 Cl1.5 O15 -","- C30.5 H36.5 Cl1.5 O15 -","- C61 H73 Cl3 O30 -","2","1","OB6542","Iwata, Shohei; Hitachi, Akio; Makino, Takashi; Mizuguchi, Jin","<i>n</i>-Propyl gallate‒chloroform (3/0.5)","Acta Crystallographica Section E","2005","61","8","o2587","o2589","10.1107/S1600536805022154","","","1.5418","CuKα","","","0.063","","","","0.201","","","","","","1.428","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2206510","8.5884","0.0011","11.3727","0.0013","12.553","0.0014","67.648","0.009","74.069","0.01","81.488","0.011","1089.1","0.2","93.1","","","","","","","","","","","4","P -1","-P 1","2","","n-Propyl gallate‒acetonitrile (2/1)","","- C22 H27 N O10 -","- C22 H27 N O10 -","- C44 H54 N2 O20 -","2","1","OB6543","Mizuguchi, Jin; Hitachi, Akio; Iwata, Shohei; Makino, Takashi","<i>n</i>-Propyl gallate‒acetonitrile (2/1)","Acta Crystallographica Section E","2005","61","8","o2593","o2595","10.1107/S1600536805022166","","","1.5418","CuKα","","","0.0471","","","","0.1339","","","","","","1.888","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206511","9.9439","0.0012","12.8538","0.0016","13.841","0.0017","63.311","0.01","80.168","0.011","86.706","0.011","1557","0.4","93.1","","","","","","","","","","","4","P -1","-P 1","2","","n-Propyl gallate‒dichloromethane (3/0.5)","","- C30.5 H37 Cl O15 -","- C30.5 H37 Cl O15 -","- C61 H74 Cl2 O30 -","2","1","OB6544","Hitachi, Akio; Makino, Takashi; Iwata, Shohei; Mizuguchi, Jin","<i>n</i>-Propyl gallate‒dichloromethane (3/0.5)","Acta Crystallographica Section E","2005","61","8","o2590","o2592","10.1107/S1600536805022178","","","1.5418","CuKα","","","0.045","","","","0.134","","","","","","1.051","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2206512","20.843","0.003","11.964","0.001","9.983","0.001","90","","90","","90","","2489.4","0.5","293","2","293","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","catena-Poly[[[tripyridinecopper(II)]-μ-m-phenylenedioxydiacetato] monohydrate]","","- C25 H25 Cu N3 O7 -","- C25 H25 Cu N3 O7 -","- C100 H100 Cu4 N12 O28 -","4","0.5","OB6545","Hong, Xian-Lan; Li, Yi-Zhi; Jiang, Guo-Qing; Bai, Jun-Feng","<i>catena</i>-Poly[[[tripyridinecopper(II)]-μ-<i>m</i>-phenylenedioxydiacetato] monohydrate]","Acta Crystallographica Section E","2005","61","8","m1556","m1558","10.1107/S1600536805021550","","","0.71073","MoKα","","0.0762","0.0507","","","0.128","0.1318","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206513","9.605","0.0019","10.767","0.002","13.374","0.003","90","","104.36","0.03","90","","1339.9","0.5","288","2","288","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Benzoylmethylene-1-methyl-3,4-dihydroquinoxalin-2(1H)-one","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C68 H56 N8 O8 -","4","1","OB6546","Yun Liu; Zhi-Feng Lu; Yong-Miao Shen; Jian-Hua Xu","3-Benzoylmethylene-1-methyl-3,4-dihydroquinoxalin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2753","o2754","10.1107/S1600536805023664","","","0.71073","MoKα","","0.1004","0.0457","","","0.0958","0.1074","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206514","3.7819","0.0011","5.8314","0.0016","16.754","0.004","94.956","0.016","95.136","0.017","90.66","0.018","366.56","0.17","93.1","","","","","","","","","","","5","P -1","-P 1","2","","2,9-Dichloro-5,12-dihydroquino[2,3-b]acridine-7,14-dione","","- C20 H10 Cl2 N2 O2 -","- C20 H10 Cl2 N2 O2 -","- C20 H10 Cl2 N2 O2 -","1","0.5","OB6549","Senju, Takatoshi; Nishimura, Naoko; Hoki, Tomonori; Mizuguchi, Jin","2,9-Dichloro-5,12-dihydroquino[2,3-<i>b</i>]acridine-7,14-dione (red phase)","Acta Crystallographica Section E","2005","61","8","o2596","o2598","10.1107/S1600536805022257","","","1.5418","CuKα","","","0.0564","","","","0.1784","","","","","","1.141","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206515","9.8855","0.0007","9.8856","0.0007","20.3477","0.0014","90","","90","","90","","1988.5","0.2","292","2","292","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1R,2R,2'S)-2-(4-Methylphenylsulfonamido)-1-(pyrrolidine-2'- carboxamido)cyclohexane","","- C18 H27 N3 O3 S -","- C18 H27 N3 O3 S -","- C72 H108 N12 O12 S4 -","4","1","OB6551","Xinyong Li; Jiarong Chen; Xianggao Meng; Wenjing Xiao","(1<i>R</i>,2<i>R</i>,2'<i>S</i>)-2-(4-Methylphenylsulfonamido)-1-(pyrrolidine-2'-carboxamido)cyclohexane","Acta Crystallographica Section E","2005","61","8","o2730","o2732","10.1107/S1600536805023718","","","0.71073","MoKα","","0.0829","0.0562","","","0.0891","0.1006","","","","","","0.945","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206516","8.1512","0.0005","12.4991","0.0006","18.928","0.001","100.708","0.001","96.0057","0.0008","94.896","0.003","1873.59","0.18","295","1","","","","","","","","","","5","P -1","-P 1","2","","4-[4-Dimethylamino-1-(4-fluorophenyl)-1-hydroxybutyl]-3- (hydroxymethyl)benzonitrile","","- C20 H23 F N2 O2 -","- C20 H23 F N2 O2 -","- C80 H92 F4 N8 O8 -","4","2","OB6553","Jian-Ming Gu; Yun-Wu Wang; Xiu-Rong Hu","4-[4-Dimethylamino-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile","Acta Crystallographica Section E","2005","61","8","o2691","o2693","10.1107/S1600536805023032","","","0.7107","MoKα","","","0.056","","","","0.169","","","","","","1.002","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206517","9.0105","0.0009","12.633","0.003","13.717","0.003","64.45","0.03","73.85","0.03","88.61","0.03","1344.8","0.6","293","","293","","","","","","","","","5","P -1","-P 1","2","","N,N'-Butanedioylbis(5-ferrocenyl-3-methyl-1H-pyrazole)","","- C32 H30 Fe2 N4 O2 -","- C32 H30 Fe2 N4 O2 -","- C64 H60 Fe4 N8 O4 -","2","1","OM6240","Yao-Cheng Shi; Chun-Xia Sui; Hong-Jian Cheng","<i>N</i>,<i>N</i>'-Butanedioylbis(5-ferrocenyl-3-methyl-1<i>H</i>-pyrazole)","Acta Crystallographica Section E","2005","61","8","m1563","m1565","10.1107/S1600536805021768","","","0.71073","MoKα","","0.0772","0.0614","","","0.194","0.2068","","","","","","0.928","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206518","9.58","0.003","10.015","0.001","10.67","0.002","77.38","0.01","85.68","0.02","73.55","0.01","958","0.4","299","2","299","2","","","","","","","","3","P -1","-P 1","2","","trans-4-Phenyl-3-tetrahydropyranol","","- C11 H14 O2 -","- C11 H14 O2 -","- C44 H56 O8 -","4","2","OM6243","Hartung, Jens; Svoboda, Ingrid; Schmidt, Philipp; Fuess, Hartmut","Racemic <i>trans</i>-4-phenylperhydropyran-3-ol","Acta Crystallographica Section E","2005","61","8","o2395","o2397","10.1107/S1600536805020222","","","0.71073","MoKα","","0.1647","0.0616","","","0.1506","0.2084","","","","","","0.903","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206519","8.5227","0.0007","33.412","0.003","12.2415","0.001","90","","93.702","0.002","90","","3478.6","0.5","292","2","292","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H38 Cl2 Cu2 F2 N6 O13 -","- C25 H38 Cl2 Cu2 F2 N6 O13 -","- C100 H152 Cl8 Cu8 F8 N24 O52 -","4","1","OM6245","Lei Chen; Hong Zhou; Zhiquan Pan; Xuelei Hu; Bo Liu","Bis[μ-4-fluoro-6-hydroxymethyl-2-(2,5,8-triazaoct-1-enyl)phenolato]dicopper(II) bis(perchlorate) methanol solvate","Acta Crystallographica Section E","2005","61","8","m1467","m1469","10.1107/S1600536805020234","","","0.71073","MoKα","","0.0679","0.0466","","","0.0975","0.1037","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206520","25.317","0.005","13.762","0.003","11.542","0.002","90","","114.26","0.03","90","","3666.3","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-(Isothiocyanato-κN)phenylbis(triphenylphosphine-κP)platinum(II)","","- C43 H35 N P2 Pt S -","- C43 H35 N P2 Pt S -","- C172 H140 N4 P8 Pt4 S4 -","4","0.5","OM6249","Otto, Stefanus; Roodt, Andreas","<i>trans</i>-(Isothiocyanato-κ<i>N</i>)phenylbis(triphenylphosphine-κ<i>P</i>)platinum(II)","Acta Crystallographica Section E","2005","61","8","m1545","m1547","10.1107/S1600536805021756","","","0.71073","MoKα","","0.0983","0.0389","","","0.0682","0.0789","","","","","","0.873","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206521","13.878","0.001","13.878","0.001","60.239","0.007","90","","90","","120","","10047.6","1.6","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","Tetra-μ~3~iodo-tetrakis[(tri-tert-butylphosphine)copper(I)]","","- C48 H108 Cu4 I4 P4 -","- C48 H108 Cu4 I4 P4 -","- C288 H648 Cu24 I24 P24 -","6","0.333333","OM6250","Medina, Iliana; Mague, Joel T.; Fink, Mark J.","Tetra-μ~3~-iodo-tetrakis[(tri-<i>tert</i>-butylphosphine)copper(I)]","Acta Crystallographica Section E","2005","61","8","m1550","m1552","10.1107/S1600536805021744","","","0.71073","MoKα","","0.0318","0.027","","","0.0551","0.0566","","","","","","1.105","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206522","11.7224","0.0009","15.1064","0.0012","15.2183","0.0011","117.583","0.001","95.397","0.002","103.732","0.001","2254.3","0.3","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Diaqua-κ^2^O-tris(1,10-phenanthroline)-1κ^2^N,N';2κ^4^N,N'- μ-5-sulfonatoisophthalato-1:2κ^4^O^1^,O^1'^:O^3^,O^3'^-dicopper(II) perchlorate trihydrate","","- C44 H37 Cl Cu2 N6 O16 S -","- C44 H37 Cl Cu2 N6 O16 S -","- C88 H74 Cl2 Cu4 N12 O32 S2 -","2","1","RN6053","Wei-Dong Wang; Xin-Hua Li","Diaqua-κ^2^<i>O</i>-tris(1,10-phenanthroline)-1κ^2^<i>N</i>,<i>N</i>';2κ^4^<i>N</i>,<i>N</i>'-μ-5-sulfonatoisophthalato-1:2κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^3^,<i>O</i>^3'^-dicopper(II) perchlorate trihydrate","Acta Crystallographica Section E","2005","61","8","m1534","m1536","10.1107/S1600536805021641","","","0.71073","MoKα","","0.0854","0.0651","","","0.1469","0.1583","","","","","","1.058","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206523","8.3481","0.0015","17.667","0.003","9.9401","0.0018","90","","108.86","0.003","90","","1387.3","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Chloro-6-morpholino-1,3,5-triazin-2-yl)aniline","","- C13 H14 Cl N5 O -","- C13 H14 Cl N5 O -","- C52 H56 Cl4 N20 O4 -","4","1","RN6054","Li, Yang; Ding, Li; Zeng, Tao; Li, Jiang-Sheng; Dong, Chuan-Ming; Yan, Xi-Long","<i>N</i>-(4-Chloro-6-morpholino-1,3,5-triazin-2-yl)aniline","Acta Crystallographica Section E","2005","61","8","o2345","o2346","10.1107/S1600536805020040","","","0.71073","MoKα","","0.0742","0.0387","","","0.0875","0.104","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206524","8.1306","0.0009","9.7446","0.0011","15.7357","0.0018","90","","90","","90","","1246.7","0.2","292","2","292","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-(2-Methylpropyl)-1H-imidazo[4,5-c]quinolin-4-amine","","- C14 H16 N4 -","- C14 H16 N4 -","- C56 H64 N16 -","4","1","RN6056","Jing Cheng; Zuming liu; Guangfu Yang","1-(2-Methylpropyl)-1<i>H</i>-imidazo[4,5-<i>c</i>]quinolin-4-amine","Acta Crystallographica Section E","2005","61","8","o2638","o2639","10.1107/S1600536805022579","","","0.71073","MoKα","","0.0558","0.0467","","","0.1094","0.1149","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206525","12.924","0.004","8.644","0.003","21.25","0.005","90","","103.25","0.02","90","","2310.7","1.2","173.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 Cl4 N3 O6 S2 -","- C16 H21 Cl4 N3 O6 S2 -","- C64 H84 Cl16 N12 O24 S8 -","4","1","RZ6063","Lee, Jianchao; Takahashi, Hiroki; Matsui, Yoshihiko; Hori, Toshitaka","Iminodiethylenediaminium bis(2,5-dichlorobenzenesulfonate)","Acta Crystallographica Section E","2005","61","8","o2403","o2405","10.1107/S1600536805013711","","","0.71073","MoKα","","0.0382","0.0315","","","0.0319","0.0337","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206526","11.838","0.003","14.976","0.003","10.611","0.003","90","","95.996","0.004","90","","1870.9","0.8","294","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(5-((1H-1,2,4-Triazol-1-yl)methyl)-4-phenyl-4H-1,2,4-triazol-3-ylthio)-1-(4- fluorophenyl)ethanone","","- C19 H15 F N6 O S -","- C19 H15 F N6 O S -","- C76 H60 F4 N24 O4 S4 -","4","1","RZ6095","Xu, Liang-Zhong; Li, Kai; Liu, Jin-Hong; Zhou, Kai; Li, Wei-Hua; Hou, Bao-Rong","1-(4-Fluorophenyl)-2-{4-phenyl-5-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-4<i>H</i>-1,2,4-triazol-3-ylsulfanyl}ethanone","Acta Crystallographica Section E","2005","61","8","o2338","o2339","10.1107/S1600536805020301","","","0.71073","MoKα","","0.1004","0.0415","","","0.0813","0.1023","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206527","9.4761","0.0006","10.0886","0.0006","10.5018","0.0006","90","","111.697","0.006","90","","932.85","0.1","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-(+)-2-(2-biphenyl-2-yl-1-methylethyl)-4,5-dihydro-1H-imidazolium hydrogen oxalate","","- C20 H22 N2 O4 -","- C20 H22 N2 O4 -","- C40 H44 N4 O8 -","2","1","RZ6096","Giannella, Mario; Gentili, Francesco; Bruni, Bruno; Messori, Luigi; Di Vaira, Massimo","(<i>S</i>)-(+)-2-[2-(Biphenyl-2-yl)-1-methylethyl]-4,5-dihydro-1<i>H</i>-imidazolium hydrogen oxalate","Acta Crystallographica Section E","2005","61","8","o2376","o2378","10.1107/S1600536805020398","","","1.5418","CuKα","","0.0366","0.0346","","","0.0823","0.083","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206528","15.6032","0.0007","15.9227","0.0007","16.3694","0.0007","90","","90","","90","","4066.9","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","2,5-Dimethyl-7-phenylsulfonyl-5,6-dihydroindolo[2,3-c]benzazepin-12-one","","- C24 H20 N2 O3 S -","- C24 H20 N2 O3 S -","- C192 H160 N16 O24 S8 -","8","2","RZ6097","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","2,5-Dimethyl-7-phenylsulfonyl-5,6-dihydroindolo[2,3-<i>c</i>]benzazepin-12-one","Acta Crystallographica Section E","2005","61","8","o2410","o2412","10.1107/S1600536805020842","","","0.71073","MoKα","","0.0855","0.0506","","","0.1079","0.1231","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206529","33.177","0.002","9.085","0.0006","16.1712","0.001","90","","111.802","0.001","90","","4525.6","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","3-Bromo-2-(4-bromo-2,5-dimethoxybenzyl)-1-phenylsulfonyl-1H-indole","","- C23 H19 Br2 N O4 S -","- C23 H19 Br2 N O4 S -","- C184 H152 Br16 N8 O32 S8 -","8","1","RZ6098","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","3-Bromo-2-(4-bromo-2,5-dimethoxybenzyl)-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","8","o2455","o2457","10.1107/S1600536805021574","","","0.71073","MoKα","","0.0995","0.0443","","","0.0952","0.1162","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206530","9.826","0.004","13.596","0.002","11.99","0.005","90","","102.06","0.04","90","","1566.4","1","303","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(Acetylsulfanyl)pyridine N-oxide","","- C7 H7 N O3 S -","- C7 H7 N O3 S -","- C56 H56 N8 O24 S8 -","8","2","RZ6099","Samuel Robinson Jebas; Thailampillai Balasubramanian; Balasingh Ravidurai; Sudalaiandi Kumaresan","2-(Acetylsulfanyl)pyridine <i>N</i>-oxide","Acta Crystallographica Section E","2005","61","8","o2677","o2678","10.1107/S1600536805022415","","","0.71073","MoKα","","","0.052","","","","0.1496","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206531","6.7834","0.0014","17.953","0.004","15.247","0.003","90","","92.53","0.03","90","","1855","0.7","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,6-Bis(3,4,5-trimethylpyrazol-1-ylmethyl)pyridine","","- C19 H25 N5 -","- C19 H25 N5 -","- C76 H100 N20 -","4","1","RZ6100","Giuseppe Agrifoglio; Arquímedes R. Karam; Edgar L. Catarí; Teresa González; Reinaldo Atencio","2,6-Bis(3,4,5-trimethylpyrazol-1-ylmethyl)pyridine","Acta Crystallographica Section E","2005","61","8","o2613","o2616","10.1107/S1600536805022427","","","0.71073","MoKα","","0.2352","0.0938","","","0.2122","0.2954","","","","","","0.988","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206532","11.002","0.002","15.3","0.003","14.309","0.003","90","","94.28","0.03","90","","2401.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diisothiocyanatotetrakis(1-methyl-1H-imidazole-κN^3^)nickel(II)","","- C18 H24 N10 Ni S2 -","- C18 H24 N10 Ni S2 -","- C72 H96 N40 Ni4 S8 -","4","1","RZ6101","Fa-Qian Liu; Fang-Fang Jian; Guang-Ye Liu; Lu-De Lu; Xu-Jie Yang; Xin Wang","Diisothiocyanatotetrakis(1-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II)","Acta Crystallographica Section E","2005","61","8","m1568","m1570","10.1107/S1600536805021987","","","0.71073","MoKα","","0.1188","0.0515","","","0.1369","0.1623","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206533","8.3497","0.0001","23.039","0.0002","21.3683","0.0002","90","","93.342","0.001","90","","4103.6","0.07","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[silver(I)-μ~2~-1,1'-dimethyl-2,2'-biimidazole-κN^3^:N^3'^] nitrate 1.167-hydrate methanol 0.33-solvate]","","- C8.33 H13.33 Ag N3 O4.5 -","- C8.33333 H13.3333 Ag N5 O4.5 -","- C100 H160 Ag12 N60 O54 -","12","3","RZ6102","Letitia M. Gruia; Fernande D. Rochon; André L. Beauchamp","<i>catena</i>-Poly[[silver(I)-μ~2~-1,1'-dimethyl-2,2'-biimidazole-κ<i>N</i>^3^:<i>N</i>^3'^] nitrate 1.167-hydrate methanol 0.33-solvate]","Acta Crystallographica Section E","2005","61","8","m1604","m1606","10.1107/S1600536805023044","","","1.54178","CuKα","","0.0635","0.047","","","0.135","0.1447","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206534","7.181","0.005","8.069","0.005","13.015","0.005","90","","90","","90","","754.1","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4,5-Dimethoxycyclopent-4-ene-1,2,3-trione","","- C7 H6 O5 -","- C7 H6 O5 -","- C28 H24 O20 -","4","1","RZ6103","Chen, Hong-Yu; Fang, Qi; Xue, Gang; Yu, Wen-Tao","4,5-Dimethoxycyclopent-4-ene-1,2,3-trione","Acta Crystallographica Section E","2005","61","8","o2696","o2698","10.1107/S1600536805023068","","","0.71069","MoKα","","0.0883","0.0404","","","0.0905","0.1171","","","","","","0.944","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206535","10.658","0.002","17.943","0.004","16.618","0.006","90","","116.72","0.02","90","","2838.6","1.4","273","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[(diphenylphosphino)acetato-κ^2^O,P]palladium(II) dichloromethane solvate","","- C29 H26 Cl2 O4 P2 Pd -","- C29 H26 Cl2 O4 P2 Pd -","- C116 H104 Cl8 O16 P8 Pd4 -","4","1","RZ6104","Mengping Guo; Fangfang Jian; Ren He; Hailian Xiao","Bis[(diphenylphosphino)acetato-κ^2^<i>O</i>,<i>P</i>]palladium(II) dichloromethane solvate","Acta Crystallographica Section E","2005","61","8","m1635","m1636","10.1107/S160053680502341X","","","0.71073","MoKα","","0.0565","0.0483","","","0.0943","0.0975","","","","","","1.172","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206536","7.264","0.004","5.317","0.003","24.239","0.015","90","","93.158","0.01","90","","934.8","0.9","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[2-(diethylamino)ethyl]dithiooxalamide","","- C14 H30 N4 S2 -","- C14 H30 N4 S2 -","- C28 H60 N8 S4 -","2","0.5","RZ6106","Cui, Jian-Zhong; Zhang, Dan; Song, Li-Hui; Cheng, Peng; Liao, Dai-Zheng; Wang, Geng-Lin","<i>N</i>,<i>N</i>'-Bis[2-(diethylamino)ethyl]dithiooxalamide","Acta Crystallographica Section E","2005","61","8","o2714","o2715","10.1107/S1600536805023457","","","0.71073","MoKα","","0.1616","0.0682","","","0.1673","0.2144","","","","","","1.015","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206537","13.7005","0.0002","6.0509","0.0001","15.1789","0.0001","90","","103.155","0.001","90","","1225.31","0.03","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Benzoic acid derivative","2-(2-phenylethyl)benzoic acid","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","RZ6107","Anilkumar, H. G.; Yathirajan, H. S.; Narasimhamurthy, T.; Vijay, T.; Rathore, R. S.","Intermolecularly associated carboxylic acid dimers in the supramolecular assembly of 2-(2-phenylethyl)benzoic acid","Acta Crystallographica Section E","2005","61","8","o2704","o2705","10.1107/S1600536805023329","","","0.71073","MoKα","","0.0468","0.0381","","","0.108","0.1136","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206538","9.618","0.002","10.905","0.002","13.03","0.002","79.16","0.02","87.389","0.01","81.635","0.01","1327.7","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","Cr2-dibenzoylmethane","Di-μ-methoxo-κ^4^O:O-bis[bis(1,3-diphenylpropane-1,3-dionato- κ^2^O,O')chromium(III)]","","- C62 H50 Cr2 O10 -","- C62 H50 Cr2 O10 -","- C62 H50 Cr2 O10 -","1","0.5","RZ6108","Abbati, Gian Luca","Di-μ-methoxo-κ^4^<i>O</i>:<i>O</i>-bis[bis(1,3-diphenylpropane-1,3-dionato- κ^2^<i>O</i>,<i>O</i>')chromium(III)]","Acta Crystallographica, Section E","2005","61","8","o1655","o1657","10.1107/S1600536805023469","","","0.71073","MoKα","","0.1962","0.0553","","","0.1364","0.1927","","","","","","0.943","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2206539","10.1669","0.0016","10.9425","0.0016","13.651","0.0012","74.001","0.01","77.008","0.011","88.039","0.013","1421.9","0.3","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","2,3a-trans-1,3a-cis-1,2-Bis(4-chlorophenyl)-1',2',3'-trihydro-3a-hydroxy- benzo[e]bicyclo[3.3]octane-3-spiro-2'-indene-1'-one acetone solvate","","- C35 H30 Cl2 O3 -","- C35 H30 Cl2 O3 -","- C70 H60 Cl4 O6 -","2","1","RZ6109","Zheng-Yi Li; Da-Qing Shi; Chun-Ling Shi; Guo-Lan Dou","2,3a-<i>trans</i>-1,3a-<i>cis</i>-1,2-Bis(4-chlorophenyl)-1',2',3'-trihydro-3a-hydroxybenzo[<i>e</i>]bicyclo[3.3]octane-3-spiro-2'-indene-1'-one acetone solvate","Acta Crystallographica Section E","2005","61","8","o2709","o2711","10.1107/S1600536805023421","","","0.7107","MoKα","","0.0608","0.0473","","","0.1076","0.1148","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206540","33.0359","0.0002","33.0359","0.0002","9.0191","0.0003","90","","90","","120","","8524.4","0.3","110","2","110","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C43.22 H30.44 N8 O3.22 Zn -","- C43.22 H30.44 N8 O3.22 Zn -","- C388.98 H273.96 N72 O28.98 Zn9 -","9","0.5","SG6017","Sumod George; Israel Goldberg","[5,10,15,20-Tetrakis(4-pyridyl)porphyrinato]zinc(II) acetic acid clathrate, and its unique polymeric honeycomb architecture","Acta Crystallographica Section E","2005","61","8","m1441","m1443","10.1107/S1600536805018556","","","0.71073","MoKα","","0.0898","0.0546","","","0.1447","0.1646","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206541","8.1029","0.0008","14.0352","0.0014","15.6679","0.0015","90","","100.503","0.002","90","","1752","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(diisopropylamino)(1-indenyl)(isopropylamino)borane","(diisopropylamino)(1-indenyl)(isopropylamino)borane","","- C18 H29 B N2 -","- C18 H29 B N2 -","- C72 H116 B4 N8 -","4","1","SG6019","Braunschweig, Holger; Breitling, Frank Michael; Seeler, Fabian","<i>rac</i>-(Diisopropylamino)(1-indenyl)(isopropylamino)borane","Acta Crystallographica Section E","2005","61","8","o2343","o2344","10.1107/S1600536805019896","","","0.71073","MoKα","","0.0592","0.0452","","","0.1059","0.1138","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206542","5.3736","0.0002","7.0394","0.0003","15.191","0.0007","90","","90","","90","","574.63","0.04","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","cyclohexanone","","- C6 H10 O -","- C6 H10 O -","- C24 H40 O4 -","4","1","SJ6089","Howard A. Shallard-Brown; David J. Watkin; Andrew R. Cowley","Cyclohexanone at 150K","Acta Crystallographica Section E","2005","61","8","o2424","o2425","10.1107/S1600536805015977","","","0.71073","MoKα","","0.052","0.0462","","0.1189","0.1136","0.1189","","","","","","1.0183","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206543","12.5267","0.0006","17.2768","0.0008","13.8644","0.0007","90","","90","","90","","3000.6","0.3","150","1","150","1","","","","","","","","6","C m c 21","C 2c -2","36","","Tris(ethylenediamine)cobalt(III) nonaiododibismuthate","","- C6 H24 Bi2 Co I9 N6 -","- C6 H24 Bi2 Co I9 N6 -","- C24 H96 Bi8 Co4 I36 N24 -","4","0.5","SJ6094","Goforth, Andrea M.; Hipp, Rachael E.; Smith, Mark D.; Peterson Jr, LeRoy; zur Loye, Hans-Conrad","Tris(ethylenediamine)cobalt(III) nonaiododibismuthate","Acta Crystallographica Section E","2005","61","8","m1531","m1533","10.1107/S1600536805021501","","","0.71073","Mo-Kα","","0.0315","0.0304","","","0.0703","0.0708","","","","","","1.039","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206544","6.744","0.002","6.988","0.002","19.377","0.003","90","","93.19","0.03","90","","911.8","0.4","296","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Ent-3β-hydroxy-8(17),13(14)-labdadiene-16,15-olide 14-deoxyandrographolide","","- C20 H30 O4 -","- C20 H30 O4 -","- C40 H60 O8 -","2","1","SJ6106","Bhattacharyya, Kinkini; Kar, Tanusree; Bocelli, Gabriele; Cantoni, Andrea; Pramanick, Swapan; Banerjee, Sukdeb; Mukhopadhyay, Sibabrata","Redetermination of 14-deoxyandrographolide","Acta Crystallographica Section E","2005","61","8","o2743","o2745","10.1107/S1600536805023378","","","0.71069","MoKα","","0.0513","0.0416","","","0.1076","0.1119","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206545","8.0414","0.0008","8.7014","0.0008","14.3196","0.0014","87.205","0.002","88.374","0.002","84.521","0.002","995.92","0.17","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","Diethyl cis-1,2,3,4,5,10-hexahydro-6-iodo-1,4-dioxo-2,3,4a,10a- tetraazabenzo[g]cyclopent[cd]azulene-2a,10b-dicarboxylate","","- C18 H19 I N4 O6 -","- C18 H19 I N4 O6 -","- C36 H38 I2 N8 O12 -","2","1","SJ6107","Yun-Feng Chen; Bao-Han Zhou; Guo-Dong Yin; An-Xin Wu","Diethyl <i>cis</i>-1,2,3,4,5,10-hexahydro-6-iodo-1,4-dioxo-2,3,4a,10a-tetraazabenzo[<i>g</i>]cyclopent[<i>cd</i>]azulene-2a,10b-dicarboxylate","Acta Crystallographica Section E","2005","61","8","o2470","o2472","10.1107/S1600536805021513","","","0.71073","MoKα","","0.0466","0.042","","","0.1118","0.1171","","","","","","1.041","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206546","7.6131","0.0007","10.3234","0.001","11.7736","0.0011","105.837","0.002","103.79","0.002","97.422","0.002","845.65","0.14","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","Bis(acetylacetonato-κ^2^O,O')(N,N-dimethylaminoethanol-κ^2^N,O)zinc(II)","","- C14 H25 N O5 Zn -","- C14 H25 N O5 Zn -","- C28 H50 N2 O10 Zn2 -","2","1","SJ6108","Hamid, Mazhar; Mazhar, Muhammad; Ali, Asif; Zeller, Matthias; Hunter, Allen D.","Bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(<i>N</i>,<i>N</i>-dimethylaminoethanol-κ^2^<i>N</i>,<i>O</i>)zinc(II)","Acta Crystallographica Section E","2005","61","8","m1539","m1541","10.1107/S1600536805021161","","","0.71073","Mo-Kα","","0.0494","0.0472","","","0.129","0.1313","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206547","32.131","0.004","9.7172","0.0013","18.918","0.002","90","","90","","90","","5906.6","1.2","293","2","293","2","","","","","","","","5","I b a 2","I 2 -2c","45","","Bis[2-(benzoimidazol-2-yl)phenolato-κ^2^N,O]zinc(II)‒ bis[5-amino-2-(benzoimidazol-2-yl)phenolato-κ^2^N,O]zinc(II)‒ethanol‒water (0.56/0.44/2/0.5)","","- C30 H31.88 N4.88 O4.5 Zn -","- C30 H31.88 N4.88 O4.5 Zn -","- C240 H255.04 N39.04 O36 Zn8 -","8","1","SJ6110","Tong, Yi-Ping","Bis[2-(benzimidazol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>]zinc(II)‒bis[5-amino-2-(benzimidazol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>]zinc(II)‒ethanol‒water (0.56/0.44/2/0.5)","Acta Crystallographica Section E","2005","61","8","m1595","m1597","10.1107/S1600536805022233","","","0.71073","Mo-Kα","","0.0944","0.0562","","","0.1162","0.1404","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206548","9.496","0.003","9.895","0.003","13.619","0.005","90","","90","","90","","1279.7","0.7","295","2","295","3","","","","","","","","5","P n a 21","P 2c -2n","33","","5-Chlorosalicylaldehyde benzoylhydrazone","","- C14 H11 Cl N2 O2 -","- C14 H11 Cl N2 O2 -","- C56 H44 Cl4 N8 O8 -","4","1","SJ6111","Ali, Hapipah M.; Puvaneswary, Subramaniam; Ng, Seik Weng","5-Chlorosalicylaldehyde benzoylhydrazone","Acta Crystallographica Section E","2005","61","8","o2415","o2416","10.1107/S1600536805020775","","","0.71073","MoKα","","0.031","0.03","","","0.084","0.085","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206549","19.257","0.004","8.904","0.003","19.4","0.004","90","","108.33","0.017","90","","3157.6","1.4","295","2","295","3","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-Bromo-1H-indole-3-carbaldehyde 3-methoxybenzoylhydrazone","","- C17 H14 Br N3 O2 -","- C17 H14 Br N3 O2 -","- C136 H112 Br8 N24 O16 -","8","1","SJ6112","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng","5-Bromo-1<i>H</i>-indole-3-carbaldehyde 3-methoxybenzoylhydrazone","Acta Crystallographica Section E","2005","61","8","o2417","o2418","10.1107/S1600536805020787","","","0.71073","MoKα","","0.063","0.042","","","0.106","0.114","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206550","8.889","0.014","11.523","0.018","9.677","0.015","90","","95.58","0.03","90","","986","3","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-acetyl-N-phenylglycine","","- C10 H11 N O3 -","- C10 H11 N O3 -","- C40 H44 N4 O12 -","4","1","SJ6113","Ai-Yun Fu; Da-Qi Wang","<i>N</i>-Acetyl-<i>N</i>-phenylglycine","Acta Crystallographica Section E","2005","61","8","o2504","o2505","10.1107/S1600536805021793","","","0.71073","Mo-Kα","","0.1285","0.0493","","","0.1118","0.1431","","","","","","0.966","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206551","17.23","0.007","17.23","0.007","9.812","0.004","90","","90","","90","","2913","2","292","2","292","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Tetrakis(3,5-dimethoxyphenyl)silane","","- C32 H36 O8 Si -","- C32 H36 O8 Si -","- C128 H144 O32 Si4 -","4","0.25","SJ6115","Saied, Okba; Maris, Thierry; Simard, Michel; Wuest, James D.","Tetrakis(3,5-dimethoxyphenyl)silane","Acta Crystallographica Section E","2005","61","8","o2563","o2566","10.1107/S1600536805021847","","","1.5418","CuKα","","0.0553","0.0488","","","0.1453","0.149","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206552","8.063","0.003","8.08","0.003","12.03","0.005","93.27","0.03","95.87","0.04","113.46","0.03","711.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Nicotinium picrate","Nicotinium picrate","","- C12 H8 N4 O9 -","- C12 H8 N4 O9 -","- C24 H16 N8 O18 -","2","1","SJ6116","K. Anitha; S. Athimoolam; R. K. Rajaram","Nicotinium picrate","Acta Crystallographica Section E","2005","61","8","o2556","o2558","10.1107/S160053680502221X","","","0.71073","MoKα","","0.0739","0.0453","","","0.1178","0.1359","","","","","","1.023","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206553","12.158","0.005","10.593","0.004","7.001","0.003","90","","102.35","0.03","90","","880.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Nicotinium dihydrogenphosphate","3-carboxypyridinium dihydrogenphosphate","","- C6 H8 N O6 P -","- C6 H8 N O6 P -","- C24 H32 N4 O24 P4 -","4","1","SJ6117","S. Athimoolam; K. Anitha; R. K. Rajaram","Nicotinium dihydrogenphosphate","Acta Crystallographica Section E","2005","61","8","o2553","o2555","10.1107/S1600536805022221","","","0.71073","MoKα","","0.0381","0.0297","","","0.0783","0.0837","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206554","11.824","0.003","9.6214","0.0011","13.669","0.002","90","","111.99","0.018","90","","1441.9","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Bis(nicotinic acid) hydrogen perchlorate","Bis(nicotinic acid) hydrogen perchlorate","","- C12 H11 Cl N2 O8 -","- C12 H11 Cl N2 O8 -","- C48 H44 Cl4 N8 O32 -","4","0.5","SJ6119","S. Athimoolam; R. K. Rajaram","Bis(nicotinic acid) hydrogen perchlorate","Acta Crystallographica Section E","2005","61","8","o2674","o2676","10.1107/S1600536805022877","","","0.71073","MoKα","","0.0551","0.0428","","","0.1192","0.1272","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206555","7.533","0.005","8.067","0.007","9.317","0.005","82.06","0.06","80.95","0.03","81.31","0.07","548.9","0.7","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","(±)-trans-1,2,3,4,4a,9a-Hexahydroanthrone","","- C14 H16 O -","- C14 H16 O -","- C28 H32 O2 -","2","1","SJ6121","Lalancette, Roger A.; Thompson, Hugh W.","(±)-<i>trans</i>-1,2,3,4,4a,9a-Hexahydroanthrone","Acta Crystallographica Section E","2005","61","8","o2685","o2686","10.1107/S1600536805023019","","","0.71073","MoKα","","0.122","0.064","","","0.137","0.162","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206556","6.9663","0.0007","8.3306","0.0014","12.5098","0.0012","101.253","0.011","95.746","0.008","102.685","0.011","686.85","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Dinicotinium sulfate","Dinicotinium sulfate","","- C12 H12 N2 O8 S -","- C12 H12 N2 O8 S -","- C24 H24 N4 O16 S2 -","2","1","SJ6123","S. Athimoolam; R. K. Rajaram","Dinicotinium sulfate","Acta Crystallographica Section E","2005","61","8","o2764","o2767","10.1107/S1600536805023871","","","0.71073","MoKα","","0.1023","0.0615","","","0.1802","0.2047","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206557","4.9983","0.0011","5.5158","0.0012","26.418","0.006","90","","90","","90","","728.3","0.3","292","2","292","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3,4-Difluorobenzohydroxamic acid","","- C7 H5 F2 N O2 -","- C7 H5 F2 N O2 -","- C28 H20 F8 N4 O8 -","4","1","SU6205","Shang, Xian-Mei; Meng, Xiang-Gao; Wu, Ji-Zhou; Li, Qing-Shan","3,4-Difluorobenzohydroxamic acid","Acta Crystallographica Section E","2005","61","8","o2328","o2329","10.1107/S1600536805020179","","","0.71073","MoKα","","0.0639","0.0556","","","0.148","0.1572","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206558","6.4226","0.0001","9.7869","0.0002","13.9309","0.0004","81.3584","0.0008","88.7526","0.0009","79.765","0.002","851.93","0.03","123","2","","","","","","","","","","6","P -1","-P 1","2","","Methyl 2-(3,5-dichlorophenyl)-5-dimethylamino-3-methyl-1,1-dioxo-1,2,3,4-tetrahydro- 1λ^6^-1,2,4,6-thiatriazine-3-carboxylate","","- C13 H16 Cl2 N4 O4 S -","- C13 H16 Cl2 N4 O4 S -","- C26 H32 Cl4 N8 O8 S2 -","2","1","SU6207","Duggan, Peter J.; Fallon, Gary D.; Liepa, Andris J.","Methyl 2-(3,5-dichlorophenyl)-5-dimethylamino-3-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1λ^6^,2,4,6-thiatriazine-3-carboxylate","Acta Crystallographica Section E","2005","61","8","o2694","o2695","10.1107/S1600536805022713","","","0.71073","MoKα","","","0.0427","","","","0.1134","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206559","22.574","0.008","3.9269","0.0015","6.626","0.002","90","","90","","90","","587.4","0.4","294","2","294","2","","","","","","","","5","P n a 21","P 2c -2n","33","","4-Methylthiazole-5-carbaldehyde","","- C5 H5 N O S -","- C5 H5 N O S -","- C20 H20 N4 O4 S4 -","4","1","SU6210","Dong, Min; Sun, Liang-Dong","4-Methylthiazole-5-carbaldehyde","Acta Crystallographica Section E","2005","61","8","o2712","o2713","10.1107/S1600536805023202","","","0.71073","MoKα","","0.0658","0.0446","","","0.1122","0.119","","","","","","1.162","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206560","10.1103","0.0006","11.2803","0.0006","13.2962","0.0008","83.458","0.001","83.829","0.001","74.64","0.001","1447.97","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[diaquatris(μ~2~-4,4'-bipyridine-κ^2^N,N')tetrakis(phenylacetato- κO)dinickel(II)] dihydrate]","","- C62 H60 N6 Ni2 O12 -","- C62 H60 N6 Ni2 O12 -","- C62 H60 N6 Ni2 O12 -","1","0.5","SU6212","Zhang, Xue-Li; Ng, Seik Weng","Poly[[diaquatris(μ~2~-4,4'-bipyridine-κ^2^<i>N</i>,<i>N</i>')tetrakis(phenylacetato-κ<i>O</i>)dinickel(II)] dihydrate]","Acta Crystallographica Section E","2005","61","8","m1498","m1500","10.1107/S160053680502115X","","","0.71073","MoKα","","0.082","0.069","","","0.18","0.196","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206561","12.406","0.002","9.6396","0.0017","12.276","0.002","90","","90.479","0.003","90","","1468","0.4","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Ni(en)~2~(H~2~O)~2~](ans)~2~2H~2~O","Diaquabis(ethylenediamine)nickel(II) bis(4-aminonaphthalene-1-sulfonate) dihydrate","","- C24 H40 N6 Ni O10 S2 -","- C24 H40 N6 Ni O10 S2 -","- C48 H80 N12 Ni2 O20 S4 -","2","0.5","SU6215","Ming-Tian Li; Cheng-Gang Wang; Yu Wu; Xu-Cheng Fu","Diaquabis(ethylenediamine)nickel(II) bis(4-aminonaphthalene-1-sulfonate) dihydrate","Acta Crystallographica Section E","2005","61","8","m1613","m1615","10.1107/S1600536805022907","","","0.71073","MoKα","","0.0513","0.0384","","","0.0976","0.1139","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206562","10.6052","0.0006","24.2012","0.0016","30.778","0.002","90","","97.592","0.004","90","","7830.2","0.9","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pentakis(tetraethylammonium) diaqua-μ~4~-malonato-tetramalonatodi-μ~3~-oxo-di-μ-oxo- tetraoxopotassiumdimolybdenum dihydrate acetonitrile disolvate","","- C59 H120 K Mo4 N7 O30 -","- C59 H120 K Mo4 N7 O30 -","- C236 H480 K4 Mo16 N28 O120 -","4","1","SU6217","Klausmeyer, Kevin K.; Yaklin, Marsha M.; Adrian, Rafael A.","Pentakis(tetraethylammonium) diaqua-μ~4~-malonato-tetramalonatodi-μ~3~-oxo-di-μ-oxo-tetraoxopotassiumtetramolybdenum acetonitrile disolvate","Acta Crystallographica Section E","2005","61","8","m1607","m1609","10.1107/S1600536805022932","","","0.71073","MoKα","","0.0519","0.0315","","","0.0678","0.0746","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206563","12.9935","0.0013","33.042","0.004","11.1555","0.0013","90","","90","","90","","4789.4","0.9","296","","296","","","","","","","","","5","F d d 2","F 2 -2d","43","","Ethyl 3-methyl-1-oxo-4H-1,4-benzothiazine-2-carboxylate","","- C12 H13 N O3 S -","- C12 H13 N O3 S -","- C192 H208 N16 O48 S16 -","16","1","SU6218","Mehmet Akkurt; Sevim Türktekin; Yamna Baryala; Abdelfettah Zerzouf; Moussa Salem; El-Mokhtar Essassi; Orhan Büyükgüngör","Ethyl 3-methyl-1-oxo-4<i>H</i>-1,4-benzothiazine-2-carboxylate","Acta Crystallographica Section E","2005","61","8","o2716","o2717","10.1107/S1600536805023548","","","0.71073","MoKα","","0.0409","0.0328","","","0.0787","0.0819","","","","","","1.004","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206564","7.7451","0.0009","10.3145","0.001","10.8614","0.0011","79.304","0.008","70.145","0.01","78.793","0.009","793.79","0.15","110","","110","","","","","","","","","5","P -1","-P 1","2","","2-(dimethylammonio)ethanaminium hexacosaoxaoctamolybdate dihydrate","","- C8 H32 Mo8 N4 O28 -","- C8 H32 Mo8 N4 O28 -","- C8 H32 Mo8 N4 O28 -","1","0.5","SU6219","Thorn, Katherine J.; Narducci Sarjeant, Amy; Norquist, Alexander J.","(C~4~H~14~N~2~)~2~[Mo~8~O~26~]·2H~2~O: a new molybdate salt","Acta Crystallographica Section E","2005","61","8","m1665","m1667","10.1107/S1600536805023512","","","0.71073","MoKα","","0.0425","0.0265","","0.0594","0.0547","0.0547","","","","","","0.8997","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206565","4.8721","0.0013","9.55","0.003","11.547","0.003","96.582","0.004","95.944","0.004","94.753","0.004","528.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","N,N'-bis(pyridin-4-ylmethyl)succinamide‒terephthalic acid (1/1)","","- C24 H24 N4 O6 -","- C24 H24 N4 O6 -","- C24 H24 N4 O6 -","1","0.5","TK6236","Clive L. Oliver; Gareth O. Lloyd; Elise J.C. de Vries","<i>N</i>,<i>N</i>'-Bis(pyridin-4-ylmethyl)succinamide‒terephthalic acid (1/1)","Acta Crystallographica Section E","2005","61","8","o2605","o2606","10.1107/S1600536805021227","","","0.71073","MoKα","","0.057","0.054","","","0.143","0.146","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206566","13.7534","0.0006","17.1348","0.0008","7.6723","0.0003","90","","120.997","0.002","90","","1549.87","0.12","150","","150","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Di-μ-aqua-bis[{N-[(2-dimethylamino-κN)ethyl]-N,N',N'-trimethylethane- 1,2-diamine-κ^2^N,N'}sodium(I)] diiodide","","- C18 H50 I2 N6 Na2 O2 -","- C18 H50 I2 N6 Na2 O2 -","- C36 H100 I4 N12 Na4 O4 -","2","0.25","TK6237","Jeanneau, Erwann; Mishra, Shashank; Hubert-Pfalzgraf, Liliane G.","Di-μ-aqua-bis[{<i>N</i>- [(2-dimethylamino-κ<i>N</i>)ethyl]-<i>N</i>,<i>N</i>',<i>N</i>'-trimethylethane- 1,2-diamine-κ^2^<i>N</i>,<i>N</i>'}sodium(I)] diiodide","Acta Crystallographica, Section E","2005","61","8","o1528","o1530","10.1107/S1600536805021239","","","0.71073","MoKα","","0.049","0.04","","0.099","0.091","0.091","","","","","","0.872","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206567","12.538","0.0009","10.6157","0.0008","31.76","0.002","90","","98.062","0.002","90","","4185.5","0.5","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Acetonitrile-κN){1,2-bis[bis(pentafluorophenyl)phosphino]ethane- κ^2^P,P}(η^5^-pentamethylcyclopentadienyl)ruthenium(II) hexafluorophosphate","","- C38 H22 F26 N P3 Ru -","- C38 H22 F26 N P3 Ru -","- C152 H88 F104 N4 P12 Ru4 -","4","1","WK6052","Bellabarba, Ronan M.; Nieuwenhuyzen, Mark; Saunders, Graham C.","(Acetonitrile-κ<i>N</i>){1,2-bis[bis(pentafluorophenyl)phosphino]ethane-κ^2^<i>P</i>,<i>P</i>}(η^5^-pentamethylcyclopentadienyl)ruthenium(II) hexafluorophosphate","Acta Crystallographica Section E","2005","61","8","m1588","m1589","10.1107/S1600536805020052","","","0.71073","MoKα","","0.0975","0.047","","","0.0905","0.1091","","","","","","0.936","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206568","14.3223","0.0014","15.7868","0.0014","13.5226","0.0013","90","","115.067","0.002","90","","2769.5","0.5","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","tetrapiperazium decachlorodibismuthate","Bis(piperazinium) di-μ-chloro-bis[tetraochlorobismuthate(III)] trihydrate","","- C8 H30 Bi2 Cl10 N4 O3 -","- C8 H30 Bi2 Cl10 N4 O3 -","- C32 H120 Bi8 Cl40 N16 O12 -","4","0.5","WK6053","Ping-Fan Wu; Xiao-Feng Tan; Xiang-Gao Meng; Dong-Sheng Li; Yu-Lin Zhu; Yong-Ge Wei","Bis(piperazinium) di-μ-chloro-bis[tetrachlorobismuthate(III)] trihydrate","Acta Crystallographica Section E","2005","61","8","m1506","m1508","10.1107/S1600536805021100","","","0.71073","MoKα","","0.0435","0.0355","","","0.0955","0.0998","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206569","14.114","0.003","5.5098","0.001","25.621","0.005","90","","90","","90","","1992.4","0.7","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(4,6-Dichloro-[1,3,5]triazin-2-yl)-phenyl-amine","","- C9 H6 Cl2 N4 -","- C9 H6 Cl2 N4 -","- C72 H48 Cl16 N32 -","8","1","WK6055","Tao Zeng; Chuan-Ming Dong; Xue-Gui Shu","<i>N</i>-(4,6-Dichloro-1,3,5-triazin-2-yl)aniline","Acta Crystallographica Section E","2005","61","8","o2334","o2335","10.1107/S1600536805020386","","","0.71073","MoKα","","0.0803","0.0541","","","0.1016","0.1112","","","","","","1.132","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206570","11.093","0.005","12.944","0.006","19.584","0.009","90","","91.855","0.009","90","","2811","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-Phenyl-2-(quinolin-8-yloxy)acetamide hemihydrate","","- C17 H15 N2 O2.5 -","- C17 H15 N2 O2.5 -","- C136 H120 N16 O20 -","8","1","WK6056","Xue-Mei Li; Yong-Hong Wen; Mao-Jie Li; Shu-Sheng Zhang","<i>N</i>-Phenyl-2-(quinolin-8-yloxy)acetamide hemihydrate","Acta Crystallographica Section E","2005","61","8","o2389","o2390","10.1107/S1600536805020751","","","0.71073","MoKα","","0.0781","0.0488","","","0.1112","0.1261","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206571","5.8779","0.0009","29.8","0.004","7.216","0.0011","90","","113.622","0.002","90","","1158.1","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-benzyl-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one","","- C12 H12 N2 O S -","- C12 H12 N2 O S -","- C48 H48 N8 O4 S4 -","4","1","WK6057","Hu, Sheng-Li; Yin, Guo-Dong; Wu, An-Xin","5-Benzyl-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2408","o2409","10.1107/S1600536805020921","","","0.71073","MoKα","","0.0649","0.0483","","","0.1136","0.1228","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206572","10.5565","0.0001","10.5565","0.0001","7.7584","0.0001","90","","90","","120","","748.76","0.014","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","Barium vanadate chloride","Pentabarium tris(vanadate) chloride","","- Ba5 Cl O12 V3 -","- Ba5 Cl O12 V3 -","- Ba10 Cl2 O24 V6 -","2","0.166667","WM6071","Roh, Yun-Ho; Hong, Seung-Tae","Apatite-type Ba~5~(VO~4~)~3~Cl","Acta Crystallographica, Section E","2005","61","8","i140","i142","10.1107/S1600536805018854","","","0.71073","MoKα","","0.02","0.015","","0.0383","0.0344","0.0344","","","","","","0.4614","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2206573","6.975","0.003","6.984","0.003","8.899","0.003","104.01","0.03","101.19","0.03","114.1","0.06","362.3","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","Polyhalite","Dipotassium Dicalcium Magnesium Tetrakis[sulfate(VI)] Dihydrate","","- Ca2 H4 K2 Mg O18 S4 -","- Ca2 H4 K2 Mg O18 S4 -","- Ca2 H4 K2 Mg O18 S4 -","1","0.5","WM6074","Bindi, Luca","Reinvestigation of the crystal structure of polyhalite, K~2~Ca~2~Mg(SO~4~)~4~.2H~2~O","Acta Crystallographica, Section E","2005","61","8","i135","i136","10.1107/S1600536805020507","","","0.71073","MoKα","","0.054","0.0476","","","0.1379","0.143","","","","","","0.967","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2206574","7.4864","0.0012","7.4864","0.0012","20.88","0.006","90","","90","","120","","1013.5","0.4","293","2","293","2","","","","","","","","2","R -3 :H","-R 3","148","Yttrium iodide","Yttrium triiodide","","- I3 Y -","- I3 Y -","- I18 Y6 -","6","0.333333","WM6075","Jongen, Liesbet; Meyer, Gerd","Yttrium triiodide, YI~3~","Acta Crystallographica Section E","2005","61","8","i151","i152","10.1107/S1600536805019847","","","0.71073","MoKα","","0.0347","0.0317","","","0.0869","0.0897","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206575","3.5505","0.001","3.9543","0.0016","8.7","0.003","90","","90","","90","","122.15","0.07","293","2","293","2","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","Scandium(III) oxide bromide","","- Br O Sc -","- Br O Sc -","- Br2 O2 Sc2 -","2","0.25","WM6076","Jongen, Liesbet; Meyer, Gerd","Scandium(III) oxide bromide, ScOBr","Acta Crystallographica Section E","2005","61","8","i153","i154","10.1107/S1600536805019914","","","0.71073","MoKα","","0.0186","0.0178","","","0.0421","0.0423","","","","","","1.119","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206576","3.7913","0.0002","3.7913","0.0002","3.7913","0.0002","90","","90","","90","","54.496","0.005","296","","","","","","","","synthesized at 4.5 GPa and 1273 K","synthesized at 4.5 GPa","Synthetic","3","P m -3 m","-P 4 2 3","221","","lanthanum aluminium trioxide","","- Al La O3 -","- Al La O3 -","- Al La O3 -","1","0.0208333","WM6077","Nakatsuka, Akihiko; Ohtaka, Osamu; Arima, Hiroshi; Nakayama, Noriaki; Mizota, Tadato","Cubic phase of single-crystal LaAlO~3~ perovskite synthesized at 4.5 GPa and 1273 K","Acta Crystallographica, Section E","2005","61","8","i148","i150","10.1107/S1600536805020441","","","0.71069","MoKα","","","0.0081","","","","0.0101","","","","","","1.07","","","","has coordinates","282068","2023-03-26","10:12:40",""
"2206577","5.9078","0.0013","5.9821","0.0013","7.9503","0.0019","90","","92.22","0.03","90","","280.76","0.11","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Dirubidium sodium manganate(V)","","- Mn Na O4 Rb2 -","- Mn Na O4 Rb2 -","- Mn2 Na2 O8 Rb4 -","2","0.5","WM6078","Möller, Angela; Kerp, Oliver","Dirubidium sodium manganate(V), Rb~2~NaMnO~4~","Acta Crystallographica Section E","2005","61","8","i146","i147","10.1107/S1600536805020453","","","0.71073","MoKα","","0.0439","0.0361","","","0.0712","0.0743","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206578","34.3914","0.0014","7.0397","0.0003","6.1873","0.0003","90","","91.638","0.003","90","","1497.37","0.11","296","","292","","","","","","","","","5","C 1 2/m 1","-C 2y","12","Ammonium cobalt phosphite 18-hydrate","Diammonium tris[hexaaquacobalt(II)] tetrakis[hydrogenphosphate(III)]","","- Co3 H48 N2 O30 P4 -","- Co3 H48 N2 O30 P4 -","- Co6 H96 N4 O60 P8 -","2","0.25","WM6079","Ouarsal, Rachid; El Bali, Brahim; Lachkar, Mohammed; Dusek, Michal; Fejfarova, Karla","Diammonium tris[hexaaquacobalt(II)] tetrakis[hydrogenphosphate(III)], (NH~4~)~2~[Co(H~2~O)~6~]~3~(HPO~3~)~4~","Acta Crystallographica Section E","2005","61","8","i168","i170","10.1107/S1600536805021719","","","0.71069","MoKα","","0.023","0.0213","","","0.0719","0.0732","","","","","","1.53","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206579","34.1405","0.0015","7.0197","0.0003","6.155","0.0003","90","","91.371","0.004","90","","1474.66","0.12","296","","292","","","","","","","","","5","C 1 2/m 1","-C 2y","12","Ammonium nickel phosphite 18-hydrate","Diammonium tris[hexaaquanickel(II)] tetrakis[hydrogenphosphate(III)]","","- H48 N2 Ni3 O30 P4 -","- H48 N2 Ni3 O30 P4 -","- H96 N4 Ni6 O60 P8 -","2","0.25","WM6080","Ouarsal, Rachid; El Bali, Brahim; Lachkar, Mohammed; Dusek, Michal; Fejfarova, Karla","Diammonium tris[hexaaquanickel(II)] tetrakis[hydrogenphosphate(III)], (NH~4~)~2~[Ni(H~2~O)~6~]~3~(HPO~3~)~4~","Acta Crystallographica Section E","2005","61","8","i171","i173","10.1107/S1600536805021720","","","0.71069","MoKα","","0.0261","0.0199","","","0.0573","0.0599","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206580","5.5001","0.0006","5.5001","0.0006","5.5001","0.0006","90","","90","","90","","166.38","0.03","294","","294","","","","","","","","","3","P -4 3 m","P -4 2 3","215","","Tricopper tetrathioniobate(V)","","- Cu3 Nb S4 -","- Cu3 Nb S4 -","- Cu3 Nb S4 -","1","0.0416667","WM6081","Kars, Mohammed; Rebbah, Allaoua; Rebbah, Houria","Cu~3~NbS~4~","Acta Crystallographica Section E","2005","61","8","i180","i181","10.1107/S1600536805022397","","","0.71073","MoKα","","","0.032","","","","0.038","","","","","","1.172","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206581","5.8389","0.0012","7.6865","0.0015","14.124","0.003","90","","97.9","0.03","90","","627.9","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2-bis(phenylsulfanyl)ethane","","- C14 H14 S2 -","- C14 H14 S2 -","- C28 H28 S4 -","2","0.5","WN6360","Hou, Bao-Hong; Zhou, Li-Na; Yin, Qiu-Xiang; Wang, Jing-Kang; Chen, Wei","1,2-Bis(phenylsulfanyl)ethane","Acta Crystallographica Section E","2005","61","8","o2482","o2483","10.1107/S1600536805020908","","","0.71073","MoKα","","0.0496","0.0422","","","0.1257","0.1311","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206582","6.5236","0.0005","17.5861","0.0014","9.0279","0.0007","90","","94.71","0.001","90","","1032.23","0.14","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","N-Methoxycarbonyl-D-glucosaminide","(1,3,4,-Tri-hydroxy-6-hydroxymethyl-tetrahydropyran-2-yl)methyl carbamate","","- C8 H15 N O7 -","- C8 H15 N O7 -","- C32 H60 N4 O28 -","4","2","WN6361","Shahid Iqbal Awan; M. Iqbal Choudhary; Atta-ur-Rahman; Shazia Anjum; Shamsher Ali; Hoong-Kun Fun","Methyl [2,4,5-trihydroxy-6-(hydroxymethyl)perhydropyran-3-yl]carbamate","Acta Crystallographica Section E","2005","61","8","o2354","o2356","10.1107/S1600536805020374","","","0.71073","MoKα","","0.0311","0.0304","","","0.077","0.0782","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206583","9.7861","0.0014","10.4999","0.0015","10.7337","0.0015","72.329","0.003","88.734","0.003","84.93","0.003","1046.8","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","7a-O-methyldeguelol","(6,7-dimethoxy-3,4-dihydro-2H-chromen-4-yl)(5-methoxy-2,2- dimethyl-2H-chromen-6-yl)methanone","","- C24 H25 O6 -","- C24 H26 O6 -","- C48 H52 O12 -","2","1","WN6362","Suchada Chantrapromma; Hoong-Kun Fun; Yupparase Pullaput; Hathaichanok Wongtap; Saravut Dejmanee; Kan Chantrapromma","7a-<i>O</i>-Methyldeguelol","Acta Crystallographica Section E","2005","61","8","o2340","o2342","10.1107/S1600536805020325","","","0.71073","MoKα","","0.0917","0.084","","","0.194","0.199","","","","","","1.225","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206584","8.6563","0.0016","7.633","0.0012","26.927","0.004","90","","95.403","0.009","90","","1771.3","0.5","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,4,5-Trimethoxyphenyl 4-bromo-7-methoxy-1,3-benzodioxole-5-carboxylate","","- C18 H17 Br O8 -","- C18 H17 Br O8 -","- C72 H68 Br4 O32 -","4","1","WN6364","Zheng, Lei; Guo, Boying; Zheng, Xiufang; Chen, Juan; Chang, Junbiao","3,4,5-Trimethoxyphenyl 4-bromo-7-methoxy-1,3-benzodioxole-5-carboxylate","Acta Crystallographica Section E","2005","61","8","o2508","o2509","10.1107/S1600536805021689","","","0.71073","MoKα","","0.0858","0.0407","","","0.085","0.1002","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206585","8.4553","0.0014","10.1812","0.0016","13.408","0.002","90","","98.646","0.002","90","","1141.1","0.3","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N'-(4-Hydroxybenzylidene)isonicotinohydrazide","","- C13 H11 N3 O2 -","- C13 H11 N3 O2 -","- C52 H44 N12 O8 -","4","1","WN6365","Qi-Liang Deng; Ming Yu; Xin Chen; Chun-Hua Diao; Zuo-Liang Jing; Zhi Fan","<i>N</i>'-(4-Hydroxybenzylidene)isonicotinohydrazide","Acta Crystallographica Section E","2005","61","8","o2545","o2546","10.1107/S1600536805022191","","","0.71073","MoKα","","0.0677","0.0398","","","0.1017","0.1113","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206586","20.566","0.002","10.698","0.001","22.789","0.002","90","","104.3","0.002","90","","4858.6","0.8","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N,N'-Bis(2-chlorophenyl)-4-(4-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine- 3,5-dicarboxamide","","- C27 H22 Cl3 N3 O2 -","- C27 H22 Cl3 N3 O2 -","- C216 H176 Cl24 N24 O16 -","8","1","WN6366","Mahendra, M; Doreswamy, B. H.; Sridhar, M. A.; Shashidhara Prasad, J.; Kinnari, D.; Dinesh, M.; Anamik, S.","<i>N</i>,<i>N</i>'-Bis(2-chlorophenyl)-4-(4-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide","Acta Crystallographica Section E","2005","61","8","o2567","o2569","10.1107/S1600536805022038","","","0.71073","MoKα","","0.0677","0.0508","","","0.1491","0.1812","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206587","8.9854","0.0017","11.955","0.002","12.21","0.002","71.179","0.003","70.188","0.003","84.085","0.003","1168","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2-(3-Bromo-4-butoxyphenyl)-3,4-dimethyl-5-(3,4,5-trimethoxyphenyl)furan","","- C25 H29 Br O5 -","- C25 H29 Br O5 -","- C50 H58 Br2 O10 -","2","1","WN6367","Wang, Run-Ling; Shi, Ji-Xian; Zheng, Xiu-Fang; Zhou, Ye","2-(3-Bromo-4-butoxyphenyl)-3,4-dimethyl-5-(3,4,5-trimethoxyphenyl)furan","Acta Crystallographica Section E","2005","61","8","o2619","o2620","10.1107/S1600536805022543","","","0.71073","MoKα","","0.0881","0.0421","","","0.0888","0.1097","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206588","11.7262","0.0013","7.6968","0.0007","11.8788","0.0013","90","","109.97","0.005","90","","1007.65","0.18","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1S,2S,4S,5S)-2,5-Dibenzyl-1,4-diazoniabicyclo[2.2.2]octane dichloride methanol solvate","","- C21 H30 Cl2 N2 O -","- C21 H30 Cl2 N2 O -","- C42 H60 Cl4 N4 O2 -","2","1","WN6368","Qiu, Li-Hua; Yang, Wen; Zhang, Yawen; Zhang, De-Chun","(1<i>S</i>,2<i>S</i>,4<i>S</i>,5<i>S</i>)-2,5-Dibenzyl-1,4-diazoniabicyclo[2.2.2]octane dichloride methanol solvate","Acta Crystallographica Section E","2005","61","8","o2668","o2670","10.1107/S1600536805022762","","","0.7107","MoKα","","0.0434","0.0432","","","0.1279","0.128","","","","","","1.129","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206589","9.8061","0.0007","9.9171","0.0007","23.7427","0.0017","90","","92.545","0.002","90","","2306.7","0.3","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-2,4-dihydroxyacetophenone salicylhydrazidato)bis[pyridinezinc(II)] dimethylformamide disolvate","","- C46 H48 N8 O10 Zn2 -","- C46 H48 N8 O10 Zn2 -","- C92 H96 N16 O20 Zn4 -","2","0.5","WN6369","Jinshan Huang; Yongfei Wu; Xinde Zhu","Bis(μ-2,4-dihydroxyacetophenone salicylhydrazidato)bis[pyridinezinc(II)] dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","8","m1548","m1549","10.1107/S1600536805021677","","","0.71073","MoKα","","0.0722","0.0518","","","0.1208","0.14","","","","","","1.077","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206590","20.5494","0.001","12.1369","0.001","16.3862","0.0014","90","","126.097","0.01","90","","3302.2","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,4-Bis[2-(benzylaminocarbonyl)phenoxymethyl]-1,3,5-trimethylbenzene","","- C39 H38 N2 O4 -","- C39 H38 N2 O4 -","- C156 H152 N8 O16 -","4","0.5","WW6370","Tang, Yu; Tang, Kuan-Zhen; Zhang, Jian","2,4-Bis[2-(benzylaminocarbonyl)phenoxymethyl]-1,3,5-trimethylbenzene","Acta Crystallographica Section E","2005","61","8","o2489","o2490","10.1107/S1600536805021537","","","0.71073","MoKα","","0.1244","0.054","","","0.1202","0.1507","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206591","9.5089","0.001","7.7663","0.0008","26.204","0.003","90","","91.825","0.002","90","","1934.2","0.4","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Diisopropylamino-3-phenylbenzo[4,5]furo[3,2-d]pyrimidin-4(3H)-one","","- C22 H23 N3 O2 -","- C22 H23 N3 O2 -","- C88 H92 N12 O8 -","4","1","WW6387","Hu, Yang-Gen; Xu, Sheng-Zhen; Yuan, Ju-Zhen; Ding, Ming-Wu; He, Hong-Wu","2-Diisopropylamino-3-phenylbenzo[4,5]furo[3,2-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2649","o2651","10.1107/S1600536805022919","","","0.71073","MoKα","","0.0832","0.0588","","","0.1265","0.139","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206592","8.844","0.005","9.062","0.004","9.635","0.004","97.7","0.03","116.8","0.03","93.26","0.03","677","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(imidazolium) diaquabis(pyridine-2,5-dicarboxylato-κ^2^N,O)cobaltate(II) tetrahydrate","","- C20 H28 Co N6 O14 -","- C20 H28 Co N6 O14 -","- C20 H28 Co N6 O14 -","1","0.5","WW6403","Deng, Qian-Jun; Liu, Zhuang-Tian; Zeng, Ming-Hua","Bis(imidazolium) diaquabis(pyridine-2,5-dicarboxylato-κ^2^<i>N</i>,<i>O</i>)cobaltate(II) tetrahydrate","Acta Crystallographica Section E","2005","61","8","m1514","m1516","10.1107/S1600536805021380","","","0.71073","MoKα","","0.063","0.0526","","","0.1393","0.1486","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206593","8.819","0.003","7.822","0.003","20.465","0.008","90","","96.507","0.007","90","","1402.6","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Methyl-2-methylsulfanyl-7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile","","- C15 H12 N4 S -","- C15 H12 N4 S -","- C60 H48 N16 S4 -","4","1","WW6407","Ren, Xue-Ling; Wu, Chao; Li, Hua-Bin; Yang, Hua-Zheng","5-Methyl-2-methylsulfanyl-7-phenylpyrazolo[1,5-<i>a</i>]pyrimidine-3-carbonitrile","Acta Crystallographica Section E","2005","61","8","o2506","o2507","10.1107/S1600536805021896","","","0.71073","MoKα","","0.1091","0.0506","","","0.1035","0.1216","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206594","13.395","0.002","7.1833","0.0011","11.4151","0.0018","90","","104.948","0.002","90","","1061.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,5-bis(4-pyridyl)-1,3,4-thiadiazole","","- C12 H8 N4 S -","- C12 H8 N4 S -","- C48 H32 N16 S4 -","4","1","WW6408","Zhao, Xiao-Jun; Cai, Hua; Du, Miao","A new polymorph of 2,5-bis(4-pyridyl)-1,3,4-thiadiazole","Acta Crystallographica Section E","2005","61","8","o2547","o2548","10.1107/S1600536805022142","","","0.71073","MoKα","","0.0406","0.0323","","","0.0969","0.1015","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206595","18.0634","0.0016","15.1108","0.0013","18.8377","0.0017","90","","90","","90","","5141.8","0.8","292","2","292","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Diethyl 4,8-dioxo-2,6-diphenyl-1,3,5,7-tetrahydro-2,3a,4a,6,7a,8a- hexaazacyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C26 H28 N6 O6 -","- C26 H28 N6 O6 -","- C208 H224 N48 O48 -","8","1","WW6409","Yin, Guo-Dong; Chen, Yun-Feng; Zhou, Bao-Han; Wu, An-Xin","Diethyl 4,8-dioxo-2,6-diphenyl-1,3,5,7-tetrahydro-2,3a,4a,6,7a,8a-hexaazacyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2005","61","8","o2467","o2469","10.1107/S1600536805021525","","","0.71073","MoKα","","0.079","0.0574","","","0.1528","0.1805","","","","","","1.178","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206596","7.105","0.003","9.762","0.003","13.29","0.005","100.018","0.005","99.912","0.005","100.614","0.004","872.1","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-Amino-1-(2-chlorophenyl)-9-methoxy-5,6-dihydro-1H- benzo[f]chromene-2-carbonitrile","","- C21 H17 Cl N2 O2 -","- C21 H17 Cl N2 O2 -","- C42 H34 Cl2 N4 O4 -","2","1","WW6410","Yu, Chen-Xia; Shi, Da-Qing; Yao, Chang-Sheng; Wang, Xiang-Shan; Zhuang, Qi-Ya","3-Amino-1-(2-chlorophenyl)-9-methoxy-5,6-dihydro-1<i>H</i>-benzo[<i>f</i>]chromene-2-carbonitrile","Acta Crystallographica Section E","2005","61","8","o2628","o2629","10.1107/S1600536805022671","","","0.71073","MoKα","","0.0771","0.0455","","","0.1036","0.1176","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206597","8.27","0.002","10.619","0.003","11.399","0.003","64.657","0.003","75.794","0.004","72.154","0.004","853.6","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Dibromobis(3-methoxy-2-methylpyrazine 1-oxide-κ^O^)copper(II)","","- C12 H16 Br2 Cu N4 O4 -","- C12 H16 Br2 Cu N4 O4 -","- C24 H32 Br4 Cu2 N8 O8 -","2","1","XU6012","Sun, You-Min; Shi, Jing-Min; Liu, Zhe","Dibromobis(3-methoxy-2-methylpyrazine 1-oxide-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2005","61","8","m1574","m1575","10.1107/S1600536805022099","","","0.71073","MoKα","","0.076","0.059","","","0.151","0.16","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206598","11.033","0.005","11.951","0.005","12.034","0.005","69.081","0.005","77.369","0.004","66.626","0.005","1355","1","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Tetrakis(1,4-dimethylpyridinium) dodecamolybdosilicate","","- C28 H40 Mo12 N4 O40 Si -","- C28 H40 Mo12 N4 O40 Si -","- C28 H40 Mo12 N4 O40 Si -","1","0.5","XU6013","Xue-Jie Tan; Si-Xiu Sun; Lian-Dong Liu; Jian-Ping Ma; Dian-Xiang Xing","Tetrakis(1,4-dimethylpyridinium) dodecamolybdosilicate","Acta Crystallographica Section E","2005","61","8","m1620","m1622","10.1107/S1600536805023111","","","0.71073","MoKα","","0.101","0.1","","","0.225","0.226","","","","","","1.151","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206599","4.2588","0.0008","10.93","0.002","13.724","0.003","90","","95.733","0.003","90","","635.6","0.2","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3,6-Dibromo-9-ethyl-9H-carbazole","","- C14 H11 Br2 N -","- C14 H11 Br2 N -","- C28 H22 Br4 N2 -","2","1","XU6016","Huang, Peng-Mian; Li Jiang-Sheng; Duan Xue-Min; Zeng Tao; Yan Xi-Long","3,6-Dibromo-9-ethyl-9<i>H</i>-carbazole","Acta Crystallographica Section E","2005","61","8","o2366","o2367","10.1107/S1600536805020490","","","0.71073","MoKα","","0.055","0.039","","","0.087","0.094","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206600","11.3218","0.0011","12.7214","0.0013","11.8011","0.0012","90","","105.976","0.002","90","","1634.1","0.3","293","2","273","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","Di-μ-diphenylphosphido-bis[tricarbonyliron(II)] dichloromethane solvate","","- C31 H22 Cl2 Fe2 O6 P2 -","- C31 H22 Cl2 Fe2 O6 P2 -","- C62 H44 Cl4 Fe4 O12 P4 -","2","0.5","XU6018","María Gabriela Ballinas-López; Itzia I. Padilla-Martínez; Francisco J. Martínez-Martínez; Herbert Höpfl; Efrén V. García-Báez","Di-μ-diphenylphosphido-bis[tricarbonyliron(II)] dichloromethane solvate","Acta Crystallographica Section E","2005","61","8","m1475","m1477","10.1107/S1600536805020982","","","0.71073","MoKα","","0.056","0.044","","","0.128","0.132","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206601","20.674","0.002","8.2442","0.0009","14.9541","0.0016","90","","111.106","0.002","90","","2377.8","0.4","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(2,6-Difluorobenzoyl)-3-(5-1,3,4-thiadiazol-2-yl)urea","","- C10 H6 F2 N4 O2 S -","- C10 H6 F2 N4 O2 S -","- C80 H48 F16 N32 O16 S8 -","8","2","XU6020","Song, Xin-Jian; Zhang, Sheng-Hui; Li, Yao-Hua; Tan, Xiao-Hong; Wang, Yan-Gang","1-(2,6-Difluorobenzoyl)-3-(1,3,4-thiadiazol-2-yl)urea","Acta Crystallographica Section E","2005","61","8","o2360","o2362","10.1107/S1600536805020362","","","0.71073","MoKα","","0.066","0.049","","","0.125","0.144","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206602","16.982","0.004","6.7616","0.0014","10.12","0.002","90","","111.718","0.004","90","","1079.5","0.4","298","2","298","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Tetraaquadithiocyanatocobalt(II) bis(2-methylpyrazine 1,4-dioxide)","","- C12 H20 Co N6 O8 S2 -","- C12 H20 Co N6 O8 S2 -","- C24 H40 Co2 N12 O16 S4 -","2","0.25","XU6021","Sun, You-Min; Shi, Jing-Min; Zhang, Xia","Tetraaquadithiocyanatocobalt(II) bis(2-methylpyrazine 1,4-dioxide)","Acta Crystallographica Section E","2005","61","8","m1501","m1502","10.1107/S1600536805021148","","","0.71073","MoKα","","0.033","0.032","","","0.083","0.083","","","","","","1.116","","","","has coordinates,has Fobs","191063","2020-10-21","18:00:00",""
"2206603","8.2409","0.0005","9.8064","0.0006","11.567","0.0007","87.027","0.001","85.507","0.001","80.552","0.001","918.53","0.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","bis(μ~2~-4-sulfonatobenzoato)bis[(di-2-pyridylamine)copper(II)] trihydrate","","- C34 H32 Cu2 N6 O13 S2 -","- C34 H32 Cu2 N6 O13 S2 -","- C34 H32 Cu2 N6 O13 S2 -","1","0.5","XU6023","Zhang, Li-Ping; Zhu, Long-Guan","The cyclic dimer bis(μ~2~-4-sulfonatobenzoato)bis[(di-2-pyridylamine)copper(II)] trihydrate","Acta Crystallographica Section E","2005","61","8","m1439","m1440","10.1107/S1600536805020489","","","0.71073","MoKα","","0.07","0.065","","","0.154","0.157","","","","","","1.168","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206604","9.4833","0.0002","11.1136","0.0003","13.0749","0.0003","73.486","0.002","72.134","0.002","81.704","0.002","1254.99","0.05","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","Diaquabis(1,10-phenanthroline-κ^2^N,N')zinc(II) pentafluorooxoniobate","","- C24 H20 F5 N4 Nb O3 Zn -","- C24 H20 F5 N4 Nb O3 Zn -","- C48 H40 F10 N8 Nb2 O6 Zn2 -","2","1","XU6024","Zhu, Gang; Liu, Yu-Ying; Wang, Gang; Tang, Zong-Xun","Diaquabis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II) pentafluorooxoniobate(V)","Acta Crystallographica Section E","2005","61","8","m1566","m1567","10.1107/S1600536805020854","","","0.71073","MoKα","","0.05","0.036","","","0.095","0.1","","","","","","1.083","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206605","7.0207","0.0014","7.0602","0.0011","8.1978","0.0019","68.66","0.01","73.748","0.006","76.204","0.011","359.09","0.13","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","4,4'-Ethylenebipyridinium tetrachlorocuprate","","- C12 H12 Cl4 Cu N2 -","- C12 H12 Cl4 Cu N2 -","- C12 H12 Cl4 Cu N2 -","1","0.5","XU6025","Zhang, Jing; Ye, Ling; Yu, Jing-Sheng; Wu, Li-Xin","4,4'-Ethylenebipyridinium tetrachlorocuprate","Acta Crystallographica Section E","2005","61","8","m1633","m1634","10.1107/S1600536805023433","","","0.71073","MoKα","","0.051","0.043","","","0.12","0.127","","","","","","1.135","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206606","12.4376","0.0009","9.595","0.0007","12.4375","0.0009","90","","90.03","0.01","90","","1484.28","0.19","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Diaquabis(ethylenediamine)copper(II)] [bis(4-aminonaphthalene-1-sulfonate)] dihydrate","","- C24 H40 Cu N6 O10 S2 -","- C24 H40 Cu N6 O10 S2 -","- C48 H80 Cu2 N12 O20 S4 -","2","0.5","XU6026","Li, Ming-Tian; Wang, Cheng-Gang; Wu, Yu; Fu, Xu-Cheng","Diaquabis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(4-aminonaphthalene-1-sulfonate) dihydrate","Acta Crystallographica Section E","2005","61","8","m1660","m1661","10.1107/S1600536805023627","","","0.71073","MoKα","","0.046","0.037","","","0.101","0.12","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206607","8.243","0.002","10.25","0.003","10.655","0.003","116.643","0.003","92.658","0.003","106.771","0.003","754","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-Chloro-N-ferrocenylmethyl-N-methylaniline","","- C18 H18 Cl Fe N -","- C18 H18 Cl Fe N -","- C36 H36 Cl2 Fe2 N2 -","2","1","XU6027","Ying-Jie Li; Hong-Xing Wang; Hong-Fei Wu","3-Chloro-<i>N</i>-ferrocenylmethyl-<i>N</i>-methylaniline","Acta Crystallographica Section E","2005","61","8","m1579","m1580","10.1107/S1600536805021835","","","0.71073","MoKα","","0.028","0.026","","","0.071","0.072","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206608","12.503","0.005","9.894","0.004","26.88","0.01","90","","90","","90","","3325","2","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C17 H17 Cu N3 O3 -","- C17 H17 Cu N3 O3 -","- C136 H136 Cu8 N24 O24 -","8","1","XU6030","Liu, Ming-Li; Dou, Jian-Min; Wang, Da-Qi; Li, Da-Cheng","[1-Acetylacetone (2-hydroxybenzoyl)hydrazonato]pyridinecopper(II)","Acta Crystallographica Section E","2005","61","8","m1662","m1664","10.1107/S1600536805023639","","","0.71073","MoKα","","0.149","0.067","","","0.156","0.22","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206609","17.1543","0.0004","8.3835","0.0002","10.9679","0.0003","90","","105.976","0.001","90","","1516.41","0.07","295","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-[4-(Dimethylamino)benzylidene]-4-methylbenzenesulfonamide","","- C16 H18 N2 O2 S -","- C16 H18 N2 O2 S -","- C64 H72 N8 O8 S4 -","4","1","YA6251","Li-Ping Deng; Yong-Zhou Hu","<i>N</i>-[4-(Dimethylamino)benzylidene]-4-methylbenzenesulfonamide","Acta Crystallographica Section E","2005","61","8","o2652","o2653","10.1107/S1600536805022816","","","0.71069","MoKα","","","0.055","","","","0.152","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206610","22.485","0.005","12.361","0.003","12.56","0.003","90","","90","","90","","3490.9","1.4","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","2,3-bis[(pyrimidin-2-ylsulfanyl)methyl]quinoxaline","","- C18 H14 N6 S2 -","- C18 H14 N6 S2 -","- C144 H112 N48 S16 -","8","1","YA6252","Ma, Zi-Chuan; Xian, Hong-Shi","2,3-Bis[(pyrimidin-2-ylsulfanyl)methyl]quinoxaline","Acta Crystallographica Section E","2005","61","8","o2746","o2747","10.1107/S1600536805023779","","","0.71073","MoKα","","0.052","0.035","","","0.089","0.096","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206611","11.3751","0.0009","13.7258","0.0008","16.4798","0.0011","103.903","0.004","99.49","0.004","100.168","0.005","2399.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,2'-bipyridine)-1k^2^N:N';3k^2^N:N'-hexakis(μ-α-methylacrylato)- 1:2k^6^O:O';2:3k^6^O:O'-nitrato-2k^2^O:O'-dizinc(II)neodymium(III)","","- C44 H46 N5 Nd O15 Zn2 -","- C44 H46 N5 Nd O15 Zn2 -","- C88 H92 N10 Nd2 O30 Zn4 -","2","1","YA6253","Yue Zhu; Weimin Lu; Meng Ma; Fang Chen","Bis(2,2'-bipyridine)-1κ^2^<i>N</i>:<i>N</i>';3κ^2^<i>N</i>:<i>N</i>'-hexakis(μ-α-methylacrylato)-1:2κ^6^<i>O</i>:<i>O</i>';2:3κ^6^<i>O</i>:<i>O</i>'-nitrato-2κ^2^<i>O</i>:<i>O</i>'-dizinc(II)neodymium(III)","Acta Crystallographica Section E","2005","61","8","m1610","m1612","10.1107/S1600536805022841","","","0.71069","MoKα","","0.053","0.039","","","0.097","0.111","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206612","8.1435","0.0004","11.9365","0.0005","5.4158","0.0003","90","","90","","90","","526.44","0.04","30","","30","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","L-cysteine","","- C3 H7 N O2 S -","- C3 H7 N O2 S -","- C12 H28 N4 O8 S4 -","4","1","YA6256","Stephen A. Moggach; Stewart J. Clark; Simon Parsons","<small>L</small>-Cysteine-I at 30 K","Acta Crystallographica Section E","2005","61","8","o2739","o2742","10.1107/S1600536805023688","","","0.71073","MoKα","","0.018","0.017","","0.047","0.047","0.047","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206613","16.611","0.002","10.982","0.0013","16.728","0.002","90","","113.542","0.002","90","","2797.6","0.6","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[4-(Benzhydryloxy)piperidin-1-yl]-1-(4-tert-butylphenyl)butan-1-one","","- C32 H39 N O2 -","- C32 H39 N O2 -","- C128 H156 N4 O8 -","4","1","AC6182","Jing Cheng; Zhongzhen zhou; Guangfu Yang","4-[4-(Benzhydryloxy)piperidin-1-yl]-1-(4-<i>tert</i>-butylphenyl)butan-1-one","Acta Crystallographica Section E","2005","61","9","o2932","o2933","10.1107/S1600536805025353","","","0.71073","MoKα","","0.165","0.0581","","","0.1094","0.1392","","","","","","0.814","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206614","41.017","0.008","6.6341","0.0013","14.048","0.003","90","","99.733","0.003","90","","3767.6","1.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","O-[p-(2,2,4-Trimethylchroman-4-yl)phenyl]dimethylthiocarbamate","O-[4-(2,2,4-Trimethylchroman-4-yl)phenyl] N,N-dimethylthiocarbamate","","- C21 H25 N O2 S -","- C21 H25 N O2 S -","- C168 H200 N8 O16 S8 -","8","1","AC6188","Elise J. C. de Vries; Martin W. Bredenkamp; Tia Jacobs; Gareth O. Lloyd","<i>O</i>-[4-(2,2,4-Trimethylchroman-4-yl)phenyl] <i>N</i>,<i>N</i>-dimethylthiocarbamate","Acta Crystallographica Section E","2005","61","9","o2871","o2872","10.1107/S160053680502502X","","","0.71073","MoKα","","0.0844","0.071","","","0.1545","0.1608","","","","","","1.183","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206615","7.287","0.002","26.569","0.009","7.294","0.003","90","","95.59","0.007","90","","1405.5","0.8","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1,2-Dihydro-1,6-dimethylphenanthro[1,2-b]furan-10,11-dione hemihydrate","","- C18 H15 O3.5 -","- C18 H15 O3.5 -","- C72 H60 O14 -","4","2","AC6189","Zhi-Yun Du; Jiang-Ke Qin; Xue-Pu Mao; Lin Ma; Lian-Quan Gu","1,2-Dihydro-1,6-dimethylphenanthro[1,2-<i>b</i>]furan-10,11-dione hemihydrate","Acta Crystallographica Section E","2005","61","9","o2937","o2938","10.1107/S1600536805025365","","","0.71073","MoKα","","0.0631","0.0365","","","0.0898","0.1042","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206616","13.7639","0.0014","8.0723","0.0007","14.1519","0.0015","90","","109.028","0.008","90","","1486.5","0.3","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Morpholino-N-(p-tolylsulfonyl)ethylamine","","- C13 H20 N2 O3 S -","- C13 H20 N2 O3 S -","- C52 H80 N8 O12 S4 -","4","1","AT6022","Akbal, Tufan; Akdemir, Nesuhi; Ağar, Erbil; Erdönmez, Ahmet","2-Morpholino-<i>N</i>-(<i>p</i>-tolylsulfonyl)ethylamine","Acta Crystallographica Section E","2005","61","9","o2826","o2827","10.1107/S1600536805024657","","","0.71073","MoKα","","0.085","0.043","","","0.095","0.108","","","","","","0.9","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206617","21.9799","0.0015","6.9727","0.0004","20.77","0.0013","90","","90","","90","","3183.2","0.3","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Triethylaminium picrate","","- C12 H18 N4 O7 -","- C12 H18 N4 O7 -","- C96 H144 N32 O56 -","8","2","AT6023","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Krishnan SethuSankar; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar","Triethylaminium picrate","Acta Crystallographica Section E","2005","61","9","o2987","o2989","10.1107/S1600536805025870","","","1.54178","CuKα","","0.073","0.052","","","0.144","0.165","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206618","13.393","0.0016","6.8922","0.0008","15.497","0.0018","90","","90","","90","","1430.5","0.3","292","2","292","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","2-Ethoxy-3-isopropylbenzo[4,5]thieno[3,2-d]pyrimidin-4(3H)-one","","- C15 H16 N2 O2 S -","- C15 H16 N2 O2 S -","- C60 H64 N8 O8 S4 -","4","0.5","AT6024","Sheng-Zhen Xu; Min-Hui Cao; Yang-Gen Hu; Ming-Wu Ding; Wen-Jing Xiao","2-Ethoxy-3-isopropylbenzo[4,5]thieno[3,2-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","9","o2789","o2790","10.1107/S1600536805024177","","","0.71073","MoKα","","0.058","0.0436","","","0.113","0.122","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206619","23.4583","0.0009","3.8928","0.0002","7.5495","0.0003","90","","108.376","0.002","90","","654.25","0.05","90","0.2","90","0.2","","","","","","","","4","C 1 2 1","C 2y","5","3,3',5,5'-Tetrabromo-4,4'-dihydroxybiphenyl","3,3',5,5'-Tetrabromo-4,4'-dihydroxybiphenyl","","- C12 H6 Br4 O2 -","- C12 H6 Br4 O2 -","- C24 H12 Br8 O4 -","2","0.5","AT6026","Lehmler, H.-J.; Parkin, S.","3,3',5,5'-Tetrabromo-4,4'-dihydroxybiphenyl","Acta Crystallographica Section E","2005","61","9","o2828","o2830","10.1107/S160053680502458X","","","0.71073","MoKα","","0.024","0.022","","","0.047","0.048","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206620","14.253","0.0015","4.9385","0.0005","25.868","0.002","90","","119.826","0.002","90","","1579.6","0.3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Bis(4,4'-bipyridin-1-ium) bis(5-fluorouracil-1-acetate) monohydrate","bis(4,4'-bipyridin-1-ium) bis(5-fluoro-1,2,3,6-tetrahydro-2,6-dioxopyrimidine-3-acetate) monohydrate","","- C32 H28 F2 N8 O9 -","- C32 H28 F2 N8 O9 -","- C64 H56 F4 N16 O18 -","2","0.5","AT6028","Mao-Lin Hu","Bis(4,4'-bipyridin-1-ium) bis(5-fluorouracil-1-acetate) monohydrate","Acta Crystallographica Section E","2005","61","9","o3063","o3065","10.1107/S1600536805026851","","","0.71073","MoKα","","0.099","0.076","","","0.176","0.189","","","","","","1.17","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206621","6.358","0.002","9.382","0.003","24.646","0.008","90","","90","","90","","1470.2","0.8","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Methyl 4-tert-butoxycarbonyl-N-cyanopiperazine-1-carboximidothioate","","- C12 H20 N4 O2 S -","- C12 H20 N4 O2 S -","- C48 H80 N16 O8 S4 -","4","1","BD6009","Bi-Jian Lan; Peng Guo; Zhen-Guang Zou; Yin-Xiang Lu","Methyl 4-<i>tert</i>-butoxycarbonyl-<i>N</i>-cyanopiperazine-1-carboximidothioate","Acta Crystallographica Section E","2005","61","9","o3022","o3024","10.1107/S1600536805026280","","","0.71073","MoKα","","0.041","0.0336","","","0.0894","0.0975","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206622","10.117","0.005","10.401","0.005","13.934","0.007","90","","90","","90","","1466.2","1.3","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1S,4R)-N-[(S)-2-Hydroxy-1-phenylethyl]-7,7-dimethyl-2- oxobicyclo[2.2.1]heptane-1-carboxamide","","- C18 H23 N O3 -","- C18 H23 N O3 -","- C72 H92 N4 O12 -","4","1","BH6013","Cai, Yi-Min; Fang, Hua; Zeng, Qing-Le; Zhao, Yu-Fen","(1<i>S</i>,4<i>R</i>)-<i>N</i>-[(<i>S</i>)-2-Hydroxy-1-phenylethyl]-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxamide","Acta Crystallographica Section E","2005","61","9","o2833","o2835","10.1107/S1600536805024724","","","0.71073","Mo-Kα","","0.0449","0.0394","","","0.1109","0.1164","","","","","","1.233","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206623","7.8137","0.0009","11.0275","0.0012","13.9703","0.0015","80.796","0.002","75.547","0.002","76.001","0.002","1124.7","0.2","292","2","292","2","","","","","","","","3","P -1","-P 1","2","","Diethyl 2-(1,3-benzodioxol-5-yl)-5-(3,4-dimethoxyphenyl)furan-3,4-dicarboxylate","","- C25 H24 O9 -","- C25 H24 O9 -","- C50 H48 O18 -","2","1","BH6017","Hu, Sheng-Li; Wang, Zhi-Guo; Wu, An-Xin","Diethyl 2-(1,3-benzodioxol-5-yl)-5-(3,4-dimethoxyphenyl)furan-3,4-dicarboxylate","Acta Crystallographica Section E","2005","61","9","o2801","o2803","10.1107/S1600536805024335","","","0.71073","MoKα","","0.0611","0.0446","","","0.1165","0.1257","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206624","14.149","0.002","10.1346","0.0015","13.3806","0.0018","90","","90","","90","","1918.7","0.5","292","2","292","2","","","","","","","","4","C m c a","-C 2ac 2","64","","2,2,6,6-Tetramethyl-piperidin-4-ol","","- C9 H19 N O -","- C9 H19 N O -","- C72 H152 N8 O8 -","8","","BH6018","Nengfang, She; Huizhen Guo; Guodong Yin; Anxin Wu","2,2,6,6-Tetramethylpiperidin-4-ol","Acta Crystallographica Section E","2005","61","9","o2902","o2903","10.1107/S1600536805024372","","","0.71073","MoKα","","0.0854","0.0525","","","0.108","0.1202","","","","","","0.877","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206625","6.7467","0.0011","14.609","0.002","17.785","0.003","90","","90","","90","","1752.9","0.5","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-[(4-Hydroxy-3-methoxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1,2- dihydropyrazol-3-one","","- C19 H19 N3 O3 -","- C19 H19 N3 O3 -","- C76 H76 N12 O12 -","4","1","BH6020","Wen, Puhong","4-[(4-Hydroxy-3-methoxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one","Acta Crystallographica Section E","2005","61","9","o2918","o2920","10.1107/S1600536805025559","","","0.71073","MoKα","","0.0642","0.0395","","","0.0959","0.1076","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206626","6.319","0.002","8.153","0.003","11.529","0.004","90","","100.786","0.004","90","","583.5","0.3","202","2","202","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrachlorobis(dimethylamine)tin(IV)","","- C4 H14 Cl4 N2 Sn -","- C4 H14 Cl4 N2 Sn -","- C8 H28 Cl8 N4 Sn2 -","2","0.5","BR6205","Zhang, Yong; Tong, Hong-Bo; Liu, Dian-Sheng; Huang, Su-Ping; Zhou, Mei-Su","Tetrachlorobis(dimethylamine)tin(IV)","Acta Crystallographica Section E","2005","61","9","m1697","m1698","10.1107/S1600536805024232","","","0.71073","MoKα","","0.0565","0.0499","","","0.105","0.1081","","","","","","1.167","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206627","32.459","0.003","9.408","0.001","19.053","0.002","90","","90","","90","","5818.3","1","293","2","293","2","","","","","","","","6","I b a 2","I 2 -2c","45","","[2-(Benzimidazol-2-yl)phenolato]zinc(II)‒[2-(benzimidazol-2- yl)phenolato][2-(benzimidazol-2-yl)-4-bromophenolato]zinc(II)‒ethanol‒water (0.67/0.33/2/0.5)","","- C30 H30.67 Br0.33 N5 O4.5 Zn -","- C30 H30.67 Br0.33 N4 O4.5 Zn -","- C240 H245.36 Br2.64 N32 O36 Zn8 -","8","1","BR6209","Tong, Yi-Ping","Bis[2-(benzimidazol-2-yl)phenolato]zinc(II)‒[2-(benzimidazol-2-yl)phenolato][2-(benzimidazol-2-yl)-4-bromophenolato]zinc(II)‒ethanol‒water (0.67/0.33/2/0.5)","Acta Crystallographica Section E","2005","61","9","m1771","m1773","10.1107/S1600536805025328","","","0.71073","MoKα","","0.1355","0.0645","","","0.1657","0.2086","","","","","","0.951","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2206628","7.6309","0.0005","15.724","0.001","23.972","0.002","90","","93.235","0.001","90","","2871.7","0.3","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(2,6-diacetylpyridine bis(S-benzyldithiocarbazate-κ^5^N,N,N,S,S) dichloro tin(IV)","","- C25 H23 Cl2 N5 S4 Sn -","- C25 H23 Cl2 N5 S4 Sn -","- C100 H92 Cl8 N20 S16 Sn4 -","4","0.5","BR6210","Sousa, Gerimário F. de; Valdés Martínez, Jesús; Hernández-Ortega, Simón","A seven-coordinated tin(IV) complex: dichloro[2,6-diacetylpyridine bis(<i>S</i>-benzyldithiocarbazato- κ^5^<i>S</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>S</i>']tin(IV)","Acta Crystallographica, Section E","2005","61","9","o2921","o2923","10.1107/S1600536805025493","","","0.71073","MoKα","","0.0395","0.0309","","","0.0568","0.0585","","","","","","0.935","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206629","11.841","0.0007","12.594","0.0008","17.8365","0.0008","90","","123.817","0.003","90","","2209.9","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aqua(1,10-phenanthroline)bis(trichloroacetato)copper(II)","","- C16 H10 Cl6 Cu N2 O5 -","- C16 H10 Cl6 Cu N2 O5 -","- C64 H40 Cl24 Cu4 N8 O20 -","4","1","BR6211","Ping Yin; Mao-Lin Hu; Qian Miao","Aqua(1,10-phenanthroline)bis(trichloroacetato)copper(II)","Acta Crystallographica Section E","2005","61","9","m1854","m1856","10.1107/S1600536805026644","","","0.71073","MoKα","","0.0914","0.0833","","","0.1633","0.1674","","","","","","1.307","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206630","8.0147","0.0012","9.2276","0.0012","21.728","0.002","92.049","0.01","94.86","0.011","109.283","0.012","1507.8","0.4","295","2","","","","","","","","","","5","P -1","-P 1","2","","μ-Oxalato-κ^4^O^1^,O^2^:O^1'^,O^2'^-bis[aqua(2,2'-bipyridyl- κ^2^N,N')copper(II)] bis(hydrogen squarate)","","- C30 H22 Cu2 N4 O14 -","- C30 H22 Cu2 N4 O14 -","- C60 H44 Cu4 N8 O28 -","2","1","BT6702","Reinoso, Santiago; Vitoria, Pablo; San Felices, Leire; Lezama, Luis; Gutiérrez-Zorrilla, Juan M.","μ-Oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^-bis[aqua(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')copper(II)] bis(hydrogen squarate)","Acta Crystallographica Section E","2005","61","9","m1677","m1679","10.1107/S1600536805024165","","","0.71073","MoKα","","0.1044","0.0416","","","0.074","0.0808","","","","","","0.764","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206631","24.643","0.002","9.394","0.001","18.857","0.001","90","","101.97","0.01","90","","4270.4","0.6","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Di-μ-propionato-bis[dicarbonyl(triphenylphosphine)ruthenium(I)](Ru—Ru)","","- C46 H40 O8 P2 Ru2 -","- C46 H40 O8 P2 Ru2 -","- C184 H160 O32 P8 Ru8 -","4","0.5","BT6705","Rubén Gaviño; Sylvain Pellegrini; Yves Castanet; André Mortreux","Di-μ-propionato-bis[dicarbonyl(triphenylphosphine)ruthenium(I)](<i>Ru{—</i>Ru})","Acta Crystallographica Section E","2005","61","9","m1762","m1764","10.1107/S160053680502427X","","","0.71073","MoKα","","0.0581","0.0374","","","0.0796","0.089","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206632","9.626","0.002","11.675","0.002","14.062","0.003","90","","104.762","0.004","90","","1528.2","0.5","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-methyl-N-(ferrocenylmethyl)aniline","","- C18 H19 Fe N -","- C18 H19 Fe N -","- C72 H76 Fe4 N4 -","4","1","BT6706","Ying-Jie Li; Hong-Xing Wang; Jian-Feng Hou","<i>N</i>-Methyl-<i>N</i>-(ferrocenylmethyl)aniline","Acta Crystallographica Section E","2005","61","9","m1785","m1786","10.1107/S1600536805025262","","","0.71073","MoKα","","0.0654","0.0389","","","0.0864","0.1002","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206633","17.2192","0.0013","18.0407","0.0014","15.4424","0.0012","90","","90","","90","","4797.1","0.6","295","2","295","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","2-Methoxy-4-(phenyliminomethyl)phenol","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C224 H208 N16 O32 -","16","2","BT6708","Lin, Zhi-Dong; Lin, Zhi-Dong; Li, Xing; Huang, Ya-min","2-Methoxy-4-(phenyliminomethyl)phenol","Acta Crystallographica Section E","2005","61","9","o3032","o3033","10.1107/S1600536805026164","","","0.71073","MoKα","","0.0419","0.0358","","","0.0892","0.0934","","","","","","1.154","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206634","8.6501","0.0008","25.738","0.002","10.9358","0.001","90","","97.901","0.002","90","","2411.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4'-(4-Methoxyphenyl)-1'-methyl-9H-fluorene-9-spiro-3'-pyrrolidine-2'-spiro- 2''-indane-1'',3''-dione","","- C32 H25 N O3 -","- C32 H25 N O3 -","- C128 H100 N4 O12 -","4","1","BT6709","A. Subbiahpandi; S. Selvanayagam; D. Velmurugan; K. Ravikumar; J. Jayashankaran; R. Raghunathan","4'-(4-Methoxyphenyl)-1'-methyl-9<i>H</i>-fluorene-9-spiro-3'-pyrrolidine-2'-spiro-2''-indan-1'',3''-dione","Acta Crystallographica Section E","2005","61","9","o3059","o3060","10.1107/S1600536805026401","","","0.71073","MoKα","","0.0987","0.0626","","","0.1432","0.161","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206635","6.2396","0.0004","15.4657","0.001","22.332","0.0014","90","","90","","90","","2155","0.2","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-(4-fluorophenyl)-3(R)-[3-(4-fluorophenyl)-3(S)-hydroxypropyl]-4(S)- (4-hydroxyphenyl)azetidin-2-one monohydrate","","- C24 H23 F2 N O4 -","- C24 H23 F2 N O4 -","- C96 H92 F8 N4 O16 -","4","1","BT6710","Ravikumar, Krishnan; Sridhar, Balasubramanian","Ezetimibe monohydrate","Acta Crystallographica Section E","2005","61","9","o2907","o2909","10.1107/S1600536805025419","","","0.71073","MoKα","","0.0456","0.0408","","","0.0882","0.0903","","","","","","1.166","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206636","5.5","0.005","7.794","0.005","22.961","0.005","81.893","0.005","83.761","0.005","78.102","0.005","950.3","1.1","263","2","263","2","","","","","","","","5","P -1","-P 1","2","[C~12~mim]Br.H~2~O","1-Dodecyl-3-methylimidazolium bromide monohydrate","","- C16 H33 Br N2 O -","- C16 H33 Br N2 O -","- C32 H66 Br2 N4 O2 -","2","1","BT6712","Getsis, Anna; Mudring, Anja-Verena","1-Dodecyl-3-methylimidazolium bromide monohydrate","Acta Crystallographica Section E","2005","61","9","o2945","o2946","10.1107/S1600536805025717","","","0.71073","MoKα","","0.035","0.0263","","","0.0652","0.0694","","","","","","1.037","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206637","4.4286","0.0004","7.4756","0.0006","12.4664","0.0012","96.032","0.004","98.347","0.004","96.155","0.004","402.93","0.06","133","2","133","2","","","","","","","","3","P -1","-P 1","2","","2,2''-bis(bromomethyl)-p-terphenyl","","- C20 H16 Br2 -","- C20 H16 Br2 -","- C20 H16 Br2 -","1","0.5","BT6714","Jones, Peter G.; Kuś, Piotr","2,2''-Bis(bromomethyl)-<i>p</i>-terphenyl","Acta Crystallographica Section E","2005","61","9","o2947","o2948","10.1107/S1600536805025614","","","0.71073","MoKα","","0.0317","0.0246","","","0.0554","0.0573","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206638","23.4523","0.0015","23.4523","0.0015","25.4022","0.0018","90","","90","","120","","12099.7","1.4","170","2","170","2","","","","","","","","4","R -3 :H","-R 3","148","Tris(o-methylthiophenyl)phosphine","Tris[2-(methylsulfanyl)phenyl]phosphine","","- C21 H21 P S3 -","- C21 H21 P S3 -","- C504 H504 P24 S72 -","24","1.33333","BT6715","Uttecht, Jan-Georg; Tuczek, Felix; Näther, Christian","Tris[2-(methylsulfanyl)phenyl]phosphine","Acta Crystallographica Section E","2005","61","9","o2916","o2917","10.1107/S1600536805025602","","","0.71073","MoKα","","0.0688","0.0539","","","0.1279","0.1352","","","","","","1.035","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206639","7.3463","0.00018","8.58832","0.00018","9.414","0.0002","74.888","0.002","89.897","0.001","85.238","0.001","571.31","0.02","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","Dichloro[bis(2-pyridyl)amine]zinc(II)","","- C10 H9 Cl2 N3 Zn -","- C10 H9 Cl2 N3 Zn -","- C20 H18 Cl4 N6 Zn2 -","2","1","BT6716","Lutz, Martin; Spek, Anthony L.; Bruijnincx, Pieter C. A.; Klein Gebbink, Robertus J. M.; van Koten, Gerard","Dichloro(di-2-pyridylamine)zinc(II): a redetermination at 110 K","Acta Crystallographica Section E","2005","61","9","m1813","m1815","10.1107/S1600536805025973","","","0.71073","MoKα","","0.0245","0.0196","","","0.0453","0.047","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206640","13.092","0.004","15.041","0.005","8.256","0.003","90","","98.649","0.007","90","","1607.3","0.9","120","2","120","2","","","","","","","","3","C 1 c 1","C -2yc","9","","2'-Hydroxy-4,4',5',6'-tetramethoxychalcone","","- C19 H20 O6 -","- C19 H20 O6 -","- C76 H80 O24 -","4","1","BT6717","Wafo, Pascal; Hussain, Hidayat; Kouam, Simeon F.; Ngadjui, Bonaventure T.; Flörke, Ulrich; Krohn, Karsten","2'-Hydroxy-4,4',5',6'-tetramethoxychalcone","Acta Crystallographica Section E","2005","61","9","o3017","o3019","10.1107/S1600536805026292","","","0.71073","MoKα","","0.0859","0.0504","","","0.0814","0.0884","","","","","","0.908","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206641","21.075","0.002","7.4723","0.0007","8.2054","0.0007","90","","97.524","0.002","90","","1281.1","0.2","133","2","133","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","rac-(1R,1aR,4S,6aS)-Ethyl 4-carboxy-1,1a,2,3,4,5,6,6a-octahydrocyclopropa[f]indene-1-carboxylate","","- C14 H18 O4 -","- C14 H18 O4 -","- C56 H72 O16 -","4","1","BT6719","Jones, Peter G.; Hopf, Henning; Hussain, Zakir","<i>rac</i>-(1<i>R</i>,1a<i>R</i>,4<i>S</i>,6a<i>S</i>)-Ethyl 4-carboxy-1,1a,2,3,4,5,6,6a-octahydrocyclopropa[<i>f</i>]indene-1-carboxylate","Acta Crystallographica Section E","2005","61","9","o3034","o3035","10.1107/S1600536805026565","","","0.71073","MoKα","","0.0975","0.0448","","","0.0904","0.1077","","","","","","0.78","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206642","7.8212","0.0016","46.154","0.004","6.7885","0.0008","90","","90","","90","","2450.5","0.6","295","2","","","","","","","","","","4","P 21 21 2","P 2 2ab","18","","N,N'-Diethyl-4,4'-dinitrohydrazobenzene","","- C16 H18 N4 O4 -","- C16 H18 N4 O4 -","- C96 H108 N24 O24 -","6","1.5","BT6721","Liu, Wei; Ma, Yuan; Wang, Ru-Ji; Yin, Ying-Wu; Zhao, Yu-Fen","<i>N</i>,<i>N</i>'-Diethyl-4,4'-dinitrohydrazobenzene","Acta Crystallographica Section E","2005","61","9","o3069","o3070","10.1107/S1600536805026863","","","0.71073","MoKα","","0.0859","0.047","","","0.0888","0.1071","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206643","8.2896","0.0014","9.7588","0.0016","10.5669","0.0017","90.153","0.003","109.629","0.002","101.455","0.002","786.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[N-Methyl-N-(3-nitrophenyl)aminomethyl]ferrocene","","- C18 H18 Fe N2 O2 -","- C18 H18 Fe N2 O2 -","- C36 H36 Fe2 N4 O4 -","2","1","BT6723","Hong-Xing Wang; Ying-Jie Li; Hong-Fei Wu; Hui-Chao Zhou; Ren-Qing Gao; Feng-Ying Geng","[<i>N</i>-Methyl-<i>N</i>-(3-nitrophenyl)aminomethyl]ferrocene","Acta Crystallographica Section E","2005","61","9","m1871","m1872","10.1107/S160053680502711X","","","0.71073","MoKα","","0.032","0.027","","","0.0686","0.0728","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206644","10.4862","0.0003","15.1938","0.0002","17.4233","0.0003","90","","99.01","0.002","90","","2741.72","0.1","299","2","","","","","","","","","","7","C 1 c 1","C -2yc","9","","[μ~2~-bis(salicylidene)propane-1,3- diaminato]dichlorobis(N,N-dimethylformamide)nickel(II)}zinc(II)","","- C23 H30 Cl2 N4 Ni O4 Zn -","- C23 H30 Cl2.001 N4 Ni O4 Zn -","- C92 H120 Cl8.004 N16 Ni4 O16 Zn4 -","4","1","BV6019","Ercan, Filiz","A new Ni‒Zn heterodinuclear complex: [μ~2~-bis(salicylidene)propane-1,3-diaminato]dichlorobis(<i>N</i>,<i>N</i>-dimethylformamide)nickel(II)zinc(II)","Acta Crystallographica Section E","2005","61","9","m1804","m1806","10.1107/S1600536805025821","","","0.71073","MoKα","","","0.0361","","","","0.0996","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206645","10.016","0.001","12.174","0.001","13.848","0.001","96.983","0.002","101.346","0.002","99.316","0.002","1613","0.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","cis-diaquabis(1,10-phenanthroline)nickel(II) 5-sulfonatosalicylate tetrahydrate","","- C31 H32 N4 Ni O12 S -","- C31 H32 N4 Ni O12 S -","- C62 H64 N8 Ni2 O24 S2 -","2","1","BV6023","Chen, Jian-Mei; Fan, Sai-Rong; Zhu, Long-Guan","<i>cis</i>-Diaquabis(1,10-phenanthroline)nickel(II) 5-sulfonatosalicylate tetrahydrate","Acta Crystallographica Section E","2005","61","9","m1724","m1726","10.1107/S1600536805024694","","","0.71073","MoKα","","0.0518","0.0469","","","0.1108","0.1137","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206646","9.5225","0.0016","8.6825","0.0015","19.21","0.003","90","","99.91","0.03","90","","1564.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-poly[[bis(1H-imidazole-κN^3^)zinc(II)]-μ-5-nitrobenzene- 1,3-dicarboxylato-κ^2^O^1^:O^3^]","","- C14 H11 N5 O6 Zn -","- C14 H11 N5 O6 Zn -","- C56 H44 N20 O24 Zn4 -","4","1","BV6024","Zhang, Hong-Tao; Li, Yi-Zhi; Xu, Li; You, Xiao-Zeng","A one-dimensional herring-bone coordination polymer, <i>catena</i>-poly[[bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II)]-μ-5-nitrobenzene-1,3-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^]","Acta Crystallographica Section E","2005","61","9","m1727","m1729","10.1107/S1600536805024876","","","0.71073","MoKα","","0.0747","0.0556","","","0.0903","0.0954","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206647","10.2197","0.0004","10.2197","0.0004","28.3118","0.0014","90","","90","","120","","2560.79","0.19","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","Hexakis(1-oxido-1H-benzotriazol-3-ium-κO)iron(III) tris(perchlorate) acetonitrile disolvate","","- C40 H36 Cl3 Fe N20 O18 -","- C40 H36 Cl3 Fe N20 O18 -","- C80 H72 Cl6 Fe2 N40 O36 -","2","0.166667","BV6025","Zhang, Xian-Ming","Hexakis(1-oxido-1<i>H</i>-benzotriazol-3-ium-κ<i>O</i>)iron(III) tris(perchlorate) acetonitrile disolvate","Acta Crystallographica, Section E","2005","61","9","o1799","o1800","10.1107/S1600536805025882","","","0.71073","MoKα","","0.0558","0.0411","","","0.0965","0.1136","","","","","","1.142","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206648","13.413","0.002","13.115","0.002","7.104","0.001","90","","90","","90","","1249.7","0.3","291","2","291","2","","","","","","","","4","P c a 21","P 2c -2ac","29","N-3-nitrobenzylidene-p-toluidine N-p-toluidene-3-nitrobenzeneamine","N-[(3-nitrophenyl)methylene]-4-methylbenzenamine N-(4-methylphenyl)-3-nitrobenzylideneamine","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","1","BV6026","Wen Yang; Yan Zhang; De-Chun Zhang","<i>N</i>-(3-Nitrobenzylidene)-<i>p</i>-toluidine","Acta Crystallographica Section E","2005","61","9","o2964","o2966","10.1107/S160053680502581X","","","0.71073","MoKα","","0.0606","0.0362","","","0.0762","0.0838","","","","","","0.927","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206649","8.9037","0.0016","9.1916","0.0015","13.95","0.002","105.927","0.012","91.443","0.013","110.871","0.014","1016.1","0.3","100","","100","","","","","","","","","5","P -1","-P 1","2","Mercapto-N-phenylformimidoyl-1-ethyl-3-(2-morpholinoethyl)benzimidazoliniuum inner salt","[1-ethyl-3-(2-morpholinoethyl)benzimidazolio](phenylimino)methanethiolate","","- C22 H26 N4 O S -","- C22 H26 N4 O S -","- C44 H52 N8 O2 S2 -","2","1","CF6448","Mehmet Akkurt; Selvi Karaca; Hasan Küçükbay; Ülkü Yılmaz; Orhan Büyükgüngör","Mercapto-<i>N</i>-phenylformimidoyl-1-ethyl-3-(2-morpholinoethyl)benzimidazolinium inner salt","Acta Crystallographica Section E","2005","61","9","o2875","o2877","10.1107/S1600536805024852","","","0.71073","MoKα","","0.1294","0.0741","","","0.1548","0.1834","","","","","","1.012","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206650","9.2564","0.0015","9.7534","0.0015","11.4425","0.0018","65.621","0.002","75.971","0.003","76.993","0.002","903.7","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","9,10-Bis[3-(2-pyridylmethyl)imidazolium-1-ylmethyl]anthracene bis(hexafluorophosphate)","","- C34 H30 F12 N6 P2 -","- C34 H30 F12 N6 P2 -","- C34 H30 F12 N6 P2 -","1","0.5","CI6612","Yong-Sheng Liu; Feng-Bo Xu; Jun-Wen Wang; Qing-Shan Li; Hai-Bin Song; Zheng-Zhi Zhang","9,10-Bis[3-(2-pyridylmethyl)imidazolium-1-ylmethyl]anthracene bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","9","o2930","o2931","10.1107/S1600536805023196","","","0.71073","MoKα","","0.1032","0.0647","","","0.1856","0.2185","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206651","21.08","0.02","10.927","0.011","12.767","0.009","90","","111.12","0.02","90","","2743","4","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-[4-(Pyrrolidin-1-ylcarbonylmethoxy)phenyl]acetamide","","- C14 H18 N2 O3 -","- C14 H18 N2 O3 -","- C112 H144 N16 O24 -","8","1","CI6620","Sundar, T. V.; Parthasarathi, V.; Walfort, B.; Lang, H.; Piplani, P.; Malik, R.","<i>N</i>-[4-(Pyrrolidin-1-ylcarbonylmethoxy)phenyl]acetamide","Acta Crystallographica Section E","2005","61","9","o2868","o2870","10.1107/S1600536805024979","","","0.71073","MoKα","","0.0932","0.0588","","","0.1582","0.1825","","","","","","1.037","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206652","10.272","0.003","10.646","0.003","17.697","0.005","103.948","0.005","95.457","0.005","92.632","0.005","1864.9","0.9","273","2","273","2","","","","","","","","4","P -1","-P 1","2","magnolol","5,5'-Diallylbiphenyl-2,2'-diol‒1,4-diazabicyclo[2.2.2]octane (2/1)","","- C42 H48 N2 O4 -","- C42 H48 N2 O4 -","- C84 H96 N4 O8 -","2","1","CI6621","Zhi-Min Jin; Li Li; Bing Tu; Mao-Lin Hu","5,5'-Diallylbiphenyl-2,2'-diol‒1,4-diazabicyclo[2.2.2]octane (2/1)","Acta Crystallographica Section E","2005","61","9","o2939","o2941","10.1107/S1600536805025638","","","0.71073","MoKα","","0.0788","0.0556","","","0.1176","0.1233","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206653","7.7015","0.0003","7.8357","0.0003","21.1617","0.0007","90","","99.9257","0.0017","90","","1257.92","0.08","173","1","173","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","PCB 84","2,2',3,3',6-Pentachlorobiphenyl","","- C12 H5 Cl5 -","- C12 H5 Cl5 -","- C48 H20 Cl20 -","4","1","CI6622","Lehmler, H.-J.; Robertson, L.W.; Parkin, S.","2,2',3,3',6-Pentachlorobiphenyl (PCB 84)","Acta Crystallographica Section E","2005","61","9","o3025","o3026","10.1107/S1600536805025900","","","0.71073","MoKα","","0.045","0.0322","","","0.0733","0.0777","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206654","14.86","0.003","13.56","0.002","24.959","0.005","90","","90","","90","","5029.3","1.6","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis[4-chloro-2-(cyclohexyliminomethyl)phenolato]cobalt(II)","","- C26 H30 Cl2 Co N2 O2 -","- C26 H30 Cl2 Co N2 O2 -","- C208 H240 Cl16 Co8 N16 O16 -","8","1","CI6623","Li, Zong-Xiao; Zhang, Xin-Li","Bis[4-chloro-2-(cyclohexyliminomethyl)phenolato]cobalt(II)","Acta Crystallographica Section E","2005","61","9","o2806","o2807","10.1107/S1600536805024384","","","0.71073","MoKα","","0.0727","0.0345","","","0.0631","0.069","","","","","","0.846","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206655","8.414","0.002","9.513","0.002","10.497","0.002","102.57","0.03","96.58","0.03","97.08","0.03","805.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-Cyclopropyl-6-fluoro-7-(4-formylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3- carboxylic acid","","- C18 H18 F N3 O4 -","- C18 H18 F N3 O4 -","- C36 H36 F2 N6 O8 -","2","1","CI6625","Xian-Wen Li; Feng Zhi; Jian-Hua Shen; Yi-Qiao Hu","1-Cyclopropyl-6-fluoro-7-(4-formylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid. Corrigendum","Acta Crystallographica Section E","2005","61","9","e3","e3","10.1107/S1600536805024426","","","0.71073","MoKα","","0.1092","0.0498","","","0.116","0.14","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206656","8.356","0.002","21.62","0.005","8.153","0.002","90","","105.592","0.004","90","","1418.7","0.6","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(4-Nitrophenyl)-9H-carbazole","","- C18 H12 N2 O2 -","- C18 H12 N2 O2 -","- C72 H48 N8 O8 -","4","1","CI6626","Chen, Lian-Qing; Yang, Chu-Luo; Meng, Xiang-Gao; Qin, Jin-Gui","9-(4-Nitrophenyl)-9<i>H</i>-carbazole","Acta Crystallographica Section E","2005","61","9","o3073","o3075","10.1107/S160053680502708X","","","0.71073","MoKα","","0.0646","0.0453","","","0.1107","0.1196","","","","","","0.964","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206657","9.993","0.002","14.223","0.003","10.175","0.002","90","","90","","90","","1446.2","0.5","293","2","293","2","","","","","","","","5","P n c 2","P 2 -2bc","30","Thionordazepam","7-Chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-thione","","- C15 H11 Cl N2 S -","- C15 H11 Cl N2 S -","- C60 H44 Cl4 N8 S4 -","4","1","CI6627","Narasegowda, R. S.; Vijaya, T.; Yathirajan, H. S.; Nagaraja, P.; Narasimhamurthy, T.; Rathore, R. S.","Thionordazepam: strong intermolecular N—H···N hydrogen-bonded chains","Acta Crystallographica Section E","2005","61","9","o2934","o2936","10.1107/S1600536805025286","","","0.71073","MoKα","","0.1507","0.0615","","","0.1143","0.1416","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206658","7.9738","0.0017","36.351","0.008","11.875","0.003","90","","92.012","0.003","90","","3439.9","1.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","3β-E-feruloyllupeol","1-Isopropenyl-3a,5a,5b,8,8,11a-hexamethylicosahydro-1H-cyclopenta[a]chrysen- 9-yl 4-hydroxy-3-methoxycinnamate","","- C40 H58 O4 -","- C40 H58 O4 -","- C160 H232 O16 -","4","2","CI6628","Charoen Pakhathirathien; Suchada Chantrapromma; Hoong-Kun Fun; Shazia Anjum; Attar-ur-Rahman; Chachanok Karalai","1-Isopropenyl-3a,5a,5b,8,8,11a-hexamethylicosahydro-1<i>H</i>-cyclopenta[<i>a</i>]chrysen-9-yl 4-hydroxy-3-methoxycinnamate","Acta Crystallographica Section E","2005","61","9","o2942","o2944","10.1107/S1600536805025584","","","0.71073","MoKα","","0.0992","0.0893","","","0.2562","0.2642","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206659","14.848","0.002","13.567","0.002","24.993","0.005","90","","90","","90","","5034.7","1.4","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis[4-chloro-2-(cyclohexyliminomethyl)phenolato]zinc(II)","","- C26 H30 Cl2 N2 O2 Zn -","- C26 H30 Cl2 N2 O2 Zn -","- C208 H240 Cl16 N16 O16 Zn8 -","8","1","CI6629","Li, Zong-Xiao; Zhang, Xin-Li","Bis[4-chloro-2-(cyclohexyliminomethyl)phenolato]zinc(II)","Acta Crystallographica Section E","2005","61","9","m1755","m1756","10.1107/S1600536805025250","","","0.71073","MoKα","","0.0899","0.0373","","","0.0661","0.0746","","","","","","0.901","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206660","7.592","0.004","14.147","0.007","11.342","0.007","90","","95.231","0.002","90","","1213.1","1.2","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","CI6630","Mahendra, M; Khanum, S. A.; Singh, A.; Shashikanth, S.; Doreswamy, B. H.; Sridhar, M. A.; Shashidhara Prasad, J.","(4-Methoxyphenyl)(2-methylphenyl)methanone","Acta Crystallographica Section E","2005","61","9","o2990","o2991","10.1107/S1600536805025912","","","0.71073","MoKα","","0.0555","0.0476","","","0.1278","0.1427","","","","","","1.189","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206661","12.428","0.001","8.755","0.001","20.048","0.001","90","","104.2","0.01","90","","2114.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H58 N8 Ni O16 -","- C34 H58 N8 Ni O16 -","- C68 H116 N16 Ni2 O32 -","2","0.5","CI6631","You, Zhong-Lu","Bis{2-[3-(cyclohexylaminio)propyliminomethyl]-4-nitrophenolato}dimethanolnickel(II) dinitrate dihydrate","Acta Crystallographica Section E","2005","61","9","m1807","m1809","10.1107/S1600536805026024","","","0.71073","MoKα","","0.0465","0.0384","","","0.1017","0.1068","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206662","6.6848","0.0009","5.1036","0.0007","19.596","0.003","90","","92.848","0.002","90","","667.72","0.16","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N,N'-diphenylsuccinamide","","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C32 H32 N4 O4 -","2","0.5","CI6632","Shazia Anjum; M. Iqbal Choudhary; Shamsher Ali; Hoong-Kun Fun; Atta-ur-Rahman","<i>N</i>,<i>N</i>'-Diphenylsuccinamide","Acta Crystallographica Section E","2005","61","9","o3001","o3002","10.1107/S1600536805025924","","","0.71073","MoKα","","0.0442","0.0409","","","0.1101","0.1143","","","","","","1.161","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206663","8.094","0.005","9.468","0.006","13.152","0.008","104.657","0.009","92.706","0.008","115.133","0.008","868.9","0.9","293","2","566","2","","","","","","","","4","P -1","-P 1","2","","4-(4-ethoxyphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole","","- C20 H17 N5 O -","- C20 H17 N5 O -","- C40 H34 N10 O2 -","2","1","CI6635","Zhang, Shu-Ping; Liu, Zhao-Di; Yang, Song; Qiu, Xiao-Yang; Shao, Si-Chang","4-(4-Ethoxyphenyl)-3,5-di-2-pyridyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","9","o3108","o3109","10.1107/S1600536805026541","","","0.71073","MoKα","","0.0745","0.0457","","","0.1097","0.1203","","","","","","0.873","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206664","7.819","0.0007","10.5726","0.0009","21.836","0.0019","90","","90","","90","","1805.1","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Ent-kaurane","16β,17-Dihydroxy-ent-kauran-19-oic acid","","- C20 H32 O4 -","- C20 H32 O4 -","- C80 H128 O16 -","4","1","CI6636","Nasir Rasool; Viqar Uddin Ahmad; M. Iqbal Choudhary; Shazia Anjum; Hoong-Kun Fun; Shamsher Ali","16β,17-Dihydroxy-<i>ent</i>-kauran-19-oic acid","Acta Crystallographica Section E","2005","61","9","o3053","o3055","10.1107/S1600536805026528","","","0.71073","MoKα","","0.0332","0.0325","","","0.0863","0.0874","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206665","7.303","0.001","8.009","0.001","11.995","0.001","100.181","0.001","101.946","0.001","100.855","0.001","656.9","0.13","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Dichloro[N,N'-dimethyl-N'-(2-pyridylmethylidene)ethane-1,2-diamine]copper(II)","","- C10 H15 Cl2 Cu N3 -","- C10 H15 Cl2 Cu N3 -","- C20 H30 Cl4 Cu2 N6 -","2","1","CI6639","Yuan, Wen-Bing; Zhang, Qi","Dichloro[<i>N</i>,<i>N</i>-dimethyl-<i>N</i>'-(2-pyridylmethylidene)ethane-1,2-diamine]copper(II)","Acta Crystallographica Section E","2005","61","9","m1883","m1884","10.1107/S1600536805026814","","","0.71073","MoKα","","0.0276","0.0253","","","0.0586","0.06","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206666","20.0802","0.0003","7.136","0.0001","20.7415","0.0003","90","","114.399","0.001","90","","2706.66","0.07","100","0.1","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5-hydroxy-3,7-dimethoxyflavone","5-Hydroxy-3,7-dimethoxy-2-phenyl-4H-1-benzopyran-4-one","","- C17 H14 O5 -","- C17 H14 O5 -","- C136 H112 O40 -","8","2","CI6644","Hoong-Kun Fun; Abdul Razak Ibrahim; Nawong Boonnak; Surat Laphookhieo; Suchada Chantrapromma","5-Hydroxy-3,7-dimethoxy-2-phenyl-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section E","2005","61","9","o3086","o3088","10.1107/S1600536805026991","","","0.71073","MoKα","","0.0567","0.0448","","","0.1282","0.1421","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206667","4.474","0.0008","7.663","0.0008","16.463","0.002","94.685","0.011","94.945","0.009","98.276","0.013","553.93","0.14","122","2","122","2","","","","","","","","4","P -1","-P 1","2","2,3-Bis(bromomethyl)-1,4-dimethoxybenzene","2,3-Bis(bromomethyl)-1,4-dimethoxybenzene","","- C10 H12 Br2 O2 -","- C10 H12 Br2 O2 -","- C20 H24 Br4 O4 -","2","1","CV6550","Peter Hammershøj; Jørn B. Christensen","2,3-Bis(bromomethyl)-1,4-dimethoxybenzene","Acta Crystallographica Section E","2005","61","9","o2839","o2840","10.1107/S1600536805025079","","","0.71073","MoKα","","0.0447","0.0285","","","0.0564","0.0634","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206668","7.1449","0.0008","12.1932","0.0007","15.79","0.002","102.435","0.004","98.938","0.006","92.123","0.005","1323.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-Dimethylamminiomethyl-6,8-dimethyl-2-phenyl-1,2- dihydroimidazo[1,2-a][1,8]naphthyridine picrate monohydrate","","- C27 H27 N7 O8 -","- C27 H27 N7 O8 -","- C54 H54 N14 O16 -","2","1","CV6551","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Krishnan SethuSankar; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar","1-Dimethylammoniomethyl-6,8-dimethyl-2-phenyl-1,2-dihydroimidazo[1,2-<i>a</i>][1,8]naphthyridine picrate monohydrate","Acta Crystallographica Section E","2005","61","9","o2910","o2912","10.1107/S160053680502547X","","","1.54178","CuKα","","0.0611","0.0539","","","0.1525","0.1589","","","","","","1.099","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206669","16.566","0.0009","17.142","0.0016","8.672","0.0012","90","0.007","98.672","0.007","90","0.008","2434.5","0.4","122","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1-Bromo-3,4-bis(bromomethyl)-2,5-dimethoxybenzene","1-Bromo-3,4-bis(bromomethyl)-2,5-dimethoxybenzene","","- C10 H11 Br3 O2 -","- C10 H11 Br3 O2 -","- C80 H88 Br24 O16 -","8","2","CV6552","Peter Hammershøj; Erik Riis; Jørn B. Christensen","1-Bromo-3,4-bis(bromomethyl)-2,5-dimethoxybenzene","Acta Crystallographica Section E","2005","61","9","o2997","o2998","10.1107/S1600536805025444","","","0.71073","MoKα","","0.0672","0.0412","","","0.0683","0.0784","","","","","","1.159","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206670","18.1665","0.0013","11.0409","0.0008","32.197","0.002","90","","90.138","0.001","90","","6457.9","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(benzylthio)maleonitrile","Bis(benzylsulfanyl)maleonitrile","","- C18 H14 N2 S2 -","- C18 H14 N2 S2 -","- C288 H224 N32 S32 -","16","4","CV6553","Backiel, Stanley; Bajrami, Besnik; Hunter, Allen D.; Zeller, Matthias; Lesley, M. J. Gerald","Bis(benzylsulfanyl)maleonitrile","Acta Crystallographica Section E","2005","61","9","o2817","o2819","10.1107/S1600536805024414","","","0.71073","MoKα","","0.0378","0.035","","","0.0877","0.0894","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206671","6.0091","0.0007","6.4829","0.0008","12.203","0.0015","81.136","0.01","80.67","0.01","69.04","0.01","435.67","0.1","296","1","296","1","","","","","","","","4","P 1","P 1","1","","(-)-1-Benzyl-4-[1(S)-phenylethylamino]-5,6-dihydropyridin-2(1H)-one","","- C20 H22 N2 O -","- C20 H22 N2 O -","- C20 H22 N2 O -","1","1","CV6556","Romero, Nancy; Terán, Joel L.; Gnecco, Dino; Bernès, Sylvain","(‒)-1-Benzyl-4-[1(<i>S</i>)-phenylethylamino]-5,6-dihydropyridin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","9","o2924","o2926","10.1107/S160053680502413X","","","0.71073","MoKα","","0.043","0.0338","","","0.0837","0.0895","","","","","","1.014","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2206672","5.5309","0.001","12.172","0.002","26.121","0.004","90","","90","","90","","1758.5","0.5","296","1","296","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(-)-1-Benzyl-4-[(1R)-2-hydroxy-1-phenylethylamino]-5,6-dihydropyridin-2(1H)-one","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C80 H88 N8 O8 -","4","1","CV6557","Romero, Nancy; Terán, Joel L.; Gnecco, Dino; Bernès, Sylvain","(‒)-1-Benzyl-4-[(1<i>R</i>)-2-hydroxy-1-phenylethylamino]-5,6-dihydropyridin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","9","o2927","o2929","10.1107/S1600536805024141","","","0.71073","MoKα","","0.0596","0.0428","","","0.1054","0.1204","","","","","","1.017","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2206673","8.5514","0.0003","8.341","0.0003","17.6134","0.0007","90","","106.939","0.002","90","","1201.81","0.08","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Tetrachlorobis[(E)-ethyl 2-(1-iminopropoxyimino)propanoate]platinum(IV)","","- C16 H28 Cl4 N4 O6 Pt -","- C16 H28 Cl4 N4 O6 Pt -","- C32 H56 Cl8 N8 O12 Pt2 -","2","0.5","CV6558","Luzyanin, Konstantin; Haukka, Matti; Izotova, Yulia A.; Kukushkin, Vadim Yu.; Pombeiro, Armando J. L.","<i>trans</i>-Tetrachlorobis[(<i>E</i>)-ethyl 2-(1-iminopropoxyimino)propanoate]platinum(IV)","Acta Crystallographica Section E","2005","61","9","m1765","m1767","10.1107/S1600536805025183","","","0.71073","MoKα","","0.0297","0.0202","","","0.0401","0.0423","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206674","9.39703","0.00016","7.28424","0.00016","21.9483","0.0003","90","","95.802","0.0011","90","","1494.67","0.05","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Hydrochlorothiazide‒methyl acetate (1/1)","","","- C10 H14 Cl N3 O6 S2 -","- C10 H14 Cl N3 O6 S2 -","- C40 H56 Cl4 N12 O24 S8 -","4","1","CV6560","Florence, Alastair J.; Johnston, Andrea; Shankland, Kenneth","Powder study of hydrochlorothiazide‒methyl acetate (1/1)","Acta Crystallographica Section E","2005","61","9","o2974","o2977","10.1107/S1600536805025651","","","1.54056","CuKα~1~","","","","","","","","","","1.448","","","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206675","10.4874","0.0006","6.5998","0.0003","10.7986","0.0004","90","","106.57","0.002","90","","716.38","0.06","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Aqua(2,2'-bipyridine-κ^2^N,N')(L-malato-κ^3^O,O',O'')copper(II)","","- C14 H14 Cu N2 O6 -","- C14 H14 Cu N2 O6 -","- C28 H28 Cu2 N4 O12 -","2","1","CV6564","He, Long","Aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(<small>L</small>-malato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')copper(II)","Acta Crystallographica Section E","2005","61","9","m1752","m1754","10.1107/S1600536805025274","","","0.71069","MoKα","","0.0296","0.0277","","","0.069","0.0698","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206676","10.012","0.0002","10.389","0.0002","14.222","0.0004","104.619","0.001","89.923","0.001","112.754","0.0012","1312.3","0.05","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","trans-Dichloro(4-chloroaniline-κN)(triphenylphosphine-κP)palladium(II) dichloromethane solvate","","- C25 H23 Cl5 N P Pd -","- C25 H23 Cl5 N P Pd -","- C50 H46 Cl10 N2 P2 Pd2 -","2","1","CV6568","Maliha Asma; Werner Kaminsky; Amin Badshah","<i>trans</i>-Dichloro(2-chloroaniline-κ<i>N</i>)(triphenylphosphine-κ<i>P</i>)palladium(II) dichloromethane solvate","Acta Crystallographica Section E","2005","61","9","m1797","m1798","10.1107/S1600536805025729","","","0.71073","MoKα","","0.0817","0.0441","","","0.1033","0.1164","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206677","7.3474","0.0015","10.972","0.002","15.186","0.003","90","","90.27","0.03","90","","1224.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(tropolonato)palladium(II)","","- C14 H10 O4 Pd -","- C14 H10 O4 Pd -","- C56 H40 O16 Pd4 -","4","1","CV6570","Steyl, Gideon","Bis(tropolonato)palladium(II)","Acta Crystallographica Section E","2005","61","9","m1860","m1862","10.1107/S1600536805026619","","","0.71073","MoKα","","0.043","0.0289","","","0.0706","0.0754","","","","","","1.046","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206678","13.1389","0.0003","25.6885","0.0005","31.1822","0.0007","90","","90","","90","","10524.6","0.4","295","1","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","di-μ-aqua-1:2κ^4^O:O-triaqua-1κ^3^O-dilosartanido-1κN;2κ^2^N,N'- dipotassium dihydrate","","- C22 H29 Cl K N6 O4.5 -","- C22 H29 Cl K N6 O4.5 -","- C352 H464 Cl16 K16 N96 O72 -","16","2","DN6239","Xiu-Rong Hu; Yun-Wu Wang; Jian-Ming Gu","Losartan potassium 3.5-hydrate, a new crystalline form","Acta Crystallographica Section E","2005","61","9","m1686","m1688","10.1107/S1600536805024001","","","0.7107","MoKα","","","0.054","","","","0.124","","","","","","1.023","","","","has coordinates,has Fobs","184482","2020-10-21","18:00:00",""
"2206679","4.3633","0.0005","9.2982","0.0011","16.7339","0.0017","94.781","0.009","93.394","0.009","100.822","0.009","662.57","0.13","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","(E)-Ethyl 4-chloro-3-[2-(2-fluorophenyl)hydrazono]butanoate","","- C12 H12 Cl F N2 O3 -","- C12 H12 Cl F N2 O3 -","- C24 H24 Cl2 F2 N4 O6 -","2","1","DN6242","Alpaslan, Gökhan; Özdamar, Özgür; Odabaşoğlu, Mustafa; Ersanlı, Cem Cüneyt; Büyükgüngör, Orhan; Erdönmez, Ahmet","(<i>E</i>)-Ethyl 4-chloro-3-[2-(2-fluorophenyl)hydrazono]butanoate","Acta Crystallographica Section E","2005","61","9","o2823","o2825","10.1107/S1600536805024153","","","0.71073","MoKα","","0.0757","0.0364","","","0.0896","0.099","","","","","","0.829","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206680","8.8699","0.0006","19.7245","0.0013","10.8701","0.0007","90","","111.508","0.001","90","","1769.3","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Hexaaquazinc(II) bis[trichloro(3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6- dione-κN^9^)zincate(II)] dihydrate","","- C16 H36 Cl6 N8 O12 Zn3 -","- C16 H36 Cl6 N8 O12 Zn3 -","- C32 H72 Cl12 N16 O24 Zn6 -","2","0.5","DN6245","Zhi-Min Jin; Hai Feng; Li Li; Hao Su; Cheng-Xiang Tong","Hexaaquazinc(II) bis[trichloro(3,7-dihydro-1,3,7-trimethyl-1<i>H</i>-purine-2,6-dione-κ<i>N</i>^9^)zincate(II)] dihydrate","Acta Crystallographica Section E","2005","61","9","m1849","m1851","10.1107/S1600536805026309","","","0.71073","MoKα","","0.0305","0.0268","","","0.0681","0.0699","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206681","6.596","0.003","14.36","0.006","14.549","0.006","90","","90","","90","","1378.1","1","123.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","7-Diethylamino-3-dimethylamino-2H-1-benzopyran-2-one","","- C15 H20 N2 O2 -","- C15 H20 N2 O2 -","- C60 H80 N8 O8 -","4","1","DN6246","Takahashi, Hajime; Takechi, Haruko; Kubo, Kanji; Matsumoto, Taisuke","7-Diethylamino-3-dimethylamino-2<i>H</i>-1-benzopyran-2-one","Acta Crystallographica Section E","2005","61","9","o3041","o3043","10.1107/S1600536805026607","","","0.7107","MoKα","","","0.0566","","","","0.1625","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206682","10.4187","0.0005","29.5648","0.0013","12.9299","0.0006","90","","93.395","0.001","90","","3975.8","0.3","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(1,10-phenanthroline)cobalt(II) triiodide","","- C36 H24 Co I6 N6 -","- C36 H24 Co I6 N6 -","- C144 H96 Co4 I24 N24 -","4","1","ER6015","Tershansy, Meredith A.; Goforth, Andrea M.; Smith, Mark D.; Peterson Jr, LeRoy; Loye, Hans-Conrad zur","Tris(1,10-phenanthroline)cobalt(II) triiodide","Acta Crystallographica Section E","2005","61","9","m1680","m1681","10.1107/S1600536805023883","","","0.71073","MoKα","","0.0456","0.0383","","","0.0835","0.0869","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206683","10.215","0.005","11.003","0.005","16.761","0.007","90","","90","","90","","1883.9","1.5","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Methyl 12-bromo-13,14-dinitrodeisopropyldehydroabietate","","- C18 H21 Br N2 O6 -","- C18 H21 Br N2 O6 -","- C72 H84 Br4 N8 O24 -","4","1","ER6018","Ying-Ming Pan; Ye Zhang; Heng-Shan Wang; Bi-Hai Tong; Zhen-Feng Chen; Yong Zhang","Methyl 12-bromo-13,14-dinitrodeisopropyldehydroabietate","Acta Crystallographica Section E","2005","61","9","o3003","o3005","10.1107/S1600536805025390","","","0.7107","MoKα","","0.0343","0.0302","","","0.062","0.0637","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206684","3.9754","0.0008","9.79","0.002","17.958","0.004","90","","92.91","0.03","90","","698","0.3","105","2","105","2","","","","","","","","3","P 1 21 1","P 2yb","4","","5-(4-methoxyphenyl)-1-phenylpent-4-ene-1,3-dione","","- C18 H16 O3 -","- C18 H16 O3 -","- C36 H32 O6 -","2","1","ER6020","Arrieta, Antonio F.; Arvid Mostad.","Weak hydrogen bonds in 5-(4-methoxyphenyl)-1-phenylpent-4-ene-1,3-dione","Acta Crystallographica Section E","2005","61","9","o3011","o3013","10.1107/S1600536805026140","","","0.71073","MoKα","","0.0292","0.0284","","","0.0766","0.0793","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206685","6.374","0.002","10.302","0.004","10.447","0.004","90","","91.428","0.014","90","","685.8","0.4","291","2","291","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N,N'-dimetyl-N,N'-diphenylethylenediamine","","- C16 H20 N2 -","- C16 H20 N2 -","- C32 H40 N4 -","2","0.5","ER6023","Lennartson, Anders; Kokoli, Theonitsa; Håkansson, Mikael","<i>N</i>,<i>N</i>'-Dimethyl-<i>N</i>,<i>N</i>'-diphenylethylenediamine","Acta Crystallographica Section E","2005","61","9","o2904","o2906","10.1107/S1600536805025298","","","0.71073","MoKα","","0.0803","0.0548","","","0.14","0.1551","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206686","25.5382","0.0008","25.5382","0.0008","8.4031","0.0004","90","","90","","90","","5480.5","0.4","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","2-(2-bromo-4-chloroanilino)-2-phenylethanol","","- C14 H13 Br Cl N O -","- C14 H13 Br Cl N O -","- C224 H208 Br16 Cl16 N16 O16 -","16","1","FL6179","Mack, Eric T.; Brown, Matthew J.; Krause, Jeanette A.; Lieberman, Deborah L.; Pinhas, Allan R.","2-(2-Bromo-4-chloroanilino)-2-phenylethanol","Acta Crystallographica Section E","2005","61","9","o2810","o2812","10.1107/S1600536805024244","","","1.54178","CuKα","","0.0241","0.0232","","","0.0607","0.0614","","","","","","1.104","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206687","4.2422","0.0011","17.827","0.006","20.685","0.007","72.63","0.03","87.15","0.02","86.23","0.03","1489","0.8","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","1H-Triazole","","- C6 H5 N3 -","- C6 H5 N3 -","- C60 H50 N30 -","10","5","FL6181","Sławomir Krawczyk; Maria Gdaniec","Polymorph β of 1<i>H</i>-benzotriazole","Acta Crystallographica Section E","2005","61","9","o2967","o2969","10.1107/S1600536805025523","","","0.71073","MoKα","","0.1114","0.0438","","","0.0841","0.1054","","","","","","0.918","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206688","9.621","0.004","7.497","0.003","11.839","0.005","90","","93.211","0.006","90","","852.6","0.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl N-(2-pyridyl)carbamate","","- C8 H10 N2 O2 -","- C8 H10 N2 O2 -","- C32 H40 N8 O8 -","4","1","FL6182","Zheng, Peng-Wu; Wang, Wei; Duan, Xue-Min","Ethyl N-(2-pyridyl)carbamate","Acta Crystallographica Section E","2005","61","9","o2970","o2971","10.1107/S1600536805025389","","","0.71073","MoKα","","0.0721","0.037","","","0.0907","0.1092","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206689","5.8044","0.0009","9.5929","0.0015","20.075","0.003","90","","90","","90","","1117.8","0.3","299","2","299","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1S*,2S*)-(+)-2-Amino-1-[4-(methylsulfanyl)phenyl]-1,3-propanediol","","- C10 H15 N O2 S -","- C10 H15 N O2 S -","- C40 H60 N4 O8 S4 -","4","1","GH6028","Samas, Brian; Macikenas, Dainius; Blackburn, Anthony C","(1<i>S</i>*,2<i>S</i>*)-(+)-2-Amino-1-[4-(methylsulfanyl)phenyl]propane-1,3-diol","Acta Crystallographica Section E","2005","61","9","o2793","o2794","10.1107/S1600536805024359","","","0.71073","MoKα","","0.0784","0.0556","","","0.1221","0.1327","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206690","8.1041","0.0014","8.139","0.003","9.7289","0.0008","90","","99.86","0.01","90","","632.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Sodium methylenediphosphonate","poly[sodium(I)-μ~6~-methylenediphosphonato]","","- C H5 Na O6 P2 -","- C H5 Na O6 P2 -","- C4 H20 Na4 O24 P8 -","4","1","HB6235","K. Prabhakara Rao; K. Vidyasagar","Sodium methylenediphosphonate, Na(HO~3~PCH~2~PO~3~H~2~)","Acta Crystallographica Section E","2005","61","9","m1794","m1796","10.1107/S1600536805025596","","","0.71073","MoKα","","0.0282","0.0279","","","0.0779","0.0781","","","","","","1.243","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206691","11.7313","0.0005","12.546","0.0006","14.2184","0.0007","107.319","0.001","95.294","0.001","108.767","0.001","1850.2","0.15","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Chloro[1-(diphenylphosphinoyl)-2-(diphenylphosphino)ethane-κP^2^] (1,10-phenanthroline-κ^2^N,N')copper(I) dichloromethane solvate","","- C39 H34 Cl3 Cu N2 O P2 -","- C39 H34 Cl3 Cu N2 O P2 -","- C78 H68 Cl6 Cu2 N4 O2 P4 -","2","1","HB6239","Qian-Yong Cao; Huan-Yu Liu; Rui-Hong Deng; Wen-Hong Wu","Chloro[1-(diphenylphosphinoyl)-2-(diphenylphosphino)ethane-κ<i>P</i>^2^](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I) dichloromethane solvate","Acta Crystallographica Section E","2005","61","9","m1744","m1745","10.1107/S1600536805024888","","","0.71073","MoKα","","0.0542","0.0356","","","0.097","0.1025","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206692","7.356","0.002","8.707","0.005","23.417","0.008","90","","102.8","0.03","90","","1462.6","1.1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl [(2-hydroxyethylammonio)(2-hydroxyphenyl)methyl]phosphonate dihydrate","","- C11 H22 N O7 P -","- C11 H22 N O7 P -","- C44 H88 N4 O28 P4 -","4","1","HB6242","Zhang, Xiang-Dong; Yu, Zhan; Ma, Yong-Chao; Zhao, Zhen; Zhu, Miao-Li","Ethyl [(2-hydroxyethylaminio)(2-hydroxyphenyl)methyl]phosphonate dihydrate","Acta Crystallographica Section E","2005","61","9","o2952","o2954","10.1107/S1600536805025742","","","0.71073","MoKα","","0.0832","0.047","","","0.1033","0.1121","","","","","","1.029","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206693","9.23","0.002","6.779","0.001","19.052","0.004","90","","96.57","0.03","90","","1184.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","glycine magnesium nitrate tetrahydrate","catena-Poly[[[tetraaquamagnesium(II)]-μ-glycine-κ^2^O:O'] dinitrate]","","- C2 H13 Mg N3 O12 -","- C2 H13 Mg N3 O12 -","- C8 H52 Mg4 N12 O48 -","4","1","HB6244","Michel Fleck; Ladislav Bohatý","<i>catena</i>-Poly[[[tetraaquamagnesium(II)]-μ-glycine-κ^2^<i>O</i>:<i>O</i>'] dinitrate]","Acta Crystallographica Section E","2005","61","9","m1887","m1889","10.1107/S1600536805026875","","","0.71073","MoKα","","0.0505","0.035","","","0.0939","0.1036","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206694","9.201","0.001","6.773","0.001","18.966","0.002","90","","96.775","0.001","90","","1173.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Glycine nickel nitrate tetrahydrate","catena-Poly[[[tetraaquanickel(II)]-μ-glycine-κ^2^O:O'] dinitrate]","","- C2 H13 N3 Ni O12 -","- C2 H13 N3 Ni O12 -","- C8 H52 N12 Ni4 O48 -","4","1","HB6245","Michel Fleck; Ladislav Bohatý","<i>catena</i>-Poly[[[tetraaquanickel(II)]-μ-glycine-κ^2^<i>O</i>:<i>O</i>'] dinitrate]","Acta Crystallographica Section E","2005","61","9","m1890","m1893","10.1107/S1600536805026887","","","0.71073","MoKα","","0.049","0.0295","","","0.0733","0.0821","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206695","13.901","0.003","15.37","0.003","10.742","0.002","90","","101.61","0.03","90","","2248.2","0.8","283","2","283","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[[bis(1,10-phenanthroline)cadmium(II)]-μ-tetraoxomolybdato]","","- C24 H18 Cd Mo N4 O5 -","- C24 H18 Cd Mo N4 O5 -","- C96 H72 Cd4 Mo4 N16 O20 -","4","1","HB6246","Xiuli Bai; Ying Lu; Enbo Wang","[Cd(phen)~2~{MoO~4~}]·H~2~O, a one-dimensional coordination polymer with bridging molybdate groups","Acta Crystallographica Section E","2005","61","9","m1840","m1842","10.1107/S1600536805026073","","","0.71073","MoKα","","0.0498","0.0377","","","0.1238","0.1279","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206696","9.336","0.003","11.37","0.003","13.967","0.004","81.154","0.004","89.47","0.004","69.204","0.004","1367.9","0.7","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Bis(benzimidazole-κN)bis(salicylato-κ^2^O,O')cadmium(II) monohydrate","","- C28 H24 Cd N4 O7 -","- C28 H24 Cd N4 O7 -","- C56 H48 Cd2 N8 O14 -","2","1","HB6247","Xiao-Du Fu; Dong-Dong Lin; Duan-Jun Xu","Bis(benzimidazole-κ<i>N</i>)bis(salicylato-κ^2^<i>O</i>,<i>O</i>')cadmium(II) monohydrate","Acta Crystallographica Section E","2005","61","9","m1823","m1825","10.1107/S1600536805026061","","","0.71073","MoKα","","0.068","0.046","","","0.086","0.096","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206697","9.257","0.0006","18.318","0.001","7.1562","0.0004","90","","98.094","0.001","90","","1201.39","0.12","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[piperazinium(2+) [ferrate(III)-μ-hydroxo-κ^2^O:O- di-μ-sulfato-κ^4^O:O'] monohydrate]","","- C4 H15 Fe N2 O10 S2 -","- C4 H15 Fe N2 O10 S2 -","- C16 H60 Fe4 N8 O40 S8 -","4","1","HB6248","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[piperazinium(2+) [ferrate(III)-μ-hydroxo-κ^2^<i>O</i>:<i>O</i>-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2005","61","9","m1831","m1833","10.1107/S1600536805026218","","","0.71073","MoKα","","0.045","0.039","","","0.095","0.098","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206698","9.9572","0.0018","12.819","0.002","15.061","0.003","90","","90","","90","","1922.4","0.6","295","2","295","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","catena-Poly[[[diaquacalcium(II)]-μ-oxydiacetato-[tetraaquamanganese(II)]- μ-oxydiacetato] dihydrate]","","- C8 H24 Ca Mn O18 -","- C8 H24 Ca Mn O18 -","- C32 H96 Ca4 Mn4 O72 -","4","0.5","HB6250","Qian Yang; Dong-Dong Lin; Duan-Jun Xu","<i>catena</i>-Poly[[[diaquacalcium(II)]-μ-oxydiacetato-[tetraaquamanganese(II)]-μ-oxydiacetato] dihydrate]","Acta Crystallographica Section E","2005","61","9","m1826","m1828","10.1107/S160053680502622X","","","0.71073","MoKα","","0.091","0.039","","","0.104","0.154","","","","","","0.869","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206699","11.836","0.006","20.032","0.007","12.089","0.012","90","","105.04","0.07","90","","2768","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetraethylammonium hexa-μ~3~-oxo-hexa-μ~2~oxo-tetradecaoxooctamolybdate","","- C32 H80 Mo8 N4 O26 -","- C32 H80 Mo8 N4 O26 -","- C64 H160 Mo16 N8 O52 -","2","0.5","HB6251","G. Kalpana; K. Vidyasagar","[(C~2~H~5~)~4~N]~4~[Mo~8~O~26~]: a redetermination and correction","Acta Crystallographica Section E","2005","61","9","m1885","m1886","10.1107/S1600536805026899","","","0.71073","MoKα","","0.0861","0.0676","","","0.1761","0.1812","","","","","","1.183","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206700","7.5649","0.0015","6.7833","0.0008","15.502","0.003","90","","101.98","0.02","90","","778.2","0.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Lithium hydrogen iodofumarate monohydrate","poly[[aqualithium(I)]-μ~3~-iodofumarato]","","- C4 H4 I Li O5 -","- C4 H4 I Li O5 -","- C16 H16 I4 Li4 O20 -","4","1","HB6252","Billetter, Heinrich; Pantenburg, Ingo; Ruschewitz, Uwe","Lithium hydrogen iodofumarate monohydrate","Acta Crystallographica Section E","2005","61","9","m1857","m1859","10.1107/S1600536805026589","","","0.71073","MoKα","","0.0391","0.034","","","0.0876","0.0906","","","","","","1.076","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206701","11.3271","0.0014","26.9657","0.0012","8.0667","0.0006","90","","104.764","0.004","90","","2382.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethylamino proylammonium dipicrate","","- C17 H20 N8 O14 -","- C17 H20 N8 O14 -","- C68 H80 N32 O56 -","4","1","HG6209","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Krishnan SethuSankar; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar","3-(Dimethylammonio)propanaminium dipicrate","Acta Crystallographica Section E","2005","61","9","o2887","o2890","10.1107/S1600536805023652","","","1.5418","CuKα","","0.0856","0.0604","","","0.1509","0.1714","","","","","","1.045","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206702","9.4884","0.0005","8.3334","0.0004","15.1309","0.0007","90","","113.209","0.0019","90","","1099.59","0.09","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Hydrochlorothiazide form II","","","- C7 H8 Cl N3 O4 S2 -","- C7 H8 Cl N3 O4 S2 -","- C28 H32 Cl4 N12 O16 S8 -","4","1","HG6211","Florence, Alastair; Johnston, Andrea; Fernandes, Philippe; Shankland, Kenneth; Stevens, Howard N. E.; Osmundsen, Sigrunn; Mullen, Alexander B.","Powder study of hydrochlorothiazide form II","Acta Crystallographica Section E","2005","61","9","o2798","o2800","10.1107/S1600536805023640","","","1.54056","CuKα~1~","","","","","","","","","","1.641","","","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206703","12.098","0.014","11.007","0.013","6.295","0.007","90","","97.886","0.018","90","","830.3","1.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Chlorometronidazole","1-(2-chloroethyl)-2-methyl-5-nitro-1H-imidazole","","- C6 H8 Cl N3 O2 -","- C6 H8 Cl N3 O2 -","- C24 H32 Cl4 N12 O8 -","4","1","HG6214","Pi, Wen-Xia; Yang, Yu-Min; Li, Huan-Qiu; Zhu, Hai-Liang","Chlorometronidazole","Acta Crystallographica Section E","2005","61","9","o2880","o2881","10.1107/S1600536805025201","","","0.71073","MoKα","","0.0622","0.0445","","","0.1163","0.1282","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206704","6.192","0.003","7.74","0.003","10.001","0.004","89.073","0.006","86.903","0.006","73.097","0.006","457.9","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Iodometronidazole","1-(2-iodoethyl)-2-methyl-5-nitro-1H-imidazole","","- C6 H8 I N3 O2 -","- C6 H8 I N3 O2 -","- C12 H16 I2 N6 O4 -","2","1","HG6215","Yang, Yu-Min; Li, Huan-Qiu; Shi, Lei; Zhu, Hai-Liang","Iodometronidazole","Acta Crystallographica Section E","2005","61","9","o2882","o2883","10.1107/S1600536805025213","","","0.71073","MoKα","","0.0423","0.0391","","","0.0996","0.1043","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206705","20.011","0.002","8.6936","0.0008","16.3481","0.0016","90","","103.498","0.008","90","","2765.5","0.5","295","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,3,4,4,5,5-Hexafluoro-1,2-bis{3-methyl-5-[3-(trifluoromethyl)phenyl}- 2-thienyl]cyclopent-1-ene","","- C29 H16 F12 S2 -","- C29 H16 F12 S2 -","- C116 H64 F48 S8 -","4","0.5","HG6218","Pu, Shou-Zhi; Liu, Gang; Yan, Liu-Shui","3,3,4,4,5,5-Hexafluoro-1,2-bis{3-methyl-5-[3-(trifluoromethyl)phenyl]-2-thienyl}cyclopent-1-ene","Acta Crystallographica Section E","2005","61","9","o2856","o2858","10.1107/S1600536805025134","","","0.71073","MoKα","","0.0895","0.0754","","","0.1383","0.1451","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206706","7.5915","0.0002","20.1407","0.0006","17.5607","0.0006","90","","90","","90","","2685","0.14","190","","190","","","","","","","","","3","C 2 2 21","C 2c 2","20","","1,2:3,4-Di-O-isopropylidene-β-D-psicofuranose","","- C12 H20 O6 -","- C12 H20 O6 -","- C96 H160 O48 -","8","1","HG6223","David J Watkin; Andreas F. G. Glawar; Raquel Soengas; Ken Izumori; Mark R. Wormald; Raymond A. Dwek; George W. J. Fleet","1,2:3,4-Di-<i>O</i>-isopropylidene-β-<small>D</small>-psicofuranose","Acta Crystallographica Section E","2005","61","9","o2949","o2951","10.1107/S1600536805025572","","","0.71073","MoKα","","0.0411","0.0411","","0.0776","0.0776","0.0776","","","","","","0.9433","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206707","13.7829","0.0011","12.5247","0.001","18.2985","0.0014","90","","90","","90","","3158.8","0.4","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(N,N-dimethylbenzylamine)pentacarbonyltungsten","","- C14 H13 N O5 W -","- C14 H13 N O5 W -","- C112 H104 N8 O40 W8 -","8","1","HG6224","Mahmud, Tariq; Iqbal, Javed; Irshad, Muhammad; Elsegood, Mark R. J.; McKee, Vickie","Pentacarbonyl(<i>N</i>,<i>N</i>-dimethylbenzylamine)tungsten","Acta Crystallographica Section E","2005","61","9","m1789","m1791","10.1107/S1600536805025560","","","0.71073","MoKα","","0.0701","0.0329","","","0.06","0.0737","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206708","5.744","0.0006","5.744","","31.393","0.003","90","","90","","90","","1035.77","0.15","295","2","295","2","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","1,8-Dihydroxyanthraquinone","","- C14 H8 O4 -","- C14 H8 O4 -","- C56 H32 O16 -","4","0.5","HG6225","Zain, Sharifuddin M.; Ng, Seik Weng","1,8-Dihydroxyanthraquinone","Acta Crystallographica Section E","2005","61","9","o2921","o2923","10.1107/S1600536805025948","","","0.71073","MoKα","","0.074","0.047","","","0.138","0.153","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206709","9.5062","0.0006","11.4587","0.0007","16.5322","0.0011","92.931","0.001","101.219","0.001","90.509","0.001","1763.78","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis[2-(1,3-benzoxazol-2-yl)phenolato](1,10-phenanthroline)zinc(II)‒2-(1,3- benzoxazol-2-yl)phenol (2/1)","","- C44.5 H28.5 N4.5 O5 Zn -","- C44.5 H28.5 N4.5 O5 Zn -","- C89 H57 N9 O10 Zn2 -","2","1","HG6226","Tong, Yi-Ping","Bis[2-(1,3-benzoxazol-2-yl)phenolato](1,10-phenanthroline)zinc(II)‒2-(1,3-benzoxazol-2-yl)phenol (2/1)","Acta Crystallographica Section E","2005","61","9","m1843","m1845","10.1107/S1600536805026243","","","0.71073","MoKα","","0.0807","0.0603","","","0.1437","0.1555","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206710","13.145","0.003","7.2093","0.0015","8.6617","0.0017","90","","106.709","0.003","90","","786.2","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethyl N,N'-cyclohexane-1,4-diyldioxalamate","","- C14 H22 N2 O6 -","- C14 H22 N2 O6 -","- C28 H44 N4 O12 -","2","0.5","HG6227","Francisco J. Martínez-Martínez; Paloma Maya-Lugardo; Efrén V. García-Báez; Herbert Höpfl; Julio Hernández-Díaz; Itzia I. Padilla-Martínez","Diethyl <i>N</i>,<i>N</i>'-cyclohexane-1,4-diyldioxalamate","Acta Crystallographica Section E","2005","61","9","o2994","o2996","10.1107/S1600536805025833","","","0.71073","MoKα","","0.0803","0.0727","","","0.1716","0.1768","","","","","","1.186","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206711","15.0959","0.0015","8.2686","0.0008","9.3397","0.0009","90","","94.812","0.002","90","","1161.7","0.2","173","1","173","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-4-Methylcyclohexylcarbamoylphosphonic acid","","- C8 H16 N O4 P -","- C8 H16 N O4 P -","- C32 H64 N4 O16 P4 -","4","1","HG6228","Shmuel Cohen; Yiffat Katz; Reuven Reich; Eli Breuer","<i>trans</i>-(4-Methylcyclohexylcarbamoyl)phosphonic acid: a representative matrix metalloproteinase (MMP) inhibitor","Acta Crystallographica Section E","2005","61","9","o3008","o3010","10.1107/S1600536805025936","","","0.71073","MoKα","","0.0636","0.0481","","","0.099","0.1051","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206712","26.33","0.02","5.979","0.008","8.163","0.01","90","","105.14","0.1","90","","1240","3","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,2-Bis(2-aminophenoxy)ethane","1,2-Bis(2-aminophenoxy)ethane","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C56 H64 N8 O8 -","4","0.5","HG6229","Rademeyer, Melanie; Barkhuizen, David A.; Kruger, Hendrik G.; Maguire, Glenn E. M.","1,2-Bis(2-aminophenoxy)ethane","Acta Crystallographica Section E","2005","61","9","o3014","o3016","10.1107/S1600536805026231","","","0.71073","MoKα","","0.0675","0.0608","","","0.1658","0.1769","","","","","","1.088","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206713","11.639","0.003","7.235","0.004","17.206","0.003","90","","96.399","0.018","90","","1439.9","0.9","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 N2 O5 -","- C16 H12 N2 O5 -","- C64 H48 N8 O20 -","4","1","HG6230","Moreno-Fuquen, Rodolfo; Montaño, Angela Marcela; Atencio, Reinaldo","Isoquinoline 1-oxide‒2-nitrobenzoic acid (1/1)","Acta Crystallographica Section E","2005","61","9","o3061","o3062","10.1107/S1600536805026334","","","0.71073","MoKα","","0.067","0.04","","","0.086","0.104","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206714","6.6711","0.0005","12.2317","0.0008","8.1051","0.0006","90","","107.068","0.006","90","","632.24","0.08","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-trans-Tetrachlorobis(dimethyl sulfide-κS)tin","","- C4 H12 Cl4 S2 Sn -","- C4 H12 Cl4 S2 Sn -","- C8 H24 Cl8 S4 Sn2 -","2","0.5","HG6232","Ruth, Kai; Lerner, Hans-Wolfram; Bolte, Michael","<i>cis</i>-<i>trans</i>-Tetrachlorobis(dimethyl sulfide-κ<i>S</i>)tin","Acta Crystallographica Section E","2005","61","9","m1852","m1853","10.1107/S1600536805026346","","","0.71073","MoKα","","0.0211","0.0182","","","0.0405","0.0415","","","","","","1.131","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206715","6.2505","0.0002","13.3718","0.0004","22.9703","0.0007","90","","90","","90","","1919.87","0.1","160","2","160","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","17-Butyl-16,17a-dioxo-17-aza-D-homoestra-1,3,5(10)-trien-3-ol","","- C22 H29 N O3 -","- C22 H29 N O3 -","- C88 H116 N4 O12 -","4","1","HG6235","Hema, R.; Parthasarathi, V.; Ranju Bansal; Linden, Anthony","(8<i>R</i>,9<i>S</i>,13<i>S</i>,14<i>S</i>)-17-Butyl-16,17a-dioxo-17-aza-<i>D</i>-homoestra-1,3,5(10)-trien-3-ol","Acta Crystallographica Section E","2005","61","9","o3095","o3097","10.1107/S1600536805027030","","","0.71073","MoKα","","0.066","0.0466","","","0.1099","0.1219","","","","","","1.085","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2206716","5.9243","0.0001","11.0968","0.0003","30.2328","0.0007","90","","90","","90","","1987.53","0.08","160","2","160","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","17-Butyl-3-methoxy-17-aza-D-homoestra-1,3,5(10)-triene-16,17a-dione","","- C23 H31 N O3 -","- C23 H31 N O3 -","- C92 H124 N4 O12 -","4","1","HG6236","Hema, R.; Parthasarathi, V.; Ranju, Bansal; Linden, Anthony","(8<i>R</i>,9<i>S</i>,13<i>S</i>,14<i>S</i>)-17-Butyl-3-methoxy-17-aza-<i>D</i>-homoestra-1,3,5(10)-triene-16,17a-dione","Acta Crystallographica Section E","2005","61","9","o3098","o3100","10.1107/S1600536805027042","","","0.71073","MoKα","","0.0617","0.043","","","0.0984","0.1095","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206717","10.1509","0.0002","20.0739","0.0003","7.995","0.0001","90","","105.889","0.0008","90","","1566.88","0.04","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","pyridinium pentafluorotellurate hexafluoroditellurat","Tetrapyridinium di-μ-oxo-bis[trifluorotellurate(IV)] bis[pentafluorotellurate(IV)]","","- C10 H12 F8 N2 O Te2 -","- C10 H12 F8 N2 O Te2 -","- C40 H48 F32 N8 O4 Te8 -","4","1","HK6029","Klapötke, Thomas M.; Krumm, Burkhard; Mayer, Peter; Schwab, Ingo","Tetrapyridinium di-μ-oxo-bis[trifluorotellurate(IV)] bis[pentafluorotellurate(IV)]","Acta Crystallographica Section E","2005","61","9","o2984","o2986","10.1107/S1600536805025304","","","0.71073","MoKα","","0.0428","0.0292","","","0.0599","0.0639","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206718","6.8466","0.0003","15.668","0.0008","13.6328","0.0007","90","","90","","90","","1462.42","0.12","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Diethylenetriaminium(3+) hexachlorobismuthate(III)","","- C4 H16 Bi Cl6 N3 -","- C4 H16 Bi Cl6 N3 -","- C16 H64 Bi4 Cl24 N12 -","4","1","HK6030","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Diethylenetriaminium(3+) hexachlorobismuthate(III)","Acta Crystallographica Section E","2005","61","9","m1717","m1718","10.1107/S1600536805024438","","","0.71073","MoKα","","0.033","0.031","","","0.08","0.081","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206719","7.7443","0.0006","18.55","0.002","9.9726","0.0008","90","","92.925","0.001","90","","1430.8","0.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[N-methylpiperidinium(2+)] di-μ-chloro-bis[tetrachlorobismuthate(III)] dihydrate","","- C10 H32 Bi2 Cl10 N4 O2 -","- C10 H32 Bi2 Cl10 N4 O2 -","- C20 H64 Bi4 Cl20 N8 O4 -","2","0.5","HK6031","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Bis[<i>N</i>-methylpiperidinium(2+)] di-μ-chloro-bis[tetrachlorobismuthate(III)] dihydrate","Acta Crystallographica Section E","2005","61","9","m1719","m1720","10.1107/S1600536805024451","","","0.71073","MoKα","","0.034","0.027","","","0.061","0.064","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206720","4.794","0.0007","8.4531","0.0013","13.411","0.002","97.35","0.012","94.854","0.012","101.266","0.012","525.25","0.14","296","","296","","","","","","","","","4","P -1","-P 1","2","","1-Methoxyethyl-5-nitrobenzimidazole","","- C10 H11 N3 O3 -","- C10 H11 N3 O3 -","- C20 H22 N6 O6 -","2","1","HK6034","Mehmet Akkurt; Sema Öztürk Yıldırım; Ersin Orhan; Hasan Küçükbay; Orhan Büyükgüngör","1-Methoxyethyl-5-nitrobenzimidazole","Acta Crystallographica Section E","2005","61","9","o2804","o2805","10.1107/S1600536805024591","","","0.71073","MoKα","","0.1032","0.0487","","","0.1048","0.1236","","","","","","0.978","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206721","7.828","0.003","19.652","0.006","13.086","0.004","90","","98.854","0.005","90","","1989.1","1.1","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N-(3-Chlorophenyl)-2-{[(1E)-(4-methylphenyl)methylene]amino}-4,5,6,7- tetrahydro-1-benzothiophene-3-carboxamide","","- C23 H21 Cl N2 O S -","- C23 H21 Cl N2 O S -","- C92 H84 Cl4 N8 O4 S4 -","4","1","HK6035","Anilkumar, G. N.; Kokila, M. K.; Puttaraja; Mohan, S.; Majunath Shetty, K. S.","<i>N</i>-(3-Chlorophenyl)-2-{[(1<i>E</i>)-(4-methylphenyl)methylene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","9","o2841","o2843","10.1107/S1600536805024773","","","0.71073","MoKα","","0.056","0.0467","","","0.1182","0.124","","","","","","1.094","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206722","24.727","0.003","10.2755","0.0013","8.2037","0.0011","90","","90","","90","","2084.4","0.5","291","2","291","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","N-(2-Chlorophenyl)-2-{[(1E)-(4-methoxyphenyl)methylene]amino}-4,5,6,7- tetrahydro-1-benzothiophene-3-carboxamide","","- C23 H21 Cl N2 O2 S -","- C23 H21 Cl N2 O2 S -","- C92 H84 Cl4 N8 O8 S4 -","4","1","HK6036","Anilkumar, G. N.; Kokila, M. K.; Puttaraja; Mohan, S.; Manjunath Shetty, K. S.","<i>N</i>-(2-Chlorophenyl)-2-{[(1<i>E</i>)-(4-methoxyphenyl)methylene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","9","o3038","o3040","10.1107/S1600536805026413","","","0.71073","MoKα","","0.0851","0.066","","","0.1436","0.1521","","","","","","1.106","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206723","10.58","0.002","10.944","0.002","13.886","0.003","83.49","0.03","75.25","0.03","88.58","0.03","1544.8","0.6","293","2","","","","","","","","","","6","P -1","-P 1","2","","Carbonyl(8-hydroxyquinolinato)[tris(2,6-dimethylphenyl)phosphite]rhodium(I)","","- C34 H33 N O5 P Rh -","- C34 H33 N O5 P Rh -","- C68 H66 N2 O10 P2 Rh2 -","2","1","HK6037","Janse van Rensburg, J. Marthinus; Roodt, Andreas; Muller, Alfred; Meijboom, Reinout","Carbonyl(8-hydroxyquinolinato)[tris(2,6-dimethylphenyl)phosphite]rhodium(I)","Acta Crystallographica Section E","2005","61","9","m1741","m1743","10.1107/S1600536805024967","","","0.71073","MoKα","","","0.0456","","","","0.0965","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206724","11.2889","0.0011","13.4306","0.0013","13.4236","0.0012","90","","96.816","0.007","90","","2020.9","0.3","295","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,3,4,4,5,5-Hexafluoro-1,2-bis(2-ethyl-5-formyl-3-thienyl)cyclopent-1-ene","","- C19 H14 F6 O2 S2 -","- C19 H14 F6 O2 S2 -","- C76 H56 F24 O8 S8 -","4","1","HK6038","Pu, Shou-Zhi; Yang, Tian-She; Yan, Liu-Shui","1,2-Bis(2-ethyl-5-formyl-3-thienyl)-3,3,4,4,5,5-hexafluorocyclopent-1-ene","Acta Crystallographica Section E","2005","61","9","o2961","o2963","10.1107/S1600536805025869","","","0.71073","MoKα","","0.1109","0.069","","","0.1243","0.1413","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206725","15.7702","0.0011","7.8856","0.0004","15.8703","0.0011","90","","101.135","0.005","90","","1936.4","0.2","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(1,3-Benzothiazol-2-yl)propan-2-ol","","- C10 H11 N O S -","- C10 H11 N O S -","- C80 H88 N8 O8 S8 -","8","2","HK6040","Mehmet Akkurt; Yamna Baryala; Abdelfettah Zerzouf; Moussa Salem; El-Mokhtar Essassi; Orhan Büyükgüngör","1-(1,3-Benzothiazol-2-yl)propan-2-ol","Acta Crystallographica Section E","2005","61","9","o3027","o3029","10.1107/S1600536805026437","","","0.71073","MoKα","","0.0561","0.0416","","","0.1121","0.1184","","","","","","1.045","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206726","6.7922","0.0005","8.4862","0.0008","9.1518","0.0008","99.81","0.006","101.532","0.003","92.919","0.005","507.33","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5-(N,N-Dimethylammoniomethyl)-2,2-dimethyl-4-oxido-6-oxo-6H-1,3-dioxine","","- C9 H15 N O4 -","- C9 H15 N O4 -","- C18 H30 N2 O8 -","2","1","IS6085","Jing-Hua Li; Jin-Huan He; Zhi-Min Jin","5-(<i>N</i>,<i>N</i>-Dimethylammoniomethyl)-2,2-dimethyl-4-oxido-6-oxo-6<i>H</i>-1,3-dioxine","Acta Crystallographica Section E","2005","61","9","o3106","o3107","10.1107/S1600536805026826","","","0.71073","MoKα","","0.0442","0.0388","","","0.0976","0.102","","","","","","1.075","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206727","9.865","0.002","9.429","0.001","13.506","0.002","90","","101.74","0.01","90","","1230","0.3","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(piperazinium) di-μ-chloro-bis[diaquadichloromanganese(II)] dichloride","","- C8 H32 Cl8 Mn2 N4 O4 -","- C8 H32 Cl8 Mn2 N4 O4 -","- C16 H64 Cl16 Mn4 N8 O8 -","2","0.5","IS6108","Zhi-Min Jin; Li Li; Nan Sun; Mao-Lin Hu; Liang Shen","Bis(piperazinium) di-μ-chloro-bis[diaquadichloromanganate(II)] dichloride","Acta Crystallographica Section E","2005","61","9","m1711","m1713","10.1107/S1600536805024530","","","0.71073","MoKα","","0.0279","0.0225","","","0.0556","0.0567","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206728","9.6272","0.0009","15.0692","0.0014","21.286","0.0019","90","","90","","90","","3088","0.5","292","2","292","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Ethyl 2,5-diphenylfuran-3-carboxylate","","- C19 H16 O3 -","- C19 H16 O3 -","- C152 H128 O24 -","8","1","IS6110","Meng, Xiang-Gao; Wu, An-Xin","Ethyl 2,5-diphenylfuran-3-carboxylate","Acta Crystallographica Section E","2005","61","9","o2808","o2809","10.1107/S1600536805024554","","","0.71073","MoKα","","0.0586","0.0428","","","0.1079","0.1186","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206729","5.2998","0.0004","19.4005","0.0018","12.7277","0.0009","90","","100.96","0.008","90","","1284.78","0.18","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,5-Bis(2-thienyloxy)-3-oxapentane","","- C12 H14 O3 S2 -","- C12 H14 O3 S2 -","- C48 H56 O12 S8 -","4","1","IS6111","Gaël Labat; Joan Halfpenny","1,5-Bis(3-thienyloxy)-3-oxapentane: a thiophene-based precursor for thiophene-based azacryptand Mannich bases","Acta Crystallographica, Section E","2005","61","9","o2813","o22814","10.1107/S1600536805024517","","","0.71073","MoKα","","0.0641","0.0331","","","0.0664","0.0721","","","","","","0.851","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206730","22.175","0.003","5.3918","0.0004","9.0831","0.0011","90","","111.362","0.009","90","","1011.4","0.2","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-Bis(3-thienyloxy)ethane","","- C10 H10 O2 S2 -","- C10 H10 O2 S2 -","- C40 H40 O8 S8 -","4","0.5","IS6112","Gaël Labat; Joan Halfpenny","1,2-Bis(3-thienyloxy)ethane: a thiophene-based precursor for thiophene-based azacryptand Mannich bases","Acta Crystallographica Section E","2005","61","9","o2815","o2816","10.1107/S1600536805024529","","","0.71073","MoKα","","0.0334","0.0312","","","0.0882","0.0895","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206731","8.8819","0.0007","5.2497","0.0003","24.216","0.002","90","","106.165","0.007","90","","1084.49","0.14","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis{1-[(4-methoxyphenyl)amino]-2-methylglyoximato-κ^2^N,N'}nickel(II)","","- C20 H24 N6 Ni O6 -","- C20 H24 N6 Ni O6 -","- C40 H48 N12 Ni2 O12 -","2","0.5","JH6013","Hümeyra Batı; Cemile Daĝ; Mustafa Serkan Soylu; Murat Tas̨; Nezihe Çalıs̨kan; Orhan Büyükgüngör","Bis{1-[(4-methoxyphenyl)amino]-2-methylglyoximato-κ^2^<i>N</i>,<i>N</i>'}nickel(II)","Acta Crystallographica Section E","2005","61","9","m1866","m1868","10.1107/S1600536805026450","","","0.71073","MoKα","","0.045","0.0327","","","0.0845","0.0884","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206732","27.561","0.002","13.3497","0.001","16.3934","0.0008","90","","113.349","0.003","90","","5537.7","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Acetato-bis(morpholine-N)[N-salicylaldehyde-N'- (O-nitrophenoxyacyl)hydrazonato-O,N,O']cobalt(III)","","- C25 H32 Co N5 O9 -","- C25 H32 Co N5 O9 -","- C200 H256 Co8 N40 O72 -","8","1","KP6055","Sun, Ming-Mei; Li, Wei-Peng; Liu, Shi-Xiong","(Acetato-κ<i>O</i>)bis(morpholine-κ<i>N</i>)[salicylaldehyde (2-nitrophenoxyacetyl)hydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']cobalt(III)","Acta Crystallographica Section E","2005","61","9","m1818","m1820","10.1107/S1600536805026000","","","0.71073","MoKα","","0.0589","0.0385","","","0.095","0.1021","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206733","6.5952","0.0009","13.7481","0.0019","10.5778","0.0015","90","","94.051","0.003","90","","956.7","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2,3-trihydroxybenzene:pyrimidine","","- C10 H10 N2 O3 -","- C10 H10 N2 O3 -","- C40 H40 N8 O12 -","4","1","KP6057","Liliana Dobrzańska","1,2,3-Trihydroxybenzene‒pyrimidine (1/1)","Acta Crystallographica Section E","2005","61","9","o2981","o2983","10.1107/S1600536805026012","","","0.71073","MoKα","","0.0817","0.0523","","","0.1467","0.1633","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206734","8.3391","0.0007","11.1748","0.0015","13.8056","0.0019","90","","90","","90","","1286.5","0.3","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(Z)-3-hydroxy-6-[(2-methoxyphenylamino)methylene]cyclohexa-2,4-dienone","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C56 H52 N4 O12 -","4","1","KP6061","S̨ahin, Onur; Albayrak, Çiǧdem; Odabas̨oğlu, Mustafa; Büyükgüngör, Orhan","(Z)-3-Hydroxy-6-[(2-methoxyphenylamino)methylene]cyclohexa-2,4-dienone","Acta Crystallographica Section E","2005","61","9","o2859","o2861","10.1107/S1600536805024189","","","0.71073","MoKα","","0.0987","0.0593","","","0.1707","0.1919","","","","","","0.973","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206735","7.602","0.002","8.7563","0.001","11.642","0.003","85.252","0.016","84.838","0.012","78.469","0.014","754.6","0.3","297","2","293","2","","","","","","","","3","P -1","-P 1","2","flavone","5-hydroxy-7,8,2'-trimethoxyflavone","","- C18 H16 O6 -","- C18 H16 O6 -","- C36 H32 O12 -","2","1","LH6457","Krishnaiah, M.; Ravi Kumar, R.; Jagadeesh Kumar, N.; Gunasekar, D.; Jayaprakasam, B.","5-Hydroxy-7,8,2'-trimethoxyflavone","Acta Crystallographica Section E","2005","61","9","o2862","o2864","10.1107/S1600536805024827","","","0.71073","MoKα","","0.0371","0.0315","","","0.0883","0.0941","","","","","","1.068","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206736","8.6596","0.0017","22.247","0.004","15.891","0.003","90","","105.314","0.003","90","","2952.7","1","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(3S*,16S*,20R*,22R*,24S*)-3,22,25-Trihydroxy-16,24:20,24-diepoxycholest- 5-en-3-yl acetate methanol solvate","","- C30 H48 O7 -","- C30 H48 O7 -","- C120 H192 O28 -","4","2","LH6462","Zhang, Wen; Yao, Guang-Min; Guo, Yue-Wei","(3<i>S</i>*,16<i>S</i>*,20<i>R</i>*,22<i>R</i>*,24<i>S</i>*)-3,22,25-Trihydroxy-16,24:20,24-diepoxycholest-5-en-3-yl acetate methanol solvate","Acta Crystallographica Section E","2005","61","9","o2884","o2886","10.1107/S160053680502489X","","","0.71073","MoKα","","0.1868","0.0712","","","0.1432","0.1732","","","","","","0.769","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206737","11.7991","0.0006","9.355","0.0005","14.2138","0.0008","90","","96.764","0.005","90","","1558.01","0.15","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(O,O'-dicyclohexyl phosphorodithioato)nickel(II)","","- C24 H44 Ni O4 P2 S4 -","- C24 H44 Ni O4 P2 S4 -","- C48 H88 Ni2 O8 P4 S8 -","2","0.5","LH6464","Murat Taş; Mehtap Yaĝan; Hümeyra Batı; Beki̇r Batı; Orhan Büyükgüngör","Redetermination of bis(<i>O</i>,<i>O</i>'-dicyclohexyl phosphorodithioato)nickel(II)","Acta Crystallographica Section E","2005","61","9","m1684","m1685","10.1107/S1600536805023895","","","0.71073","MoKα","","0.0486","0.0324","","","0.0784","0.0837","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206738","5.3572","0.0008","21.89","0.003","9.2502","0.0014","90","","100.082","0.003","90","","1068","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N'-benzoyl-4H-1,2,4-triazole-3-carbohydrazide","N'-benzoyl-4H-1,2,4-triazole-3-carbohydrazide","","- C10 H9 N5 O2 -","- C10 H9 N5 O2 -","- C40 H36 N20 O8 -","4","1","LH6474","Chang-Hua Ge; Ding-Ben Chen; Fu-You Pan; Ling Huang; Jian-Guo Yang","<i>N</i>'-Benzoyl-4<i>H</i>-1,2,4-triazole-3-carbohydrazide","Acta Crystallographica Section E","2005","61","9","o3081","o3082","10.1107/S1600536805025055","","","0.71073","MoKα","","0.065","0.0546","","","0.136","0.143","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206739","10.817","0.0009","9.3912","0.0006","25.3745","0.0018","90","","95.576","0.006","90","","2565.5","0.3","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Acetyl-4-(2-chorophenyldiazenyl)phenol","","- C14 H11 Cl N2 O2 -","- C14 H11 Cl N2 O2 -","- C112 H88 Cl8 N16 O16 -","8","1","LH6475","Deveci, Özlem; Işık, Şamil; Albayrak, Çiǧdem; Ağar, Erbil","2-Acetyl-4-(2-chorophenyldiazenyl)phenol","Acta Crystallographica Section E","2005","61","9","o2878","o2879","10.1107/S1600536805025110","","","0.71073","MoKα","","0.0705","0.0384","","","0.1023","0.1109","","","","","","0.918","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206740","14.3933","0.0002","17.5714","0.0003","17.527","0.0003","90","","110.262","0.001","90","","4158.45","0.12","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Chloro[(E)-1,1,1,4,4,4-hexafluorobut-2-en-2- yl]bis(tricyclohexylphosphine)platinum(II)‒trans- chloro[(Z)-1,1,1,4,4,4-hexafluorobut-2-en-2- yl]bis(tricyclohexylphosphine)platinum(II) (1/1)","","- C40 H67 Cl F6 P2 Pt -","- C40 H67 Cl F6 P2 Pt -","- C160 H268 Cl4 F24 P8 Pt4 -","4","1","LH6477","Howie, R. Alan; Wardell, James L.","<i>trans</i>-Chloro[(<i>E</i>)-1,1,1,4,4,4-hexafluorobut-2-en-2-yl]bis(tricyclohexylphosphine)platinum(II)‒<i>trans</i>-chloro[(<i>Z</i>)-1,1,1,4,4,4-hexafluorobut-2-en-2yl]bis(tricyclohexylphosphine)platinum(II) (1/1) at 120 K","Acta Crystallographica Section E","2005","61","9","m1701","m1704","10.1107/S1600536805024220","","","0.71073","MoKα","","0.0477","0.0313","","","0.068","0.0735","","","","","","1.043","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206741","8.2167","0.0002","13.6406","0.0003","8.7203","0.0002","90","","107.231","0.0009","90","","933.51","0.04","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Acetamido-4-nitrotoluene","","- C9 H10 N2 O3 -","- C9 H10 N2 O3 -","- C36 H40 N8 O12 -","4","1","LH6479","Watkin, David J.; Motherwell, W. D. S.; Cooper, Richard I.; Pantos, Stefan; Steadman, Oliver I.","2-Acetamido-4-nitrotoluene","Acta Crystallographica Section E","2005","61","9","o2778","o2780","10.1107/S1600536805024049","","","0.71073","MoKα","","0.0469","0.0469","","0.0977","0.0977","0.0977","","","","","","0.9965","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206742","7.4211","0.0003","9.2176","0.0003","9.7823","0.0003","98.614","0.003","104.249","0.002","102.684","0.003","617.87","0.04","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","1-(4-Methylphenylsulfonyl)-1H-1,2,3-benzotriazole","","- C13 H11 N3 O2 S -","- C13 H11 N3 O2 S -","- C26 H22 N6 O4 S2 -","2","1","LH6480","Rodríguez, Ricaurte; Nogueras, Manuel; Cobo, Justo; Low, John N.; Glidewell, Christopher","1-(4-Methylphenylsulfonyl)-1<i>H</i>-1,2,3-benzotriazole: sheets built from C—H···N, C—H···O and C—H···π(arene) hydrogen bonds","Acta Crystallographica Section E","2005","61","9","o2795","o2797","10.1107/S1600536805024219","","","0.71073","MoKα","","0.047","0.0371","","","0.0912","0.0976","","","","","","1.052","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206743","11.0997","0.0005","6.9493","0.0003","12.3296","0.0005","90","","92.084","0.002","90","","950.42","0.07","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Iodo-2,6-dinitrotoluene","","- C7 H5 I N2 O4 -","- C7 H5 I N2 O4 -","- C28 H20 I4 N8 O16 -","4","1","LH6482","Watkin, David J.; Motherwell, W. D. S.; Cooper, Richard I.; Pantos, Stefan; Steadman, Oliver I.","3-Iodo-2,6-dinitrotoluene","Acta Crystallographica Section E","2005","61","9","o2836","o2838","10.1107/S1600536805024864","","","0.71073","MoKα","","0.051","0.051","","0.0668","0.0668","0.0668","","","","","","0.8874","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206744","5.9504","0.0002","14.5676","0.0004","22.0403","0.0008","90","","90","","90","","1910.52","0.11","170","","170","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,4-Anhydro-2-C-benzyloxymethyl-2,3:5,6-di-O-isopropylidene-D-tallitol","","- C20 H28 O6 -","- C20 H28 O6 -","- C80 H112 O24 -","4","1","LH6483","Watkin, David J.; Parry, Loren L.; Soengas, Raquel; Fleet, George W. J.","1,4-Anhydro-2-<i>C</i>-benzyloxymethyl-2,3:5,6-di-<i>O</i>-isopropylidene-<small>D</small>-tallitol","Acta Crystallographica Section E","2005","61","9","o2865","o2867","10.1107/S1600536805025031","","","0.71073","MoKα","","0.0473","0.0473","","0.0747","0.0747","0.0747","","","","","","0.9912","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206745","8.4723","0.0011","13.7762","0.0018","14.8752","0.0019","90","","103.15","0.002","90","","1690.6","0.4","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Benzimidazol-3-ium-2-ylmethyl)(benzimidazol-2-ylmethyl)aminium sulfate","","- C16 H17 N5 O4 S -","- C16 H17 N5 O4 S -","- C64 H68 N20 O16 S4 -","4","1","LH6484","Meng, Xiang-Gao; Mei, Fu-Sheng; Liao, Zhan-Ru","(Benzimidazol-3-ium-2-ylmethyl)(benzimidazol-2-ylmethyl)aminium sulfate","Acta Crystallographica Section E","2005","61","9","o3047","o3049","10.1107/S1600536805025109","","","0.71073","MoKα","","0.0778","0.0601","","","0.1593","0.1705","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206746","5.8241","0.0001","8.4972","0.0002","27.1899","0.0007","90","","90","","90","","1345.59","0.05","190","","190","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,2:3,4-Di-O-isopropylidene-α-D-tagatofuranose","","- C12 H20 O6 -","- C12 H20 O6 -","- C48 H80 O24 -","4","1","LH6485","David J. Watkin; Andreas F. G. Glawar; Raquel Soengas; Ulla P. Skytte; Mark R. Wormald; Raymond A. Dwek; George W. J. Fleet","1,2:3,4-Di-<i>O</i>-isopropylidene-α-<small>D</small>-tagatofuranose","Acta Crystallographica Section E","2005","61","9","o2891","o2893","10.1107/S1600536805025092","","","0.71073","MoKα","","0.0416","0.0358","","0.087","0.0837","0.087","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206747","10.3222","0.0009","11.5993","0.001","16.0222","0.0014","90","","101.197","0.002","90","","1881.8","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[[[trans-bis(3-aminopyridine)copper(II)]-μ~3~-5-hydroxy-1,3- benzenedicarboxylato] monohydrate]","","- C18 H18 Cu N4 O6 -","- C18 H18 Cu N4 O6 -","- C72 H72 Cu4 N16 O24 -","4","1","LH6487","Wu, Jian-Yi; Feng, De-Ming; He, Hong-Yin; Wang, Qing-Xiang; Zhu, Long-Guan","Poly[[[<i>trans</i>-bis(3-aminopyridine)copper(II)]-μ~3~-5-hydroxy-1,3-benzenedicarboxylato] monohydrate]","Acta Crystallographica Section E","2005","61","9","m1779","m1781","10.1107/S1600536805025535","","","0.71073","MoKα","","0.0564","0.0439","","","0.1221","0.1284","","","","","","1.007","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206748","19.095","0.012","19.095","0.012","19.095","0.012","90","","90","","90","","6962","8","123","2","123","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","Thallium perfluorotetraphenylborate","","- C24 B F20 Tl -","- C24 B F20 Tl -","- C288 B12 F240 Tl12 -","12","0.25","LH6488","Parvez, Masood; Piers, Warren E.; Ghesner, Ioan","Thallium tetrakis(pentafluorophenyl)borate","Acta Crystallographica Section E","2005","61","9","m1801","m1803","10.1107/S1600536805025808","","","0.71073","MoKα","","0.065","0.04","","","0.077","0.087","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206749","10.3839","0.0002","10.4574","0.0002","19.031","0.0005","90","","103.806","0.0009","90","","2006.84","0.08","190","","190","","","","","","","","","3","P 1 21 1","P 2yb","4","","2-C-Benzyloxymethyl-2,3:5,6-di-O-isopropylidene-D-allono-1,4-lactone","","- C20 H26 O7 -","- C20 H26 O7 -","- C80 H104 O28 -","4","2","LH6489","David J. Watkin; Loren L. Parry; Raquel Soengas; Ken Izumori; George W. J. Fleet","2-<i>C</i>-Benzyloxymethyl-2,3:5,6-di-<i>O</i>-isopropylidene-<small>D</small>-allono-1,4-lactone","Acta Crystallographica Section E","2005","61","9","o2955","o2957","10.1107/S1600536805025791","","","0.71073","MoKα","","0.0492","0.0492","","0.0966","0.0966","0.0966","","","","","","0.9528","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206750","10.484","0.015","10.468","0.015","15.39","0.016","90","","99.69","0.1","90","","1665","4","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Rubidium gallium disulfide","Rubidium thiogallate","","- Ga Rb S2 -","- Ga Rb S2 -","- Ga16 Rb16 S32 -","16","2","MG6043","Asmita Kumari; K. Vidyasagar","Rubidium thiogallate","Acta Crystallographica Section E","2005","61","9","i193","i195","10.1107/S1600536805024815","","","0.71073","MoKα","","0.0867","0.0531","","","0.1798","0.1861","","","","","","1.193","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206751","4.3424","0.0015","4.3424","0.0015","10.221","0.007","90","","90","","90","","192.73","0.16","120","2","120","2","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","Cerium copper diantimonide","Cerium copper diantimonide","","- Ce Cu0.93 Sb2 -","- Ce Cu0.93 Sb2 -","- Ce2 Cu1.86 Sb4 -","2","0.125","MG6044","Tobash, Paul H.; Bobev, Svilen","Cerium copper diantimonide, CeCu~0.93(1)~Sb~2~","Acta Crystallographica Section E","2005","61","9","i191","i192","10.1107/S1600536805024505","","","0.71073","MoKα","","0.0537","0.0447","","","0.1079","0.1195","","","","","","1.138","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206752","10.937","0.002","7.0519","0.0012","9.2671","0.0019","90","","90","","90","","714.7","0.2","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","indium(I) tetrachloroaluminate","indium(I) tetrachloroaluminate","","- Al Cl4 In -","- Al Cl4 In -","- Al4 Cl16 In4 -","4","0.5","MG6045","Timofte, Tudor; Mudring, Anja-Verena","Indium(I) tetrachloroaluminate","Acta Crystallographica Section E","2005","61","9","i199","i200","10.1107/S1600536805025067","","","0.71073","MoKα","","0.0966","0.0508","","","0.1543","0.1738","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206753","6.379","0.005","18.239","0.005","10.101","0.005","90","","107.331","0.005","90","","1121.9","1.1","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2-Dimethyl-5-[(1,2,4-triazin-3-ylamino)methylene]-1,3-dioxane-4,6-dione","","- C10 H10 N4 O4 -","- C10 H10 N4 O4 -","- C40 H40 N16 O16 -","4","1","NC6037","Joussef, Antonio C.; Silva, Luiz Everson da; Bortoluzzi, Adailton J.; Foro, Sabine","2,2-Dimethyl-5-[(1,2,4-triazin-3-ylamino)methylene]-1,3-dioxane-4,6-dione","Acta Crystallographica Section E","2005","61","9","o2873","o2874","10.1107/S1600536805024918","","","0.71069","MoKα","","0.1175","0.0553","","","0.1343","0.1612","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206754","9.863","0.002","10.081","0.002","10.731","0.003","98.839","0.006","95.787","0.005","114.928","0.007","939.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[2-(4-nitrophenoxyl)-2-(1H-1,2,4-triazol-1-yl)acetyl]ferrocene","","- C20 H16 Fe N4 O4 -","- C20 H16 Fe N4 O4 -","- C40 H32 Fe2 N8 O8 -","2","1","NC6041","Shao, Ling; Hu, Yan; Tao, Wei-Feng; Jin, Zhong; Fang, Jian-Xin","[2-(4-Nitrophenoxyl)-2-(1<i>H</i>-1,2,4-triazol-1-yl)acetyl]ferrocene","Acta Crystallographica Section E","2005","61","9","m1837","m1839","10.1107/S1600536805026152","","","0.71073","MoKα","","0.0532","0.0363","","","0.0814","0.088","","","","","","1.032","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206755","7.6816","0.0008","11.8247","0.0015","12.0196","0.0014","90","","90","","90","","1091.8","0.2","170","2","170","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","[mppyr][I]","N-methyl-N-propyl-pyrrolidinium iodide","","- C8 H18 I N -","- C8 H18 I N -","- C32 H72 I4 N4 -","4","1","NC6042","Babai, Arash; Mudring, Anja-Verena","<i>N</i>-Methyl-<i>N</i>-propylpyrrolidinium iodide","Acta Crystallographica Section E","2005","61","9","o2913","o2915","10.1107/S1600536805025481","","","0.71073","MoKα","","0.0286","0.0272","","","0.0691","0.0731","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206756","18.5888","0.0012","9.5697","0.0005","18.3776","0.0013","90","","107.883","0.005","90","","3111.2","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Methyltriphenylsilane","","- C19 H18 Si -","- C19 H18 Si -","- C152 H144 Si8 -","8","2","NC6044","Kückmann, Theresa; Lerner, Hans-Wolfram; Bolte, Michael","Methyltriphenylsilane","Acta Crystallographica Section E","2005","61","9","o3030","o3031","10.1107/S1600536805026310","","","0.71073","MoKα","","0.0456","0.0356","","","0.088","0.0913","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206757","9.8964","0.0001","10.3253","0.0001","26.0261","0.0004","90","","98.971","0.001","90","","2626.9","0.06","100","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","mer-Tris(benzotriazole-κN)(pyridine-2,6-dicarboxylato-κ^3^N,O,O')nickel(II)","","- C25 H18 N10 Ni O4 -","- C25 H18 N10 Ni O4 -","- C100 H72 N40 Ni4 O16 -","4","1","NG6152","Ramadevi, Palani; Kumaresan, Sudalaiandi; Muir, Kenneth W.","<i>mer</i>-Tris(1<i>H</i>-benzotriazole-κ<i>N</i>)(pyridine-2,6-dicarboxylato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section E","2005","61","9","m1749","m1751","10.1107/S1600536805024700","","","0.71073","MoKα","","","0.0363","","","","0.0935","","","","","","1.063","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2206758","11.2159","0.0012","11.7722","0.0012","13.2758","0.0013","90","","93.454","0.004","90","","1749.7","0.3","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Phyllo-poly[[silver(I)-di-μ~2~-4-aminomethylpyridine-κ^2^N:N'] hexafluorophosphate]","","- C12 H16 Ag F6 N4 P -","- C12 H16 Ag F6 N4 P -","- C48 H64 Ag4 F24 N16 P4 -","4","1","NG6169","Feazell, Rodney P.; Carson, Cody E.; Klausmeyer, Kevin K.","Phyllo-poly[[silver(I)-di-μ~2~-4-aminomethylpyridine-κ^2^<i>N</i>:<i>N</i>'] hexafluorophosphate]: a two-dimensional coordination polymer formed by the reaction of silver(I) hexafluorophosphate with 4-aminomethylpyridine","Acta Crystallographica Section E","2005","61","9","m1694","m1696","10.1107/S1600536805024256","","","0.71073","MoKα","","0.0236","0.0205","","","0.0499","0.0513","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206759","10.6042","0.0003","20.1157","0.0008","25.9795","0.0008","90","","90","","90","","5541.7","0.3","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tris(1H-benzimidazole-κN^3^)(thiodiacetato-κ^3^O,S,O')cadmium(II) dihydrate","","- C25 H26 Cd N6 O6 S -","- C25 H26 Cd N6 O6 S -","- C200 H208 Cd8 N48 O48 S8 -","8","1","NG6172","Tian-Tian Pan; Duan-Jun Xu","Tris(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)(thiodiacetato-κ^3^<i>O</i>,<i>S</i>,<i>O</i>')cadmium(II) dihydrate","Acta Crystallographica Section E","2005","61","9","m1735","m1737","10.1107/S1600536805024086","","","0.71069","MoKα","","0.086","0.067","","","0.151","0.167","","","","","","1.326","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206760","10.67","0.005","12.553","0.005","13.505","0.005","115.242","0.012","93.281","0.017","110.841","0.017","1481.6","1.1","295","3","295","3","","","","","","","","6","P -1","-P 1","2","","cis-Aquachlorobis(1,10-phenanthroline)nickel(II) chloride 4-hydroxybenzoic acid dihydrate","","- C31 H28 Cl2 N4 Ni O6 -","- C31 H28 Cl2 N4 Ni O6 -","- C62 H56 Cl4 N8 Ni2 O12 -","2","1","NG6173","Jian-Rong Su; Duan-Jun Xu","<i>cis</i>-Aquachlorobis(1,10-phenanthroline)nickel(II) chloride 4-hydroxybenzoic acid dihydrate","Acta Crystallographica Section E","2005","61","9","m1738","m1740","10.1107/S1600536805024098","","","0.71073","MoKα","","0.055","0.041","","","0.125","0.145","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206761","6.9619","0.0008","9.3723","0.0011","9.9791","0.0011","74.9","0.002","89.418","0.002","78.241","0.002","614.82","0.12","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[4,4'-bipyridinium [[diaquadisulfatomanganate(II)]-μ-4,4'- bipyridine-κ^2^N:N'] dihydrate]","","- C20 H26 Mn N4 O12 S2 -","- C20 H26 Mn N4 O12 S2 -","- C20 H26 Mn N4 O12 S2 -","1","0.5","NG6174","Fan, Sai-Rong; Zhu, Long-Guan","<i>catena</i>-Poly[4,4'-bipyridinium [[diaquadisulfatomanganate(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] dihydrate]","Acta Crystallographica Section E","2005","61","9","m1689","m1691","10.1107/S1600536805024268","","","0.71073","MoKα","","0.0384","0.0375","","","0.0913","0.092","","","","","","1.165","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206762","22.27","0.002","10.4487","0.0012","7.7771","0.0009","90","","107.249","0.012","90","","1728.3","0.3","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","diaquabis(vanillinato-κ^2^O,O')cobalt(II)","","- C16 H18 Co O8 -","- C16 H18 Co O8 -","- C64 H72 Co4 O32 -","4","0.5","NG6181","Dong-Dong Lin; Duan-Jun Xu","Redetermination of diaquabis(vanillinato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)","Acta Crystallographica Section E","2005","61","9","m1821","m1822","10.1107/S1600536805026085","","","0.71073","MoKα","","0.036","0.032","","","0.082","0.084","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206763","14.981","0.002","7.6973","0.0012","17.468","0.003","90","","90.001","0.001","90","","2014.3","0.5","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5,6-Dianilino-3-(4-chlorophenyl)-3,6-dihydro-1,2,3-triazolo[4,5-d]pyrimidin- 7-one","","- C22 H16 Cl N7 O -","- C22 H16 Cl N7 O -","- C88 H64 Cl4 N28 O4 -","4","1","OB6548","Zhao, Jun-Feng; Hu, Yang-Gen; Ding, Ming-Wu; He, Hong-Wu","5,6-Dianilino-3-(4-chlorophenyl)-3,6-dihydro-1,2,3-triazolo[4,5-<i>d</i>]pyrimidin-7-one","Acta Crystallographica Section E","2005","61","9","o2791","o2792","10.1107/S1600536805024074","","","0.71073","MoKα","","0.0858","0.0497","","","0.1112","0.125","","","","","","0.901","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206764","15.579","0.003","6.0883","0.0012","21.725","0.004","90","","104.76","0.03","90","","1992.6","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[aquadipyridinezinc(II)]-μ-benzene-1,4-dioxyacetato]","","- C20 H20 N2 O7 Zn -","- C20 H20 N2 O7 Zn -","- C80 H80 N8 O28 Zn4 -","4","0.5","OB6552","Hong, Xian-Lan; Li, Yi-Zhi; Bai, Jun-Feng","<i>catena</i>-Poly[[aquadipyridinezinc(II)]-μ-benzene-1,4-dioxyacetato]","Acta Crystallographica Section E","2005","61","9","m1863","m1865","10.1107/S1600536805023676","","","0.71073","MoKα","","0.0658","0.0421","","","0.0823","0.0886","","","","","","0.876","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206765","6.812","0.003","12.082","0.005","22.802","0.003","90","","90","","90","","1876.7","1.2","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","17a-Methyl-4-androstene-3b,17b-diol monohydrate","","- C20 H34 O3 -","- C20 H34 O3 -","- C80 H136 O12 -","4","1","OB6554","Chun-Nian Xia; Wei-Xiao Hu; Wei Zhou","17a-Methyl-4-androstene-3b,17b-diol monohydrate","Acta Crystallographica Section E","2005","61","9","o2896","o2898","10.1107/S1600536805025316","","","0.71073","MoKα","","0.0573","0.0329","","","0.0854","0.0962","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206766","11.725","0.002","20.396","0.003","11.04","0.002","90","","90","","90","","2640.1","0.8","295","","295.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 2-O-benzyl-3,4-O-dibenzoyl-1-thio-β-L-fucopyranoside","","- C28 H28 O6 S -","- C28 H28 O6 S -","- C112 H112 O24 S4 -","4","1","OB6555","Laurent F. Bornaghi; Nicholas B. Drinnan; Tracie Ramsdale; Peter C. Healy; Alan R. White","Methyl 3,4-<i>O</i>-dibenzoyl-2-<i>O</i>-benzyl-1-thio-β-<small>L</small>-fucopyranoside","Acta Crystallographica Section E","2005","61","9","o2899","o2901","10.1107/S160053680502516X","","","0.7107","MoKα","","0.0932","0.0465","","","0.1209","0.1418","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206767","11.589","0.001","14.27","0.001","15.463","0.001","90","","92.259","0.001","90","","2555.2","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(dimethylammonium) mer-tris(salicylato-κ^2^O,O')titanate(IV)","","- C25 H28 N2 O9 Ti -","- C25 H28 N2 O9 Ti -","- C100 H112 N8 O36 Ti4 -","4","1","OB6556","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Bis(dimethylammonium) <i>mer</i>-tris(salicylato-κ^2^<i>O</i>,<i>O</i>')titanate(IV)","Acta Crystallographica Section E","2005","61","9","m1730","m1732","10.1107/S160053680502475X","","","0.71073","MoKα","","0.073","0.055","","","0.152","0.186","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206768","9.021","0.001","11.072","0.001","15.067","0.002","75.545","0.002","84.83","0.002","87.146","0.003","1450.8","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Piperazinium(2+) fac-tris(salicylato-κ^2^O,O')titanate(IV) monohydrate dimethylformamide solvate","","- C28 H33 N3 O11 Ti -","- C28 H33 N3 O11 Ti -","- C56 H66 N6 O22 Ti2 -","2","1","OB6557","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Piperazinium(2+) <i>fac</i>-tris(salicylato-κ^2^<i>O</i>,<i>O</i>')titanate(IV) monohydrate dimethylformamide solvate","Acta Crystallographica Section E","2005","61","9","m1733","m1734","10.1107/S1600536805024761","","","0.71073","MoKα","","0.128","0.076","","","0.185","0.234","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206770","16.876","0.002","8.2937","0.0009","13.6237","0.0016","90","","90","","90","","1906.8","0.4","295","2","295","2","","","","","","","","6","P n a 21","P 2c -2n","33","","(1,3-Diaminopropane-κ^2^N,N')[tris(2-aminoethyl)amine- κ^4^N,N',N'',N''']nickel(II) bis(perchlorate)","","- C9 H28 Cl2 N6 Ni O8 -","- C9 H28 Cl2 N6 Ni O8 -","- C36 H112 Cl8 N24 Ni4 O32 -","4","1","OB6559","Yung-Chan Lin; Tian-Huey Lu; Chang-Yao Li; Fen-Ling Liao; Chung-Sun Chung","(1,3-Diaminopropane-κ^2^<i>N</i>,<i>N</i>')[tris(2-aminoethyl)amine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']nickel(II) bis(perchlorate)","Acta Crystallographica Section E","2005","61","9","m1757","m1759","10.1107/S1600536805025225","","","0.71073","MoKα","","0.0267","0.0251","","","0.0616","0.0624","","","","","","0.953","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206771","9.779","0.004","20.122","0.008","15.667","0.006","90","","100.011","0.005","90","","3036","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[hydrotris(1-pyrazolyl)borato-κ^3^N,N',N'']iron(III) tetrachloroferrate(III) acetonitrile solvate","","- C20 H23 B2 Cl4 Fe2 N13 -","- C20 H23 B2 Cl4 Fe2 N13 -","- C80 H92 B8 Cl16 Fe8 N52 -","4","1","OB6561","Hong, Chao-Gang; Zhou, Ai-Ju; Tong, Ming-Liang","Bis[hydrotris(1-pyrazolyl)borato-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']iron(III) tetrachloroferrate(III) acetonitrile solvate","Acta Crystallographica Section E","2005","61","9","m1774","m1776","10.1107/S1600536805025456","","","0.71073","MoKα","","0.0591","0.0468","","","0.1171","0.1272","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206772","8.236","0.005","9.003","0.006","10.781","0.007","82.203","0.01","85.384","0.011","74.53","0.01","762.5","0.8","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","1-(4-Chlorophenyl)-2,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indol-4-one","","- C17 H18 Cl N O -","- C17 H18 Cl N O -","- C34 H36 Cl2 N2 O2 -","2","1","OB6566","Chopra, Deepak; Nagarajan, K.; Guru Row, T. N.","1-(4-Chlorophenyl)-2,6,6-trimethyl-1,5,6,7-tetrahydro-4<i>H</i>-indol-4-one","Acta Crystallographica Section E","2005","61","9","o3089","o3091","10.1107/S1600536805026905","","","0.71073","MoKα","","0.0471","0.0415","","","0.1124","0.118","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206773","9.7761","0.0014","13.0082","0.0019","15.832","0.002","75.9","0.003","87.872","0.003","81.639","0.003","1931.9","0.5","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","1-(4-Chlorobenzyl)-6,6-dimethyl-2-phenyl-1,5,6,7-tetrahydro-4H-indol-4-one","","- C23 H22 Cl N O -","- C23 H22 Cl N O -","- C92 H88 Cl4 N4 O4 -","4","2","OB6567","Chopra, Deepak; Nagarajan, K.; Guru Row, T. N.","1-(4-Chlorobenzyl)-6,6-dimethyl-2-phenyl-1,5,6,7-tetrahydro-4<i>H</i>-indol-4-one","Acta Crystallographica Section E","2005","61","9","o3092","o3094","10.1107/S1600536805026929","","","0.71073","MoKα","","0.1733","0.0878","","","0.1621","0.1996","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206774","8.487","0.004","11.23","0.003","19.662","0.008","90","","100.19","0.03","90","","1844.4","1.3","158","2","158","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aqua(4'-hydroxy-2,2',6',6''-terpyridyl)copper(II) perchlorate","","- C15 H13 Cl2 Cu N3 O10 -","- C15 H13 Cl2 Cu N3 O10 -","- C60 H52 Cl8 Cu4 N12 O40 -","4","1","OB6569","Jeitler, James R.; Turnbull, Mark M.","Aqua(4'-hydroxy-2,2';6',6''-terpyridyl)copper(II) bis(perchlorate)","Acta Crystallographica Section E","2005","61","9","m1846","m1848","10.1107/S1600536805026103","","","0.71073","MoKα","","0.1166","0.0575","","","0.1218","0.1367","","","","","","0.85","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206775","7.514","0.007","8.853","0.008","25.21","0.02","85.15","0.02","89.36","0.02","86.19","0.02","1667","3","123.1","","","","","","","","","","","4","P -1","-P 1","2","","Bis(4-dodecyloxyphenyl)diazene oxide","","- C36 H58 N2 O3 -","- C36 H58 N2 O3 -","- C72 H116 N4 O6 -","2","1","OB6570","Kubo, Kanji; Matsumoto, Taisuke; Mori, Akira; Takahashi, Hajime; Takechi, Haruko","Bis(4-dodecyloxyphenyl)diazene oxide","Acta Crystallographica Section E","2005","61","9","o3056","o3058","10.1107/S1600536805026395","","","0.7107","MoKα","","","0.117","","","","0.226","","","","","","1.212","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206776","5.389","0.0008","12.2012","0.0017","19.998","0.003","90","","91.764","0.01","90","","1314.3","0.3","93.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 N6 O6 -","- C30 H26 N6 O6 -","- C60 H52 N12 O12 -","2","0.5","OB6573","Mizuguchi, Jin; Makino, Takashi; Imura, Yasuo; Takahashi, Hiroo; Suzuki, Shigeru","<i>N</i>,<i>N</i>'-Bis(4-pyridyl)naphthalene-3,4:7,8-dicarboximide dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","9","o3044","o3046","10.1107/S1600536805026371","","","1.5418","CuKα","","","0.0967","","","","0.309","","","","","","1.106","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206777","8.195","0.0008","11.1921","0.0008","26.931","0.003","90","","90","","90","","2470.1","0.4","293","2","","","","","","","","","","3","P 21 c a","P -2ac 2a","29","1,3-bis(9-ethylcarbazol-3-yl)propane","1,3-bis(9-ethyl-9H-carbazol-3-yl)propane","","- C31 H30 N2 -","- C31 H30 N2 -","- C124 H120 N8 -","4","1","OM6253","Asker, Erol; Masnovi, John","1,3-Bis(9-ethylcarbazol-3-yl)propane","Acta Crystallographica Section E","2005","61","9","o2781","o2783","10.1107/S1600536805024050","","","0.71073","MoKα","","","0.0515","","","","0.129","","","","","","0.956","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206778","7.5086","0.0004","7.7202","0.0004","16.7277","0.0009","92.256","0.001","93.66","0.001","111.039","0.001","901.16","0.08","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","tetraaquabis(4,4'-bipyridine)zinc(II) bis(4-carboxybenzenesulfonate)","","- C34 H34 N4 O14 S2 Zn -","- C34 H34 N4 O14 S2 Zn -","- C34 H34 N4 O14 S2 Zn -","1","0.5","OM6255","Zhang, Li-Ping; Zhu, Long-Guan","The monodentate 4,4'-bipyridine complex tetraaquabis(4,4'-bipyridine)zinc(II) bis(4-carboxybenzenesulfonate)","Acta Crystallographica Section E","2005","61","9","m1768","m1770","10.1107/S1600536805025377","","","0.71073","MoKα","","0.0492","0.0469","","","0.1277","0.1298","","","","","","1.103","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206779","11.7937","0.0013","8.1652","0.0009","17.076","0.0019","90","","106.202","0.002","90","","1579.1","0.3","153","2","153","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Dichlorobis(triphenylphosphine)iron(II)","","- C36 H30 Cl2 Fe P2 -","- C36 H30 Cl2 Fe P2 -","- C72 H60 Cl4 Fe2 P4 -","2","0.5","OM6256","Seewald, Oliver; Flörke, Ulrich; Henkel, Gerald","Dichlorobis(triphenylphosphine)iron(II)","Acta Crystallographica Section E","2005","61","9","m1829","m1830","10.1107/S1600536805026206","","","0.71073","MoKα","","0.0467","0.0403","","","0.1037","0.1068","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206780","10.0909","0.0007","12.7898","0.0009","17.5601","0.0012","95.6425","0.0012","99.8511","0.0013","109.665","0.0011","2072.8","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","di-μ-isophthalato-bis[bis(isonicotinamide)copper(II)] trihydrate","","- C40 H38 Cu2 N8 O15 -","- C40 H38 Cu2 N8 O15 -","- C80 H76 Cu4 N16 O30 -","2","1","RN6055","Li, Chuanbi; Liu, Bo; Gao, Guanggang; Che, Guangbo","Hydrogen bonding and π‒π stacking in di-μ-isophthalato-bis[bis(isonicotinamide)copper(II)] trihydrate","Acta Crystallographica Section E","2005","61","9","m1705","m1707","10.1107/S1600536805024645","","","0.71073","MoKα","","0.0646","0.0445","","","0.0907","0.0957","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206781","10.2724","0.0009","15.839","0.0013","12.9779","0.0011","90","","90","","90","","2111.6","0.3","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","1-Benzyl-2-[2-(benzyloxy)phenyl]-1H-benzimidazole","","- C27 H22 N2 O -","- C27 H22 N2 O -","- C108 H88 N8 O4 -","4","1","RN6057","Tong, Yi-Ping","1-Benzyl-2-[2-(benzyloxy)phenyl]-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","9","o2978","o2980","10.1107/S1600536805025675","","","0.71073","MoKα","","0.0542","0.0446","","","0.1047","0.1101","","","","","","1.079","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206782","18.799","0.001","11.4968","0.0006","15.2179","0.0008","90","","100.88","0.001","90","","3229.9","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,5-Bis[bis(diethylamino)phosphino]-9,9-dimethylxanthene","","- C31 H52 N4 O P2 -","- C31 H52 N4 O P2 -","- C124 H208 N16 O4 P8 -","4","1","RN6058","David J Adams; John Fawcett; Eric G. Hope; Alison M. Stuart","4,5-Bis[bis(diethylamino)phosphino]-9,9-dimethylxanthene","Acta Crystallographica Section E","2005","61","9","o2831","o2832","10.1107/S1600536805024797","","","0.71073","MoKα","","0.0596","0.0497","","","0.1326","0.1385","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206783","12.8275","0.0012","14.8431","0.0013","7.8272","0.0007","90","","95.334","0.002","90","","1483.8","0.2","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,2'-(Propane-1,3-diyldioxy)dibenzaldehyde","","- C17 H16 O4 -","- C17 H16 O4 -","- C68 H64 O16 -","4","1","RZ6105","Pu-Zhou Hu; Lu-Fang Ma; Jian-Ge Wang; Bang-Tun Zhao; Li-Ya Wang","2,2'-(Propane-1,3-diyldioxy)dibenzaldehyde","Acta Crystallographica Section E","2005","61","9","o2775","o2777","10.1107/S1600536805023925","","","0.71073","MoKα","","0.0833","0.0391","","","0.0878","0.1099","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206784","11.47","0.002","4.888","0.0006","15.065","0.002","90","","99.53","0.01","90","","833","0.2","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Nitroquinolin-2(1H)-one","","- C9 H6 N2 O3 -","- C9 H6 N2 O3 -","- C36 H24 N8 O12 -","4","1","SG6021","Silva, Luiz Everson da; Joussef, Antonio C.; Foro, Sabine; Schmidt, Boris","6-Nitroquinolin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","9","o2992","o2993","10.1107/S1600536805025894","","","1.5418","CuKα","","0.1066","0.0546","","","0.1248","0.1494","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206785","7.9981","0.0012","11.3139","0.0016","12.0232","0.0017","68.893","0.002","70.744","0.002","70.897","0.002","931","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","1-[(4-Nitrophenoxy)acetyl]-3-(5-thioxo-4,5-dihydro-1,3,4-thiadiazolin-2-yl)urea dimethylformamide solvate","","- C14 H16 N6 O6 S2 -","- C14 H16 N6 O6 S2 -","- C28 H32 N12 O12 S4 -","2","1","SG6022","Song, Xin-Jian; Tan, Xiao-Hong; Li, Yao-Hua; Zhang, Zheng-Wen; Wang, Yan-Gang","1-[(4-Nitrophenoxy)acetyl]-3-(5-thioxo-4,5-dihydro-1,3,4-thiadiazolin-2-yl)urea dimethylformamide solvate","Acta Crystallographica Section E","2005","61","9","o3066","o3068","10.1107/S1600536805026942","","","0.71073","MoKα","","0.0671","0.0469","","","0.1096","0.1306","","","","","","1.017","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206786","12.334","0.009","12.98","0.011","13.688","0.01","112.51","0.011","90.343","0.002","114.825","0.01","1801","2","173.1","","","","","","","","","","","5","P -1","-P 1","2","","Diaquabis[1,4-bis(1-imidazolyl)benzene]trinitratolanthanum(III) 1,4-bis(1-imidazolyl)benzene hemisolvate monohydrate","","- C30 H31 La N13 O12 -","- C30 H29 La N13 O12 -","- C60 H58 La2 N26 O24 -","2","1","SG6023","Wei-Yin Sun; Zheng-Hua Zhang; Jin-Mao Zhong; Hiroyuki Kawaguchi","Diaquabis[1,4-bis(1-imidazolyl)benzene]trinitratolanthanum(III) 1,4-bis(1-imidazolyl)benzene hemisolvate monohydrate","Acta Crystallographica Section E","2005","61","9","m1876","m1877","10.1107/S1600536805026954","","","0.7107","MoKα","","","0.026","","","","0.075","","","","","","1.001","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206787","4.4079","0.0004","13.3559","0.0011","18.6196","0.0016","90","","96.136","0.012","90","","1089.88","0.16","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(1H-benzimidazole-κN)iodomercury(II)]-μ-iodo]","","- C7 H6 Hg I2 N2 -","- C7 H6 Hg I2 N2 -","- C28 H24 Hg4 I8 N8 -","4","1","SG6024","Yi-Hong Shen; Jia-Geng Liu; Duan-Jun Xu","<i>catena</i>-Poly[[(1<i>H</i>-benzimidazole-κ<i>N</i>)iodomercury(II)]-μ-iodo]","Acta Crystallographica Section E","2005","61","9","m1880","m1882","10.1107/S1600536805026966","","","0.71069","MoKα","","0.039","0.033","","","0.065","0.067","","","","","","1.199","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206788","8.947","0.002","14.082","0.008","13.604","0.002","91.51","0.02","98.18","0.02","112.27","0.02","1564","1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","[Ni(depe)Cl2]","[1,2-bis(diethylphosphino)ethane]dichloronickel(II)","","- C10 H24 Cl2 Ni P2 -","- C10 H24 Cl2 Ni P2 -","- C40 H96 Cl8 Ni4 P8 -","4","2","SJ6120","Davies, Sian C.; Duff, Samantha E.; Evans, David J.","[1,2-Bis(diethylphosphino)ethane]dichloronickel(II)","Acta Crystallographica Section E","2005","61","9","m1674","m1676","10.1107/S160053680502386X","","","0.71069","Mo-Kα","","0.0482","0.0327","","","0.0794","0.0889","","","","","","1.071","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206789","10.4835","0.0019","9.4768","0.0018","18.66","0.004","90","","90.981","0.004","90","","1853.6","0.6","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[4-benzoyl-5-methyl-2-phenyl-2H-pyrazol-3(4H)-onato- κ^2^O,O']bis(N,N-dimethylformamide-κO)cadmium(II)","","- C40 H40 Cd N6 O6 -","- C40 H40 Cd N6 O6 -","- C80 H80 Cd2 N12 O12 -","2","0.5","SJ6124","Xiao-Ping Shen; Ai-Hua Yuan","Bis[4-benzoyl-5-methyl-2-phenyl-2<i>H</i>-pyrazol-3(4<i>H</i>)-onato-κ^2^<i>O</i>,<i>O</i>']bis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)cadmium(II)","Acta Crystallographica Section E","2005","61","9","m1714","m1716","10.1107/S1600536805024360","","","0.71073","MoKα","","0.0744","0.0627","","","0.1055","0.1101","","","","","","1.088","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206790","14.944","0.002","5.0501","0.0008","16.264","0.003","90","","107.843","0.003","90","","1168.4","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl (4-bromo-1H-pyrrole-2-carboxamido)acetate","","- C9 H11 Br N2 O3 -","- C9 H11 Br N2 O3 -","- C36 H44 Br4 N8 O12 -","4","1","SJ6125","Xiang Chao Zeng","Ethyl (4-bromo-1<i>H</i>-pyrrole-2-carboxamido)acetate","Acta Crystallographica Section E","2005","61","9","o2958","o2960","10.1107/S1600536805024906","","","0.71073","MoKα","","0.0713","0.0366","","","0.0936","0.1102","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206791","9.676","0.003","19.118","0.006","13.882","0.003","90","","95.9","0.02","90","","2554.4","1.3","546","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","C12 H36 N4 O12 P4 , 2H2O","Bis(1,6-hexanediaminium) cyclotetraphosphate dihydrate","","- C12 H40 N4 O14 P4 -","- C12 H40 N4 O14 P4 -","- C48 H160 N16 O56 P16 -","4","1","SJ6127","Soumhi, El Hassane; Saadoune, Ismael; Nahouane, Rachid; Driss, Ahmed","Bis(1,6-hexanediaminium) cyclotetraphosphate dihydrate","Acta Crystallographica Section E","2005","61","9","o2847","o2849","10.1107/S1600536805024542","","","0.71073","MoKα","","0.0492","0.0362","","","0.0946","0.1021","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206792","8.467","0.002","13.808","0.003","14.453","0.002","90","","106.62","0.02","90","","1619.1","0.6","300","2","300","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","C26 H32 N4 P4 O12","Bis(4,4'-diphenylmethylendiammonium) cyclotetraphosphate","","- C26 H32 N4 O12 P4 -","- C26 H32 N4 O12 P4 -","- C52 H64 N8 O24 P8 -","2","0.5","SJ6128","Nahouane, Rachid; Soumhi, El Hassane; Saadoune, Ismael; Driss, Ahmed","4,4'-Methylenedianilinium hemi(cyclotetraphosphate)","Acta Crystallographica Section E","2005","61","9","o2850","o2852","10.1107/S1600536805025043","","","0.71073","MoKα","","0.0506","0.0384","","","0.11","0.1176","","","","","","1.079","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2206793","6.8945","0.0009","17.432","0.002","13.8726","0.0019","90","","97.771","0.002","90","","1652","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Triaquabis(4-carboxy-1H-imidazole-5-carboxylato)cadmium(II) monohydrate","","- C10 H14 Cd N4 O12 -","- C10 H14 Cd N4 O12 -","- C40 H56 Cd4 N16 O48 -","4","1","SJ6130","Xiao-Jun Zhao; Xiu-Juan Jiang; Miao Du","Triaquabis(4-carboxy-1<i>H</i>-imidazole-5-carboxylato)cadmium(II) monohydrate: a three-dimensional hydrogen-bonded network","Acta Crystallographica Section E","2005","61","9","m1746","m1748","10.1107/S1600536805025122","","","0.71073","MoKα","","0.0346","0.0301","","","0.0784","0.0815","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206794","6.912","0.001","10.751","0.001","12.08","0.002","90","","103.18","0.01","90","","874","0.2","286","2","286","2","","","","","","","","3","P 1 21 1","P 2yb","4","","4,4,8,11b-tetramethyl-2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro- 1H,9H-6a:7,10a:11-diepoxyphenanthro[3,2-b]furan-9-one","","- C20 H26 O4 -","- C20 H26 O4 -","- C40 H52 O8 -","2","1","SU6216","Bai, Su-Ping; Zhu, Zhen-Fu; Yang, Li","An <i>ent</i>-abietane diterpenoid from <i>Doellingeria scaber</i>","Acta Crystallographica Section E","2005","61","9","o2853","o2855","10.1107/S1600536805025171","","","0.71073","MoKα","","0.061","0.0397","","","0.0818","0.0883","","","","","","0.888","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206795","11.0162","0.0012","19.98","0.002","9.5802","0.001","90","","99.092","0.003","90","","2082.1","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(N-Phenylbenzimidoyl)thiobenzanilide","","- C26 H20 N2 S -","- C26 H20 N2 S -","- C104 H80 N8 S4 -","4","1","SU6223","Naumov, Panc̆e; Ristovska, Natas̆a; Anastasova, Frosa; Ng, Seik Weng","<i>N</i>-(<i>N</i>-Phenylbenzimidoyl)thiobenzanilide","Acta Crystallographica, Section E","2005","61","9","o3036","o3037","10.1107/S160053680502653X","","","0.71073","MoKα","","0.106","0.058","","","0.131","0.153","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206796","13.4969","0.0003","11.7546","0.0003","16.1467","0.0004","90","","97.842","0.001","90","","2537.73","0.11","105","2","105","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,6-Bis(2-methoxyphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","","- C31 H28 N2 O4 -","- C31 H28 N2 O4 -","- C124 H112 N8 O16 -","4","1","SU6224","J. Suresh; V. P. Alex Raja; R. V. Krishnakumar; S. Natarajan; S. Perumal; A. Mostad","2,6-Bis(2-methoxyphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","Acta Crystallographica Section E","2005","61","9","o3050","o3052","10.1107/S1600536805026553","","","0.71073","MoKα","","0.047","0.035","","","0.092","0.098","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206797","14.1311","0.0007","3.8481","0.0002","22.0365","0.0011","90","","94.752","0.001","90","","1194.18","0.1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,5-Dichloro-N-(4-fluorobenzylidene)aniline","","- C13 H8 Cl2 F N -","- C13 H8 Cl2 F N -","- C52 H32 Cl8 F4 N4 -","4","1","SU6226","Wang, Xin; Zhang, Shu-Ping; Shao, Si-Chang","3,5-Dichloro-<i>N</i>-(4-fluorobenzylidene)aniline","Acta Crystallographica Section E","2005","61","9","o3071","o3072","10.1107/S1600536805026577","","","0.71073","MoKα","","0.0409","0.0368","","","0.1039","0.1064","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206798","8.6515","0.001","14.721","0.002","16.734","0.003","90","","97.702","0.004","90","","2112","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichloro-N-(2,4,6-trimethyl-benzyl)-N-(naphthalen-1-yl-methyl)- imidazolidin-2-ylideneruthenium","","- C24 H26 Cl2 N2 Ru -","- C24 H26 Cl2 N2 Ru -","- C96 H104 Cl8 N8 Ru4 -","4","1","TK6235","Arslan, Hakan; VanDerveer, Don; Özdemir, İsmail; Yaşar, Sedat; Çetinkaya, Bekir","Dichloro[3-(1-naphthylmethyl)-1-(2,4,6-trimethylbenzyl)imidazolidin-2-ylidene]ruthenium","Acta Crystallographica Section E","2005","61","9","m1873","m1875","10.1107/S160053680502698X","","","0.71073","MoKα","","0.038","0.029","","","0.06","0.063","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206799","15.325","0.003","14.009","0.002","5.8501","0.001","90","","92.908","0.004","90","","1254.3","0.4","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-Bis(4-chlorophenyl)prop-2-en-1-one","","- C15 H10 Cl2 O -","- C15 H10 Cl2 O -","- C60 H40 Cl8 O4 -","4","1","TK6238","Lei Wang; Wen Yang; De-Chun Zhang","1,3-Bis(4-chlorophenyl)prop-2-en-1-one","Acta Crystallographica, Section E","2005","61","9","o2820","2822","10.1107/S1600536805024566","","","0.7107","MoKα","","0.063","0.048","","","0.098","0.105","","","","","","1.15","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206800","33.9602","0.0007","33.9602","","3.9152","0.0001","90","","90","","120","","3910.43","0.13","150","2","150","2","","","","","","","","6","R -3 :H","-R 3","148","","catena-Poly[[[bis(3-aminopyridine-κN)copper(II)]-di-μ-chloro] hydrate]","","- C10 H14 Cl2 Cu N4 O -","- C10 H14 Cl2 Cu N4 O -","- C90 H126 Cl18 Cu9 N36 O9 -","9","0.5","TK6244","Lah, Nina; Leban, Ivan","<i>catena</i>-Poly[[[bis(3-aminopyridine-κ<i>N</i>)copper(II)]-di-μ-chloro] hydrate]","Acta Crystallographica Section E","2005","61","9","m1708","m1710","10.1107/S1600536805024578","","","0.71073","MoKα","","0.087","0.069","","","0.197","0.222","","","","","","1.25","","","","has coordinates,has Fobs","199607","2020-10-21","18:00:00",""
"2206801","7.2045","0.0008","9.1939","0.001","11.2326","0.0013","111.03","0.002","97.764","0.002","106.37","0.002","642.71","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","μ-2,3,5,6-tetra-2-pyridylpyrazine-κ^4^N^2^,N^6^:N^3^,N^5^- bis[dichloromercury(II)]","","- C24 H16 Cl4 Hg2 N6 -","- C24 H16 Cl4 Hg2 N6 -","- C24 H16 Cl4 Hg2 N6 -","1","0.5","TK6246","Zhang, Lei; Zhao, Xin-Hua; Zhao, Yuan","μ-2,3,5,6-Tetra-2-pyridylpyrazine-bis[dichloromercury(II)]","Acta Crystallographica Section E","2005","61","9","m1760","m1761","10.1107/S1600536805024712","","","0.71073","MoKα","","0.028","0.026","","","0.064","0.065","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206802","9.605","0.003","5.0901","0.0016","12.193","0.004","90","","101.37","0.02","90","","584.4","0.3","293","","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","3,3'-dimethyl-2-thenil","1,2-Bis(3-methyl-2-thienyl)ethane-1,2-dione","","- C12 H10 O2 S2 -","- C12 H10 O2 S2 -","- C24 H20 O4 S4 -","2","0.5","TK6247","Cantalupo, Stefanie A.; Crundwell, Guy","1,2-Bis(3-methyl-2-thienyl)ethane-1,2-dione","Acta Crystallographica Section E","2005","61","9","o3079","o3080","10.1107/S1600536805027108","","","0.71073","MoKα","","0.086","0.047","","0.087","0.052","0.052","","","","","","1.13","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206803","22.446","0.003","3.8547","0.0005","11.5504","0.0015","90","","90","","90","","999.4","0.2","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2-(2-Hydroxyphenyl)-1,3-benzoxazole","","- C13 H9 N O2 -","- C13 H9 N O2 -","- C52 H36 N4 O8 -","4","1","TK6249","Tong, Yi-Ping","2-(2-Hydroxyphenyl)-1,3-benzoxazole","Acta Crystallographica Section E","2005","61","9","o3076","o3078","10.1107/S1600536805027066","","","0.71073","MoKα","","0.079","0.059","","","0.154","0.17","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206804","8.629","0.002","9.784","0.002","9.863","0.009","90","","105.61","0.05","90","","802","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","p-Bromoaniline hydrochloride","","- C6 H7 Br Cl N -","- C6 H7 Br Cl N -","- C24 H28 Br4 Cl4 N4 -","4","1","TK6250","Gustavo Portalone","<i>p</i>-Bromoanilinium chloride","Acta Crystallographica Section E","2005","61","9","o3083","o3085","10.1107/S160053680502595X","","","0.710689","MoKα","","0.03","0.028","","","0.071","0.072","","","","","","1.1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206805","10.058","0.0007","8.8663","0.0006","21.87","0.002","90","","96.481","0.001","90","","1937.8","0.3","158","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,5-Dibromo-2,4-bis[(2-bromophenyl)ethynyl]benzene","","- C22 H10 Br4 -","- C22 H10 Br4 -","- C88 H40 Br16 -","4","1","TK6251","Westmoreland, Ian; Miyagi, Lowell; Que, Emily L.","1,5-Dibromo-2,4-bis[(2-bromophenyl)ethynyl]benzene","Acta Crystallographica Section E","2005","61","9","o2894","o2895","10.1107/S1600536805025237","","","0.7107","MoKα","","0.034","0.034","","0.042","","0.042","","","","","","1.48","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206806","10.254","0.0007","17.0933","0.0009","8.0635","0.0011","90","","92.56","0.006","90","","1411.9","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(1-Naphthylsulfonyl)-1a,2,6,6a-tetrahydro-1H,4H-1,3-dioxepino[5,6-b]azirine","","- C15 H15 N O4 S -","- C15 H15 N O4 S -","- C60 H60 N4 O16 S4 -","4","1","WK6058","Prugovečki, Biserka; Marinković, Marina; Vinković, Mladen; Dumić, Miljenko","1-(1-Naphthylsulfonyl)-1a,2,6,6a-tetrahydro-1<i>H</i>,4<i>H</i>-1,3-dioxepino[5,6-<i>b</i>]azirine","Acta Crystallographica Section E","2005","61","9","o2844","o2846","10.1107/S1600536805024931","","","0.71073","MoKα","","0.1572","0.0511","","","0.1001","0.1281","","","","","","0.952","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206807","3.4147","0.0004","6.506","0.0007","17.8263","0.0019","90","","90","","90","","396.03","0.08","296","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","cadmium zinc diborate","cadmium zinc diborate","","- B2 Cd1.171 O5 Zn0.829 -","- B2 Cd1.171 O5 Zn0.829 -","- B8 Cd4.684 O20 Zn3.316 -","4","1","WM6073","Yuan, Xin; Wang, Ru-Ji; Shen, De-Zhong; Wang, Xiao-Qing; Shen, Guang-Qiu","Cd~1.17~Zn~0.83~B~2~O~5~, a new cadmium zinc diborate","Acta Crystallographica Section E","2005","61","9","i196","i198","10.1107/S1600536805024608","","","0.71073","MoKα","","0.0319","0.0319","","","0.0793","0.0793","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206808","10.3229","0.0002","8.9307","0.0002","11.1826","0.0002","90","","106.371","0.001","90","","989.13","0.03","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Cesium gadolinium polyphosphate","","- Cs Gd O12 P4 -","- Cs Gd O12 P4 -","- Cs4 Gd4 O48 P16 -","4","1","WM6085","Naïli, Houcine; Mhiri, Tahar","Caesium gadolinium polyphosphate, CsGd(PO~3~)~4~","Acta Crystallographica Section E","2005","61","9","i204","i207","10.1107/S1600536805025705","","","0.71073","MoKα","","0.0183","0.0176","","","0.0455","0.0458","","","","","","1.239","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206809","8.725","0.002","7.932","0.001","11.969","0.004","90","","99.53","0.02","90","","816.9","0.3","295","","295","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","Dirubidium diiodoaurate(I) tetraiodoaurate(III)","","- Au2 I6 Rb2 -","- Au2 I6 Rb2 -","- Au4 I12 Rb4 -","2","0.25","WM6086","Matsushita, Nobuyuki; Tanaka, Atsushi; Kojima, Norimichi","A three-dimensional iodo-bridged mixed-valence gold(I,III) compound, Rb~2~[Au^I^I~2~][Au^III^I~4~]","Acta Crystallographica Section E","2005","61","9","i201","i203","10.1107/S1600536805025432","","","0.71069","MoKα","","","0.0661","","","","0.0971","","","","","","1.7201","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206810","13.1554","0.001","7.452","0.0004","17.9508","0.001","90","","90","","90","","1759.79","0.19","180","2","180","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","tetrapotassium niobium tantalum undecasulfide","","- K4 Nb1.04 S11 Ta0.96 -","- K4 Nb1.042 S11 Ta0.958 -","- K16 Nb4.168 S44 Ta3.832 -","4","1","WM6087","Yuandong Wu; Christian Näther; Wolfgang Bensch","K~4~Nb~0.96~Ta~1.04~S~11~","Acta Crystallographica Section E","2005","61","9","i208","i210","10.1107/S1600536805026930","","","0.71073","MoKα","","0.0215","0.0212","","","0.0562","0.0565","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206811","3.9585","0.001","6.9894","0.0017","23.15","0.006","90","","90.416","0.004","90","","640.5","0.3","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(4-chlorobenzylidene)hydrazine","","- C14 H10 Cl2 N2 -","- C14 H10 Cl2 N2 -","- C28 H20 Cl4 N4 -","2","0.5","WN6370","Zheng, Peng-Wu; Wang, Wei; Duan, Xue-Min","<i>N</i>,<i>N</i>'-Bis(4-chlorobenzylidene)hydrazine","Acta Crystallographica Section E","2005","61","9","o3020","o3021","10.1107/S1600536805026279","","","0.71073","MoKα","","0.0596","0.0388","","","0.0898","0.1014","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206812","11.8828","0.0009","6.7072","0.0005","21.1191","0.0016","90","","92.084","0.001","90","","1682.1","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(2-furyl)methyleneamino]- 1H-pyrazole-3-carbonitrile","","- C16 H7 Cl2 F3 N4 O -","- C16 H7 Cl2 F3 N4 O -","- C64 H28 Cl8 F12 N16 O4 -","4","1","WW6369","Zhong, Ping; Yang, Zhiping; Shi, Qian; Hu, Maolin; Li, Shuyan; Tang, Riyuan","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(2-furyl)methyleneamino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","9","o2972","o2973","10.1107/S1600536805025699","","","0.71073","MoKα","","0.0768","0.0688","","","0.1953","0.2039","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206813","3.825","0.0008","6.241","0.0012","18.988","0.004","90","","95.25","0.03","90","","451.38","0.16","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","para-fluorobenzalhydantoin","5-(4-Fluorobenzylidene)imidazolidine-2,4-dione","","- C10 H7 F N2 O2 -","- C10 H7 F N2 O2 -","- C20 H14 F2 N4 O4 -","2","1","WW6390","Jia, Hong-Hua; Ni, Fang; Wang, Jun; Wei, Ping; Ouyang, Ping-Kai","5-(4-Fluorobenzylidene)imidazolidine-2,4-dione","Acta Crystallographica Section E","2005","61","9","o2784","o2786","10.1107/S1600536805024104","","","0.71073","MoKα","","0.057","0.0397","","","0.102","0.114","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206814","32.134","0.005","10.8983","0.0015","22.339","0.003","90","","132.932","0.002","90","","5727.9","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-Ethyl 5-methyl 4-(2-chlorophenyl)-6-methyl-2-[(2-phthalimidoethoxy)methyl]- 1,4-dihydropyridine-3,5-dicarboxylate diethyl ether hemisolvate","","- C30 H32 Cl N2 O7.5 -","- C30 H32 Cl N2 O7.5 -","- C240 H256 Cl8 N16 O60 -","8","1","WW6395","Liu, He-Chao; Feng, Ya-Qing","3-Ethyl 5-methyl 4-(2-chlorophenyl)-6-methyl-2-[(2-phthalimidoethoxy)methyl]-1,4-dihydropyridine-3,5-dicarboxylate diethyl ether hemisolvate","Acta Crystallographica Section E","2005","61","9","o3006","o3007","10.1107/S1600536805023950","","","0.71073","MoKα","","0.1188","0.0471","","","","0.1377","","","","","","0.992","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206815","15.822","0.004","15.822","0.004","12.844","0.004","90","","90","","90","","3215.3","1.5","294","2","294","2","","","","","","","","4","P 43","P 4cw","78","","N,N-bis(3,5-di-tert-butyl-4-hydroxybenzyl)-N-propylamine","","- C33 H53 N O2 -","- C33 H53 N O2 -","- C132 H212 N4 O8 -","4","1","WW6399","Zeng, Tao; Shu, Xue-Gui; Dong, Chuan-Ming; Chen, Li-Gong","<i>N</i>,<i>N</i>-Bis(3,5-di-<i>tert</i>-butyl-4-hydroxybenzyl)-<i>N</i>-propylamine","Acta Crystallographica Section E","2005","61","9","o2999","o3000","10.1107/S1600536805025961","","","0.71073","MoKα","","0.1384","0.0535","","","0.1222","0.1644","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206816","12.06","0.002","18.511","0.004","8.936","0.0018","90","","102.99","0.03","90","","1943.8","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-amino-4-(4-methoxyphenyl)-4H-benzo[h]chromene-3-carboxylate","","- C23 H21 N O4 -","- C23 H21 N O4 -","- C92 H84 N4 O16 -","4","1","WW6411","Guo, Cheng; Gu, Xi-feng","Ethyl 2-amino-4-(4-methoxyphenyl)-4<i>H</i>-benzo[<i>h</i>]chromene-3-carboxylate","Acta Crystallographica Section E","2005","61","9","o3101","o3103","10.1107/S1600536805025006","","","0.71073","MoKα","","0.1261","0.0554","","","0.148","0.1838","","","","","","0.985","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206817","6.996","0.0014","10.542","0.002","13.522","0.003","101.45","0.03","96.33","0.03","96.82","0.03","961.3","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-amino-4-(2-methoxyphenyl)-4H-benzo[h]chromene-3-carboxylate","","- C23 H21 N O4 -","- C23 H21 N O4 -","- C46 H42 N2 O8 -","2","1","WW6412","Guo, Cheng; Gu, Xi-Feng","Ethyl 2-amino-4-(2-methoxyphenyl)-4<i>H</i>-benzo[<i>h</i>]chromene-3-carboxylate","Acta Crystallographica Section E","2005","61","9","o3104","o3105","10.1107/S1600536805025018","","","0.71073","MoKα","","0.0997","0.0566","","","0.1574","0.1874","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206818","14.235","0.004","6.901","0.002","8.538","0.003","90","","118.12","0.01","90","","739.7","0.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Tetraaquabis(pyridine-3-carboxylato-κN)iron(II)","","- C12 H16 Fe N2 O8 -","- C12 H16 Fe N2 O8 -","- C24 H32 Fe2 N4 O16 -","2","0.25","WW6414","Liang, Yong; Li, Wei; Guo, Bao-Jing","Tetraaquabis(pyridine-3-carboxylato-κ<i>N</i>)iron(II)","Acta Crystallographica Section E","2005","61","9","m1782","m1784","10.1107/S1600536805025420","","","0.71073","MoKα","","0.0602","0.0519","","","0.1337","0.1389","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206819","8.3","0.002","12.698","0.003","14.428","0.004","103.836","0.017","103.21","0.02","105.087","0.019","1355.3","0.7","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","Diethyl 4,8-dioxo-2,6-di-p-chlorophenyl-1,3,5,7-tetrahydro-2,3a,4a,6,7a,8a- hexaazacyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C26 H26 Cl2 N6 O6 -","- C26 H26 Cl2 N6 O6 -","- C52 H52 Cl4 N12 O12 -","2","1","WW6416","Yin, Guo-Dong; Zhou, Bao-Han; Wu, An-Xin","Diethyl 4,8-dioxo-2,6-di-<i>p</i>-chlorophenyl-1,3,5,7-tetrahydro-2,3a,4a,6,7a,8a-hexaazacyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2005","61","9","o2787","o2788","10.1107/S1600536805024116","","","0.71073","MoKα","","0.0542","0.0414","","","0.1059","0.1125","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206820","14.177","0.005","12.967","0.004","18.885","0.006","90","","106.237","0.005","90","","3333.2","1.9","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","catena-Poly[[aqua(cis-syn-cis-dicyclohexyl-18-crown-6)lead(II)]-μ- thiocyanato-κ^2^N:S-[dithiocyanatopallalium(II)]-μ-thiocyanato-κ^2^S:N]","","- C24 H38 N4 O7 Pb Pd S4 -","- C24 H38 N4 O7 Pb Pd S4 -","- C96 H152 N16 O28 Pb4 Pd4 S16 -","4","1","XU6031","Yun-Ming Sun; Feng-Ying Dong; Jian-Min Dou; Xi-Ke Gao; Da-Cheng Li; Da-Qi Wang","<i>catena</i>-Poly[[aqua(<i>cis</i>-<i>syn</i>-<i>cis</i>-dicyclohexyl-18-crown-6)lead(II)]-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>-[dithiocyanatopalladium(II)]-μ-thiocyanato-κ^2^<i>S</i>:<i>N</i>]","Acta Crystallographica Section E","2005","61","9","m1787","m1788","10.1107/S1600536805025407","","","0.71073","MoKα","","0.064","0.033","","","0.043","0.046","","","","","","0.946","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206821","3.61","0.0011","14.11","0.004","10.915","0.003","90","","97.06","0.004","90","","551.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","poly[copper(II)-μ~6~-benzene-1,3,5-tricarboxylato-tri-μ~3~-hydroxo]","","- C9 H6 Cu3 O9 -","- C9 H6 Cu3 O9 -","- C18 H12 Cu6 O18 -","2","0.5","XU6033","Wei, Wen-Ying; Han, Jin-Yu","A polymeric copper(II) complex bridged by benzene-1,3,5-tricarboxylate","Acta Crystallographica Section E","2005","61","9","m1792","m1793","10.1107/S1600536805025687","","","0.71073","MoKα","","0.028","0.023","","","0.062","0.065","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206822","18.27","0.006","11.8","0.004","21.927","0.008","90","","110.648","0.008","90","","4424","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene]potassium(I) bis(2-thioxo-4,5-dihydro-1,3-dithiole-4,5-dithiolato)nickel(III)","","- C34 H40 K Ni O10 S10 -","- C34 H40 K Ni O10 S10 -","- C136 H160 K4 Ni4 O40 S40 -","4","1","XU6034","Jun-Hong Zhang; Da-Qi Wang; Jian-Min Dou","Bis[2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene]potassium(I) bis(2-thioxo-4,5-dihydro-1,3-dithiole-4,5-dithiolato)nickel(III)","Acta Crystallographica Section E","2005","61","9","m1699","m1700","10.1107/S160053680502430X","","","0.71073","MoKα","","0.141","0.047","","","0.049","0.057","","","","","","0.854","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206823","10.029","0.002","7.486","0.0015","15.608","0.003","90","","100.26","0.03","90","","1153.1","0.4","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","(S)-3-[(1-Ethoxycarbonyl-2-phenylethyl)amino]-1-ferrocenylbut-2-en-1-one","(S)-ethyl 2-[1-(1-ferrocenylcarbonyl)prop-1-en-2-ylamino]-3-phenylpropionate","","- C25 H27 Fe N O3 -","- C25 H27 Fe N O3 -","- C50 H54 Fe2 N2 O6 -","2","1","XU6035","Yao-Cheng Shi; Chun-Xia Sui; Jin-Juan Wu","(<i>S</i>)-3-[(1-Ethoxycarbonyl-2-phenylethyl)amino]-1-ferrocenylbut-2-en-1-one","Acta Crystallographica Section E","2005","61","9","m1878","m1879","10.1107/S1600536805026978","","","0.71073","MoKα","","0.074","0.044","","","0.109","0.121","","","","","","1.044","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206824","13.032","0.004","13.032","0.004","17.558","0.007","90","","90","","120","","2582.4","1.5","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","Hexakis(μ~2~-4-amino-4H-1,2,4-triazole)hexachlorotricadmium(II)","","- C12 H24 Cd3 Cl6 N24 -","- C12 H24 Cd3 Cl6 N24 -","- C36 H72 Cd9 Cl18 N72 -","3","0.166667","XU6036","Xuan-Wen, Liu","Hexakis(μ~2~-4-amino-4<i>H</i>-1,2,4-triazole)hexachlorotricadmium(II)","Acta Crystallographica Section E","2005","61","9","m1777","m1778","10.1107/S1600536805025468","","","0.71073","MoKα","","0.038","0.032","","","0.086","0.09","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206825","19.369","0.003","15.515","0.002","17.246","0.003","90","","93.72","0.01","90","","5171.7","1.4","295","2","295","3","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[5-bromo-1H-indole-3-carbaldehyde (2-nitrobenzoyl)hydrazonato- κ^2^N,O]bis(pyridine-κN)nickel(II) pyridine disolvate","","- C52 H40 Br2 N12 Ni O6 -","- C52 H40 Br2 N12 Ni O6 -","- C208 H160 Br8 N48 Ni4 O24 -","4","0.5","XU6037","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng","Bis[5-bromo-1<i>H</i>-indole-3-carbaldehyde (2-nitrobenzoyl)hydrazonato-κ^2^<i>N</i>,<i>O</i>]bis(pyridine-κ<i>N</i>)nickel(II) pyridine disolvate","Acta Crystallographica Section E","2005","61","9","m1682","m1683","10.1107/S1600536805024062","","","0.71073","MoKα","","0.059","0.038","","","0.101","0.111","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206826","22.4629","0.0005","10.5743","0.0002","7.86","0.0002","90","","106.565","0.0009","90","","1789.5","0.07","296","1","296","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Diaquabis(vanillinato-κ^2^O,O')manganese(II)","","- C16 H18 Mn O8 -","- C16 H18 Mn O8 -","- C64 H72 Mn4 O32 -","4","0.5","XU6038","Jian Gao; Yu Liu","Diaquabis(vanillinato-κ^2^<i>O</i>,<i>O</i>')manganese(II)","Acta Crystallographica Section E","2005","61","9","m1692","m1693","10.1107/S1600536805024293","","","0.71073","MoKα","","0.036","0.028","","","0.077","0.1","","","","","","1.192","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206827","7.7562","0.0005","14.1641","0.0008","9.6837","0.0006","90","","102.743","0.001","90","","1037.64","0.11","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[μ-2-(semicarbazonomethyl)phenolato]- 1κ^3^O^3^,N^1^,O:2κO;1κO:2κ^3^O^3^,N^1^,O-bis[(formato-κO)copper(II)]","","- C18 H18 Cu2 N6 O8 -","- C18 H18 Cu2 N6 O8 -","- C36 H36 Cu4 N12 O16 -","2","0.5","XU6043","Gerasimenko, Andrey V.; Davidovich, Ruven L.; Bulimestru, Ion G.; Gulea, Aurelian P.; Ng, Seik Weng","Bis(μ-salicylaldehyde semicarbazonato)bis[formatocopper(II)]","Acta Crystallographica Section E","2005","61","9","m1816","m1817","10.1107/S1600536805025845","","","0.71073","MoKα","","0.043","0.033","","","0.085","0.09","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206828","7.6369","0.0004","8.519","0.0004","18.2777","0.0009","84.952","0.001","84.505","0.001","65.275","0.001","1073.64","0.09","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","5,7-dimethyl-1,2,4-triazolo[1,5-a]pyrimidinium tetrachlorocobaltate(II) monohydrate","","- C14 H20 Cl4 Co N8 O -","- C14 H20 Cl4 Co N8 O -","- C28 H40 Cl8 Co2 N16 O2 -","2","1","YA6255","Maldonado, Carmen R.; Quirós, Miguel; Salas, Juan M.; Sánchez, M. Purificación","5,7-Dimethyl-1,2,4-triazolo[1,5-a]pyrimidinium tetrachlorocobaltate(II) monohydrate","Acta Crystallographica, Section E: Structure Reports Online","2005","61","9","m1721","m1723","10.1107/S1600536805024633","","","0.71073","MoKα","","0.037","0.031","","","0.077","0.08","","","","","","1.04","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2206830","6.885","0.002","6.969","0.002","27.348","0.009","90","","90","","90","","1312.2","0.7","289","2","289","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","10α-Hydroxy-1-oxoeremophila-7(11),8(9)-dien-12,8-olide","","- C15 H18 O4 -","- C15 H18 O4 -","- C60 H72 O16 -","4","1","AC6170","Wu, Quan-Xiang; Shi, Yan-Ping; Shi, Yan-Ping","10α-Hydroxy-1-oxoeremophila-7(11),8(9)-dien-12,8-olide","Acta Crystallographica Section E","2005","61","10","o3502","o3504","10.1107/S1600536805030795","","","0.71073","MoKα","","0.0596","0.0392","","","0.0791","0.0842","","","","","","0.905","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206831","12.7084","0.001","8.0446","0.0009","20.2971","0.0016","90","","119.05","0.005","90","","1814","0.3","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[2-Methyl-4-(4-methylphenyldiazenyl)phenoxy]phtalonitrile","","- C22 H16 N4 O -","- C22 H16 N4 O -","- C88 H64 N16 O4 -","4","1","AC6181","Deveci, Özlem; Işık, Şamil; Albayrak, Çiǧdem; Ağar, Erbil","4-[2-Methyl-4-(4-methylphenyldiazenyl)phenoxy]phthalonitrile","Acta Crystallographica Section E","2005","61","10","o3327","o3329","10.1107/S1600536805029053","","","0.71073","MoKα","","0.117","0.053","","","0.137","0.1565","","","","","","0.91","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206832","7.5746","0.0011","9.3984","0.0013","7.9482","0.0011","90","","117.139","0.002","90","","503.53","0.12","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-methylimidazolidin-2-one","","- C4 H8 N2 O -","- C4 H8 N2 O -","- C16 H32 N8 O4 -","4","1","AC6191","Caudle, M. Tyler; Tassone, Erica; Groy, Thomas L.","Anhydrous 1-methylimidazolidin-2-one","Acta Crystallographica Section E","2005","61","10","o3269","o3270","10.1107/S1600536805028023","","","0.71073","MoKα","","0.0913","0.0702","","","0.1483","0.1605","","","","","","1.161","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206833","16.8478","0.0006","7.7746","0.0003","13.0702","0.0005","90","","109.816","0.001","90","","1610.62","0.11","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Pd (N O3)2 (2 H8 N2)]","(Ethane-1,2-diamine)dinitratopalladium(II)","","- C2 H8 N4 O6 Pd -","- C2 H8 N4 O6 Pd -","- C16 H64 N32 O48 Pd8 -","8","2","AC6192","Bray, David J.; Clegg, Jack K.; Liao, Li-Ling; Lindoy, Leonard F.; McMurtrie, John C.; Schilter, David; Wei, Gang; Won, Tai-Jin","(Ethane-1,2-diamine)dinitratopalladium(II)","Acta Crystallographica Section E","2005","61","10","m1940","m1942","10.1107/S1600536805027224","","","0.71073","MoKα","","0.0183","0.0162","","","0.0419","0.0431","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206834","10.6918","0.0011","7.1329","0.0007","22.794","0.002","90","","102.538","0.002","90","","1696.9","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^N,N')(thiodiacetato- κ^3^O,S,O')cobalt(II) dihydrate","","- C10 H16 Co N4 O7 S3 -","- C10 H16 Co N4 O7 S3 -","- C40 H64 Co4 N16 O28 S12 -","4","1","AC6195","Bing-Xin Liu; Jian-Yong Yu; Duan-Jun Xu","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')(thiodiacetato-κ^3^<i>O</i>,<i>S</i>,<i>O</i>')cobalt(II) dihydrate","Acta Crystallographica Section E","2005","61","10","m1978","m1980","10.1107/S1600536805028059","","","0.71073","MoKα","","0.052","0.042","","","0.097","0.102","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206835","10.766","0.002","11.648","0.002","11.813","0.002","69.89","0.03","74.07","0.03","75.84","0.03","1319","0.5","173","2","","","","","","","","","","4","P -1","-P 1","2","Tetranitrodibenzo-18-crown-6","2,3,11,12-[4',4'',5',5''-Tetranitro]dibenzo- 1,4,7,10,13,16-hexaoxacyclooctadeca-2,11-diene","","- C22 H25 N5 O15 -","- C22 H25 N5 O15 -","- C44 H50 N10 O30 -","2","1","AC6196","Belousoff, Matthew J.; Langford, Steven J.; Latter, Melissa J.; Lau, Vei L.","4',4'',5',5''-Tetranitro-2,3:11,12-dibenzo- 1,4,7,10,13,16-hexaoxacyclooctadeca-2,11-diene acetonitrile solvate monohydrate","Acta Crystallographica Section E","2005","61","10","o3283","o3284","10.1107/S1600536805028564","","","0.71073","MoKα","","","0.0499","","","","0.1185","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206836","9.924","0.002","11.936","0.003","14.89","0.004","90","","104.003","0.004","90","","1711.3","0.7","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N'-[(E)-4-(2-Hydroxyethoxy)-3-methoxybenzylidene]benzohydrazide monohydrate","","- C17 H20 N2 O5 -","- C17 H20 N2 O5 -","- C68 H80 N8 O20 -","4","1","AC6197","Chun-Hua Diao; Ming Yu; Xin Chen; Zuo-Liang Jing; Qi-Liang Deng","<i>N</i>'-[(<i>E</i>)-4-(2-Hydroxyethoxy)-3-methoxybenzylidene]benzohydrazide monohydrate","Acta Crystallographica Section E","2005","61","10","o3500","o3501","10.1107/S1600536805030655","","","0.71073","MoKα","","0.0893","0.0443","","","0.1048","0.1293","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206837","6.414","0.0013","10.643","0.002","13.308","0.003","108.59","0.03","96.11","0.03","96.95","0.03","844.5","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4-(4-methoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile","","- C21 H16 N2 O2 -","- C21 H16 N2 O2 -","- C42 H32 N4 O4 -","2","1","AC6199","Gu, Xi-Feng; Guo, Cheng; Zhang, Dong-Mei; Tang, Qing-Gang","2-Amino-4-(4-methoxyphenyl)-4<i>H</i>-benzo[<i>h</i>]chromene-3-carbonitrile","Acta Crystallographica Section E","2005","61","10","o3419","o3420","10.1107/S160053680502982X","","","0.71073","MoKα","","0.0927","0.0508","","","0.1568","0.2016","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206838","5.8095","0.0001","24.292","0.0004","8.5473","0.0002","90","","99.2211","0.0008","90","","1190.64","0.04","90","0.2","90","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-2-(3-Nitrobenzylidene)-1-azabicyclo[2.2.2]octan-3-one","","- C14 H14 N2 O3 -","- C14 H14 N2 O3 -","- C56 H56 N8 O12 -","4","1","AC6200","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>Z</i>)-2-(3-Nitrobenzylidene)-1-azabicyclo[2.2.2]octan-3-one","Acta Crystallographica Section E","2005","61","10","o3254","o3256","10.1107/S1600536805028576","","","0.71073","MoKα","","0.0483","0.0373","","","0.0919","0.0985","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206839","19.3783","0.0004","10.568","0.0006","7.3257","0.0003","90","","90","","90","","1500.23","0.11","90","0.2","90","0.2","","","","","","","","5","C m c 21","C 2c -2","36","","(2E,4E)-8-Methyl-2,4-bis-thiophen-3-ylmethylene-8-azabicyclo[3.2.1]octan-3-one","","- C18 H17 N O S2 -","- C18 H17 N O S2 -","- C72 H68 N4 O4 S8 -","4","0.5","AC6202","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(2<i>E</i>,4<i>E</i>)-8-Methyl-2,4-bis(3-thienylmethylene)-8-azabicyclo[3.2.1]octan-3-one","Acta Crystallographica Section E","2005","61","10","o3445","o3446","10.1107/S160053680503028X","","","0.71073","MoKα","","0.0363","0.0313","","","0.0709","0.0738","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206840","5.0205","0.0011","13.081","0.003","17.598","0.004","90","","97.085","0.004","90","","1146.9","0.4","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-acetyl-4-methyl-2-(2-fluorophenylamino)-1,3-thiazole","","- C12 H11 F N2 O S -","- C12 H11 F N2 O S -","- C48 H44 F4 N8 O4 S4 -","4","1","AC6203","Kasim, Noor Azilah M.; Akbari, Aulia; Yamin, Bohari M.","5-Acetyl-4-methyl-2-(2-fluorophenylamino)-1,3-thiazole","Acta Crystallographica Section E","2005","61","10","o3490","o3491","10.1107/S1600536805030278","","","0.71073","MoKα","","0.059","0.053","","","0.129","0.133","","","","","","1.19","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206841","8.0043","0.001","9.5866","0.0013","14.6977","0.0019","90","","96.778","0.002","90","","1119.9","0.3","292","2","292","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2RS,3SR)-Diethyl 2,3-bis(1,3-benzodioxole-5-carbonyl)succinate","","- C24 H22 O10 -","- C24 H22 O10 -","- C48 H44 O20 -","2","0.5","AT6029","Hu, Shengli; She, Neng-Fang; Wu, An-Xin","(2<i>RS</i>,3<i>SR</i>)-Diethyl 2,3-bis(1,3-benzodioxole-5-carbonyl)succinate","Acta Crystallographica Section E","2005","61","10","o3317","o3318","10.1107/S1600536805029144","","","0.71073","MoKα","","0.109","0.06","","","0.15","0.177","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206842","8.3764","0.0003","5.9861","0.0002","10.469","0.0004","90","","110.034","0.0012","90","","493.17","0.03","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","3,5-O-Isopropylidene-2-C-methyl-D-xylonolactone","","- C9 H14 O5 -","- C9 H14 O5 -","- C18 H28 O10 -","2","1","AT6030","David J. Watkin; Loren L. Parry; David J. Hotchkiss; Vanessa Eastwick-Field; George W. J. Fleet","3,5-<i>O</i>-Isopropylidene-2-<i>C</i>-methyl-<small>D</small>-xylonolactone","Acta Crystallographica Section E","2005","61","10","o3302","o3303","10.1107/S1600536805028837","","","0.71073","MoKα","","0.0442","0.0442","","0.0744","0.0744","0.0744","","","","","","0.9378","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206843","5.3676","0.0009","11.4763","0.0019","12.447","0.002","92.505","0.003","91.692","0.003","94.138","0.003","763.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-(4-Methoxybenzoyl)-N'-(4-methylphenyl)thiourea","","- C16 H16 N2 O2 S -","- C16 H16 N2 O2 S -","- C32 H32 N4 O4 S2 -","2","1","AT6031","Yusof, M. Sukeri M.; Sahali, A. Mardi; Bohari M. Yamin","<i>N</i>-(4-Methoxybenzoyl)-<i>N</i>'-(4-methylphenyl)thiourea","Acta Crystallographica Section E","2005","61","10","o3357","o3358","10.1107/S1600536805029478","","","0.71073","MoKα","","0.046","0.04","","","0.11","0.114","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206844","17.0925","0.0016","10.6353","0.0006","10.6634","0.0009","90","","99.263","0.007","90","","1913.2","0.3","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-2-[1,3-Dihydroxy-2-(hydroxymethyl)propan-2-ylaminomethylene]-4-[(4- ethylphenyl)diazenyl]-6-methoxycyclohexanone","","- C20 H25 N3 O5 -","- C20 H25 N3 O5 -","- C80 H100 N12 O20 -","4","1","AT6032","Şahin, Onur; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-2-[1,3-Dihydroxy-2-(hydroxymethyl)propan-2-ylaminomethylene]-4-[(4-ethylphenyl)diazenyl]-6-methoxycyclohexanone","Acta Crystallographica Section E","2005","61","10","o3508","o3510","10.1107/S1600536805030916","","","0.71073","MoKα","","0.0854","0.0584","","","0.1595","0.1741","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206845","9.3415","0.0012","10.0584","0.0012","19.976","0.003","90","","92.262","0.002","90","","1875.5","0.4","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-methoxyphenoxy)-3-phenyl-3H-benzo[4,5]furo[3,2-d]pyrimidin-4-one","","- C23 H16 N2 O4 -","- C23 H16 N2 O4 -","- C92 H64 N8 O16 -","4","1","BD6008","Yang-Gen Hu; Gui-Hua Li; Jia-Hua Tian; Ming-Wu Ding; Hong-Wu He","3-(4-Methoxyphenoxy)-2-phenyl-3<i>H</i>-1-benzofuro[3,2-<i>d</i>]pyrimidin-1-one","Acta Crystallographica Section E","2005","61","10","o3266","o3268","10.1107/S1600536805028734","","","0.71073","MoKα","","0.0884","0.0513","","","0.1003","0.1154","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206846","27.92","0.006","7.5547","0.0015","16.712","0.003","90","","105.753","0.004","90","","3392.6","1.2","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-[(2-Hydroxy-3-methoxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1H- pyrazol-3(2H)-one","","- C19 H19 N3 O3 -","- C19 H19 N3 O3 -","- C152 H152 N24 O24 -","8","1","BH6019","Diao, Chun-Hua; Fan, Zhi; Yu, Ming; Chen, Xin; Jing, Zuo-Liang; Deng, Qi-Liang","4-[(2-Hydroxy-3-methoxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","10","o3271","o3272","10.1107/S1600536805027340","","","0.71073","MoKα","","0.0961","0.0466","","","0.1058","0.1278","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206847","7.8338","0.0015","15.095","0.003","13.962","0.003","90","","105.436","0.005","90","","1591.5","0.6","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-methyl-5-oxo-4-p-tolyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","","- C19 H21 N O3 -","- C19 H21 N O3 -","- C76 H84 N4 O12 -","4","1","BH6021","Yu, Chen-Xia; Shi, Da-Qing; Yao, Chang-Sheng; Wang, Xiang-Shan; Zhuang, Qi-Ya","Methyl 2-methyl-5-oxo-4-<i>p</i>-tolyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","Acta Crystallographica Section E","2005","61","10","o3224","o3225","10.1107/S1600536805027352","","","0.7107","MoKα","","0.0491","0.0456","","","0.1209","0.1239","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206848","8.8442","0.0009","10.4591","0.0009","13.319","0.001","110.718","0.004","90.895","0.002","105.595","0.002","1101.53","0.17","253","1","","","","","","","","","","7","P -1","-P 1","2","","N-[4-Cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenylsulfanyl)-2-hydroxy- 2-methylpropionamide chloroform solvate","","- C19 H15 Cl3 F4 N2 O2 S -","- C19 H15 Cl3 F4 N2 O2 S -","- C38 H30 Cl6 F8 N4 O4 S2 -","2","1","BH6024","Tang, Gu-Ping; Gu, Jian-Ming","<i>N</i>-[4-Cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenylsulfanyl)-2-hydroxy-2-methylpropionamide chloroform solvate","Acta Crystallographica Section E","2005","61","10","o3184","o3186","10.1107/S1600536805027650","","","0.7107","MoKα","","","0.047","","","","0.089","","","","","","0.959","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206849","7.291","0.0009","7.481","0.0009","9.007","0.0013","104.444","0.002","96.971","0.002","102.618","0.002","456.15","0.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[bis(4-chloromethylpyridine-κN)cobalt(II)]-di-μ- dicyanamido-κN^1^:κN^5^]","","- C16 H12 Cl2 Co N8 -","- C16 H12 Cl2 Co N8 -","- C16 H12 Cl2 Co N8 -","1","0.5","BH6025","Pei, Hong-Xia; Sun, Yu-Xi; Lu, She-Ming; Li, Jian-Min; Wu, Xin-Tao; Du, Wen-Xin","<i>catena</i>-Poly[[bis(4-chloromethylpyridine-κ<i>N</i>)cobalt(II)]-di-μ-dicyanamido-κ^2^<i>N</i>^1^:κ^2^<i>N</i>^5^]","Acta Crystallographica Section E","2005","61","10","m2109","m2111","10.1107/S1600536805027662","","","0.71073","MoKα","","0.0877","0.0683","","","0.1434","0.1599","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206850","10.006","0.0008","22.6236","0.0018","15.8991","0.0013","90","","95.512","0.001","90","","3582.5","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2-Hydroxy-3,5-dinitrobenzoato)tris(2-methyl-2-phenylpropyl)tin(IV)","","- C37 H42 N2 O7 Sn -","- C37 H42 N2 O7 Sn -","- C148 H168 N8 O28 Sn4 -","4","1","BH6026","Tian, Lai-Jin; Yu, Hai-Xia; Sun, Yu-Xi; Zhang, Bo","(2-Hydroxy-3,5-dinitrobenzoato)tris(2-methyl-2-phenylpropyl)tin(IV)","Acta Crystallographica Section E","2005","61","10","m2029","m2030","10.1107/S1600536805028904","","","0.71073","MoKα","","0.0617","0.051","","","0.1051","0.1098","","","","","","1.182","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206851","6.914","0.002","7.822","0.002","8.211","0.002","95","0.02","113.74","0.02","99.79","0.02","394.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis(acetato)diaquadioxouranium(VI) acetic acid disolvate","","- C8 H18 O12 U -","- C8 H18 O12 U -","- C8 H18 O12 U -","1","0.5","BH6027","Grigoriev, Mikhail S.; Antipin, Mikhail Yu.; Krot, Nikolai N.","Diacetatodiaquadioxouranium(VI) acetic acid disolvate","Acta Crystallographica Section E","2005","61","10","m2078","m2079","10.1107/S1600536805029922","","","0.71073","MoKα","","0.0218","0.0218","","","0.051","0.051","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206852","6.9785","0.0005","18.7982","0.0013","10.0764","0.0007","90","","107.367","0.001","90","","1261.59","0.15","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4,5,5-Tetramethyl-2-thiazol-2-ylimidazolidine-1,3-diol","","- C10 H17 N3 O2 S -","- C10 H17 N3 O2 S -","- C40 H68 N12 O8 S4 -","4","1","BH6030","Jiang, Kai; Chang, Jiu-Li; Wang, Li-Ya; Ma, Lu-Fang; Wang, Yu-Fang","4,4,5,5-Tetramethyl-2-(thiazol-2-yl)imidazolidine-1,3-diol","Acta Crystallographica Section E","2005","61","10","o3430","o3432","10.1107/S1600536805029910","","","0.71073","MoKα","","0.0636","0.0525","","","0.1387","0.1483","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206853","8.8517","0.0007","9.0145","0.0007","13.5956","0.001","90","","101.698","0.002","90","","1062.31","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Formyl thymol oxime","","- C11 H15 N O2 -","- C11 H15 N O2 -","- C44 H60 N4 O8 -","4","1","BH6031","Butcher, Ray J.; Bendre, Ratnamala S.; Kuwar, Anil S.","2-Formylthymol oxime","Acta Crystallographica Section E","2005","61","10","o3511","o3513","10.1107/S1600536805029934","","","0.71073","MoKα","","0.0641","0.0455","","","0.1271","0.1371","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206854","12.6956","0.0009","5.1295","0.0004","13.9659","0.001","90","","98.452","0.001","90","","899.61","0.11","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis(uracil-1-acetato)cadmium(II)","","- C12 H18 Cd N4 O12 -","- C12 H18 Cd N4 O12 -","- C24 H36 Cd2 N8 O24 -","2","0.5","BH6032","Miao, Qian; Mao-Lin Hu","Tetraaquabis(uracil-1-acetato)cadmium(II)","Acta Crystallographica Section E","2005","61","10","m2083","m2085","10.1107/S1600536805029946","","","0.71073","MoKα","","0.0238","0.0223","","","0.0529","0.0537","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206855","7.1969","0.0012","7.8499","0.0013","35.797","0.006","90","","90","","90","","2022.3","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4'-Isobutoxy-biphenyl-4-carboxylic acid 4-cyano-3-fluoro-phenyl ester","","- C24 H20 F N O3 -","- C24 H20 F N O3 -","- C96 H80 F4 N4 O12 -","4","1","BH6035","Ren, Rui; Li, Qiang; Zhang, Shu-Sheng; Li, Xue-Mei","4-Cyano-3-fluorophenyl 4'-isobutoxybiphenyl-4-carboxylate","Acta Crystallographica Section E","2005","61","10","o3472","o3473","10.1107/S1600536805030138","","","0.71073","MoKα","","0.042","0.0377","","","0.094","0.0972","","","","","","1.139","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206856","27.886","0.003","8.0475","0.0009","16.671","0.002","90","","116.149","0.002","90","","3358.3","0.7","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-butyl-4-butylaminonaphthalimide","","- C20 H24 N2 O2 -","- C20 H24 N2 O2 -","- C160 H192 N16 O16 -","8","1","BH6036","Banthia, Sandip; Paul, Aniruddha","<i>N</i>-Butyl-4-butylamino-1,8-naphthalimide","Acta Crystallographica Section E","2005","61","10","o3474","o3475","10.1107/S160053680503014X","","","0.71073","MoKα","","0.0552","0.0476","","","0.1207","0.1261","","","","","","1.051","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206857","10.8815","0.0004","11.0081","0.0005","11.7412","0.0007","69.229","0.002","77.892","0.004","68.091","0.002","1215.16","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Hexa-μ-α-methylacrylato-bis[(1,10-phenanthroline)lanthanum(III)] monohydrate","","- C48 H50 La2 N4 O14 -","- C48 H50 La2 N4 O14 -","- C48 H50 La2 N4 O14 -","1","0.5","BR6212","Yue Zhu; Wei-Min Lu; Meng Ma; Fang Chen","Hexa-μ-α-methylacrylato-bis[(1,10-phenanthroline)lanthanum(III)] dihydrate","Acta Crystallographica Section E","2005","61","10","m2044","m2046","10.1107/S1600536805028928","","","0.71073","MoKα","","0.0412","0.0354","","","0.0965","0.1117","","","","","","1.235","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206858","11.7885","0.0013","11.6149","0.0013","25.301","0.003","90","","94.903","0.002","90","","3451.6","0.7","298","2","571","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-3-nitrobenzoato)-1:2κ^2^O:O';3:4κ^2^O:O'-bis(3-nitrobenzoato)- 1κ^2^O,O';3κ^2^O,O'-di-μ~3~-oxo-1:2:4κ^3^O;2:3:4κ^3^O- tetrakis[di-n-butyltin(IV)]","","- C60 H88 N4 O18 Sn4 -","- C60 H88 N4 O18 Sn4 -","- C120 H176 N8 O36 Sn8 -","2","0.5","BR6213","Min Hong; Han-Dong Yin; Da-Qi Wang","Bis(μ-3-nitrobenzoato)-1:2κ^2^<i>O</i>:<i>O</i>';3:4κ^2^<i>O</i>:<i>O</i>'-bis(3-nitrobenzoato)-1κ^2^<i>O</i>,<i>O</i>';3κ^2^<i>O</i>,<i>O</i>'-di-μ~3~-oxo-1:2:4κ^3^<i>O</i>;2:3:4κ^3^<i>O</i>-tetrakis[di-<i>n</i>-butyltin(IV)]","Acta Crystallographica Section E","2005","61","10","m2008","m2010","10.1107/S1600536805028369","","","0.71073","MoKα","","0.0701","0.0386","","","0.0905","0.1137","","","","","","0.999","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206859","7.9649","0.0004","5.6569","0.0003","8.1221","0.0003","90","","91.34","0.003","90","","365.85","0.03","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Hydrazinium nitrate","","- H5 N3 O3 -","- H5 N3 O3 -","- H20 N12 O12 -","4","1","BR6216","Grigoriev, Mikhail S.; Moisy, Philippe; Den Auwer, Christophe; Charushnikova, Iraida A.","Hydrazinium nitrate","Acta Crystallographica Section E","2005","61","10","i216","i217","10.1107/S1600536805029211","","","0.71073","MoKα","","0.0305","0.0281","","","0.07","0.072","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206860","15.6693","0.0017","10.4272","0.0008","17.1803","0.0015","90","","110.503","0.003","90","","2629.2","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-azido-κ^4^N:N-bis{aqua[2-(2-pyridylmethylideneamino)ethanesulfonate- κ^3^N,N',O]nickel(II)} dihydrate","","- C16 H26 N10 Ni2 O10 S2 -","- C16 H26 N10 Ni2 O10 S2 -","- C64 H104 N40 Ni8 O40 S8 -","4","1","BR6217","Jia-Ming Li; Yi-Min Jiang; Yan-Fei Wang; Da-Wen Liang","Di-μ-azido-κ^4^<i>N</i>:<i>N</i>-bis{aqua[2-(2-pyridylmethylideneamino)ethanesulfonato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]nickel(II)} dihydrate","Acta Crystallographica Section E","2005","61","10","m2160","m2162","10.1107/S1600536805030874","","","0.71073","MoKα","","0.0681","0.054","","","0.1135","0.1211","","","","","","1.147","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206861","36.77","0.007","7.604","0.0015","10.366","0.002","90","","97.82","0.03","90","","2871.4","1","295","","295","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Ethyl N-[1-ferrocenylethylidene]hydrazine carbazate","","- C15 H18 Fe N2 O2 -","- C15 H18 Fe N2 O2 -","- C120 H144 Fe8 N16 O16 -","8","1","BR6218","Yao-Cheng Shi","Ethyl 3-(1-ferrocenylethylidene)carbazate","Acta Crystallographica Section E","2005","61","10","m2136","m2138","10.1107/S1600536805030242","","","0.71073","MoKα","","0.0788","0.0597","","","0.1642","0.1841","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206862","12.2928","0.0004","3.8261","0.0001","14.3291","0.0005","90","","90","","90","","673.95","0.04","150","2","150","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Strontium nitride carbodiimide","Strontium nitride carbodiimide","","- C N4 Sr4 -","- C N4 Sr4 -","- C4 N16 Sr16 -","4","0.5","BR6219","Gál, Zoltán A.; Mallinson, Phillip M.; Clarke, Simon J.","Strontium nitride carbodiimide, Sr~4~N~2~(CN~2~)","Acta Crystallographica Section E","2005","61","10","i221","i222","10.1107/S1600536805030850","","","0.71073","MoKα","","0.0399","0.026","","","0.0462","0.0496","","","","","","1.071","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206863","10.7146","0.0001","23.8939","0.0001","16.8782","0.0003","90","","91.846","0.001","90","","4318.81","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","{N,N-Bis[3-(phenylysulfanyl)-1-(phenylsulfonyl)indol-2- ylmethyl]amino}acetaldehyde dimethyl acetal","","- C46 H38 N3 O6 S4 -","- C46 H38 N3 O6 S4 -","- C184 H152 N12 O24 S16 -","4","1","BT6700","M. Yogavel; D. Velmurugan; P. C. Srinivasan; H.-K. Fun","{<i>N</i>,<i>N</i>-Bis[3-(phenylysulfanyl)-1-(phenylsulfonyl)indol-2-ylmethyl]amino}acetaldehyde dimethyl acetal","Acta Crystallographica Section E","2005","61","10","o3205","o3207","10.1107/S160053680502790X","","","0.71073","MoKα","","0.1631","0.0738","","","0.1656","0.2071","","","","","","1.014","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206864","24.0578","0.0012","10.2342","0.0005","18.1597","0.0009","90","","125.861","0.001","90","","3623.6","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,3-Bis(1H-indol-3-yl)indolin-2-one","","- C24 H17 N3 O -","- C24 H17 N3 O -","- C192 H136 N24 O8 -","8","1","BT6707","S. Selvanayagam; Mahesh S. Chandak; D. Velmurugan; K. Ravikumar; R. Raghunathan","3,3-Bis(1<i>H</i>-indol-3-yl)indolin-2-one","Acta Crystallographica Section E","2005","61","10","o3122","o3123","10.1107/S1600536805027248","","","0.71073","MoKα","","0.0576","0.0496","","","0.1284","0.1344","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206865","23.592","0.003","8.3111","0.0006","12.5067","0.0014","90","","105.74","0.009","90","","2360.3","0.4","150","","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","O,O-Bis(2-tert-butyl-4-methoxyphenyl) chlorothiophosphonate","","- C22 H30 Cl O4 P S -","- C22 H30 Cl O4 P S -","- C88 H120 Cl4 O16 P4 S4 -","4","0.5","BT6713","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan; Albayrak, Çiğdem","<i>O</i>,<i>O</i>-Bis(2-<i>tert</i>-butyl-4-methoxyphenyl) chlorothiophosphonate. Corrigendum.","Acta Crystallographica Section E","2005","61","10","e4","e5","10.1107/S1600536805027789","","","0.71073","MoKα","","0.0303","0.0278","","","0.0721","0.0731","","","","","","1.077","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206866","22.439","0.006","8.553","0.002","20.576","0.005","90","","90.178","0.004","90","","3948.9","1.7","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[(1,4,7,10,13,16-hexaoxacyclooctadecane)potassium] carbonyltricyanorhodate(I) acetonitrile solvate","","- C30 H51 K2 N4 O13 Rh -","- C30 H51 K2 N4 O13 Rh -","- C120 H204 K8 N16 O52 Rh4 -","4","1","BT6720","Whaley, Curtis M.; Rauchfuss, Thomas B.; Wilson, Scott R.","Bis[(1,4,7,10,13,16-hexaoxacyclooctadecane)potassium] carbonyltricyanorhodate(I) acetonitrile solvate","Acta Crystallographica Section E","2005","61","10","m1918","m1919","10.1107/S1600536805027297","","","0.71073","MoKα","","0.0621","0.0364","","","0.0736","0.0811","","","","","","1.02","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206867","10.75","0.001","11.839","0.001","18.709","0.002","93.07","0.002","105.927","0.001","103.382","0.002","2210","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Bis[μ-2-(1-butylbenzimidazol-2-yl)phenolato]-κ^2^N^3^,O';κ^2^N^3'^,O- bis{[2-(1-butylbenzimidazol-2-yl)phenolato-κ^2^N^3^,O]zinc(II)} 2-(1-butylbenzimidazol-2-yl)phenol disolvate","","- C102 H104 N12 O6 Zn2 -","- C102 H104 N12 O6 Zn2 -","- C102 H104 N12 O6 Zn2 -","1","0.5","BT6722","Tong, Yi-Ping; Lin, Yan-Wen; Ng, Seik Weng","Bis[μ-2-(1-butylbenzimidazol-2-yl)phenolato]-1κ<i>N</i>^3^:2κ<i>O</i>;1κ<i>O</i>:2κ<i>N</i>^3^-bis{[2-(1-butylbenzimidazol-2-yl)phenolato-κ^2^<i>N</i>^3^,<i>O</i>]zinc(II)} 2-(1-butylbenzimidazol-2-yl)phenol disolvate","Acta Crystallographica Section E","2005","61","10","m1915","m1917","10.1107/S1600536805027418","","","0.71073","MoKα","","0.098","0.068","","","0.172","0.196","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206868","18.8748","0.0018","10.8973","0.001","19.1042","0.0015","90","","109.139","0.005","90","","3712.2","0.6","291","1","291","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","10-(tert-Butyldimethylsilyl)-4,6-bis(diphenylphosphino)phenoxazine","","- C42 H41 N O P2 Si -","- C42 H41 N O P2 Si -","- C168 H164 N4 O4 P8 Si4 -","4","1","BT6724","Osiński, Piotr W.; Schürmann, Markus; Preut, Hans; Haag, Rainer; Eilbracht, Peter","10-(<i>tert</i>-Butyldimethylsilyl)-4,6-bis(diphenylphosphino)phenoxazine","Acta Crystallographica Section E","2005","61","10","o3115","o3116","10.1107/S1600536805027121","","","0.71073","MoKα","","0.1542","0.0373","","","0.0619","0.0793","","","","","","0.988","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206869","6.7467","0.0013","9.1779","0.0018","10.731","0.002","102.95","0.03","103.29","0.03","100.02","0.03","612.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","magnesium pyrazinetetracarboxylate","Bis[hexaquamagnesium(II)] pyrazine-2,3,5,6-tetracarboxylate tetrahydrate","","- C8 H32 Mg2 N2 O24 -","- C8 H32 Mg2 N2 O24 -","- C8 H32 Mg2 N2 O24 -","1","0.5","BT6725","Gryz Michał; Starosta Wojciech; Leciejewicz Janusz","Bis[hexaquamagnesium(II)] pyrazine-2,3,5,6-tetracarboxylate tetrahydrate","Acta Crystallographica Section E","2005","61","10","m1920","m1922","10.1107/S1600536805027406","","","0.71073","MoKα","","0.0583","0.0419","","","0.1271","0.1374","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206870","4.6309","0.0003","5.8963","0.0004","39.939","0.003","90","","90","","90","","1090.54","0.13","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","{N-[(S)-1-Phenylethyl]carbamoyl}methylaminium chloride","","- C10 H15 Cl N2 O -","- C10 H15 Cl N2 O -","- C40 H60 Cl4 N8 O4 -","4","1","BT6726","Williamson, Craig; Storey, John M. D.; Harrison, William T. A.","{<i>N</i>-[(<i>S</i>)-1-Phenylethyl]carbamoyl}methylaminium chloride","Acta Crystallographica Section E","2005","61","10","o3133","o3135","10.1107/S1600536805027182","","","0.71073","MoKα","","0.0508","0.0417","","","0.1141","0.1274","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206871","4.779","0.0001","11.9257","0.0004","14.6703","0.0003","90","","96.8173","0.0016","90","","830.19","0.04","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(2-Bromophenyl)acetamide","","- C8 H8 Br N O -","- C8 H8 Br N O -","- C32 H32 Br4 N4 O4 -","4","1","BT6727","Ronaldson, Vicki; Storey, John. M. D.; Harrison, William T. A.","<i>N</i>-(2-Bromophenyl)acetamide","Acta Crystallographica Section E","2005","61","10","o3156","o3158","10.1107/S1600536805027492","","","0.71073","MoKα","","0.0352","0.0315","","","0.0732","0.0743","","","","","","1.262","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206872","9.674","0.001","11.761","0.001","12.315","0.002","90","","99.285","0.002","90","","1382.8","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[dimethylammonium aquadi-μ-oxalato-europate(III) trihydrate]","","- C6 H16 Eu N O12 -","- C6 H16 Eu N O12 -","- C24 H64 Eu4 N4 O48 -","4","1","BT6728","Yang, Yang-Yi; Zai, Shao-Bo; Wong, Wing-Tak; Ng, Seik Weng","Poly[dimethylammonium aquadi-μ-oxalato-europate(III) trihydrate]","Acta Crystallographica Section E","2005","61","10","m1912","m1914","10.1107/S1600536805027467","","","0.71073","MoKα","","0.036","0.026","","","0.058","0.062","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206873","22.3933","0.0009","5.6174","0.0002","22.3033","0.0008","90","","90","","90","","2805.58","0.18","183","2","183","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","tetrakis(tert-butylisocyanide)copper(I) chloride monohydrate","","- C20 H38 Cl Cu N4 O -","- C20 H38 Cl Cu N4 O -","- C80 H152 Cl4 Cu4 N16 O4 -","4","0.5","BT6729","Imhof, Wolfgang; Halbauer, Kathi; Görls, Helmar","Tetrakis(<i>tert</i>-butyl isocyanide)copper(I) chloride monohydrate","Acta Crystallographica Section E","2005","61","10","m1995","m1997","10.1107/S1600536805028606","","","0.71073","MoKα","","0.1251","0.0699","","","0.1964","0.231","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206874","8.832","0.004","9.811","0.004","11.089","0.005","90","","90","","90","","960.9","0.7","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Ethylenediaminium tetrachlorozincate","","- C2 H10 Cl4 N2 Zn -","- C2 H10 Cl4 N2 Zn -","- C8 H40 Cl16 N8 Zn4 -","4","1","BT6730","Harrison, William T. A.","Ethylenediaminium tetrachlorozincate","Acta Crystallographica Section E","2005","61","10","m1951","m1952","10.1107/S1600536805027923","","","0.71073","MoKα","","0.0936","0.084","","","0.1968","0.2093","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206875","4.8701","0.0001","11.8048","0.0004","15.9296","0.0005","90","","93.964","0.002","90","","913.61","0.05","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(2-Bromophenyl)propionamide","","- C9 H10 Br N O -","- C9 H10 Br N O -","- C36 H40 Br4 N4 O4 -","4","1","BT6731","Ronaldson, Vicki; Storey, John. M. D.; Harrison, William T. A.","<i>N</i>-(2-Bromophenyl)propionamide","Acta Crystallographica Section E","2005","61","10","o3200","o3202","10.1107/S1600536805027935","","","0.71073","MoKα","","0.034","0.0269","","","0.062","0.0648","","","","","","1.072","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206876","11.9479","0.0008","13.2197","0.0009","13.9479","0.0009","90","","92.327","0.001","90","","2201.2","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[2-(2-hydroxyethoxy)ethyl]-4-(dibenzo[b,f][1,4]thiazepin-11- yl)piperazinium hemifumarate","","- C46 H54 N6 O8 S2 -","- C46 H54 N6 O8 S2 -","- C92 H108 N12 O16 S4 -","2","0.5","BT6732","K. Ravikumar; B. Sridhar","Quetiapine hemifumarate","Acta Crystallographica Section E","2005","61","10","o3245","o3248","10.1107/S1600536805028357","","","0.71073","MoKα","","0.0606","0.0547","","","0.1322","0.1362","","","","","","1.116","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2206877","8.9279","0.0006","12.1099","0.0009","11.7567","0.0009","90","","95.117","0.001","90","","1266.02","0.16","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Isatin 3-benzoylhydrazone","2-oxo-2,3-dihydro-1H-indole-3-carbaldehyde benzoylhydrazone","","- C15 H11 N3 O2 -","- C15 H11 N3 O2 -","- C60 H44 N12 O8 -","4","1","BT6733","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng","Isatin 3-benzoylhydrazone: a monoclinic form","Acta Crystallographica Section E","2005","61","10","o3285","o3286","10.1107/S1600536805028692","","","0.71073","MoKα","","0.069","0.042","","","0.108","0.125","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206878","8.0023","0.0009","28.549","0.003","5.2574","0.0006","90","","90","","90","","1201.1","0.2","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","Isatin 3-benzoylhydrazone","2-oxo-2,3-dihydro-1H-indole-3-carbaldehyde benzoylhydrazone","","- C15 H11 N3 O2 -","- C15 H11 N3 O2 -","- C60 H44 N12 O8 -","4","1","BT6734","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng","Isatin 3-benzoylhydrazone: an orthorhombic form","Acta Crystallographica Section E","2005","61","10","o3287","o3288","10.1107/S1600536805028709","","","0.71073","MoKα","","0.079","0.058","","","0.166","0.191","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206879","5.492","0.001","14.098","0.001","18.056","0.001","101.92","0.01","91.52","0.01","100.83","0.01","1340.4","0.3","291.3","0.3","291.3","0.3","","","","","","","","5","P -1","-P 1","2","","4-Phenyl-14,18-dithia-4-phosphatricyclo[18.4.0.0^7,12^]tetracosa-2,5- dien-4-one benzene solvate","","- C30 H30 O P S2 -","- C30 H30 O P S2 -","- C60 H60 O2 P2 S4 -","2","1","BT6735","Wieczorek, Wanda; Trzesowska, Agata; Kruszynski, Rafal","4-Phenyl-14,18-dithia-4-phosphatricyclo[18.4.0.0^7,12^]tetracosa-2,5-dien-4-one benzene hemisolvate","Acta Crystallographica Section E","2005","61","10","o3304","o3306","10.1107/S1600536805029181","","","1.54178","CuKα","","0.0656","0.0622","","","0.1768","0.1822","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206880","8.0887","0.0002","12.875","0.0004","23.8205","0.0008","90","","90","","90","","2480.71","0.13","291","1","291","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Epivernadol diacetate","(4aR,5R,6S,7S,8aS)-methyl 8a-ethenyloctahydro-5-acetoxy-7-{[2-(acetoxymethyl)-1-oxo-2-propenyl]oxy}- α,4-bis(methylene)-3-oxo-1H-2-benzopyran-6-acetate","","- C24 H28 O10 -","- C24 H28 O10 -","- C96 H112 O40 -","4","1","BT6736","Koul, Jawahir L.; Koul, Surrinder; Taneja, Subbash C.; Schürmann, Markus; Preut, Hans; Spiteller, Michael","Epivernadol diacetate","Acta Crystallographica Section E","2005","61","10","o3349","o3350","10.1107/S1600536805029387","","","0.71073","MoKα","","0.105","0.0434","","","0.0984","0.1154","","","","","","0.865","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206881","8.4698","0.0005","9.3359","0.0006","12.6058","0.0008","74.394","0.001","72.025","0.001","79.334","0.001","907.49","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2'-(2-Chlorophenyl)-1'-nitro-2',3',4',5',6',7'-hexahydro-1H-indole-3-spiro- 3'-1'H-pyrrolizin-2(3H)-one","","- C20 H18 Cl N3 O3 -","- C20 H18 Cl N3 O3 -","- C40 H36 Cl2 N6 O6 -","2","1","BT6737","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; R. Raghunathan","2'-(2-Chlorophenyl)-1'-nitro-2',3',4',5',6',7'-hexahydro-1<i>H</i>-indole-3-spiro-3'-1'<i>H</i>-pyrrolizin-2(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","10","o3299","o3301","10.1107/S1600536805028990","","","0.71073","MoKα","","0.0457","0.0423","","","0.1234","0.1275","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206882","23.8981","0.0015","7.5886","0.0004","19.137","0.001","90","","102.941","0.002","90","","3382.4","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1'-nitro-2'-phenyl-2',3',4',5',6',7'-hexahydro-1H-indole- 3-spiro-3'-1'H-pyrrolizin-2(3H)-one","","- C20 H19 N3 O3 -","- C20 H19 N3 O3 -","- C160 H152 N24 O24 -","8","1","BT6738","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Poornachandran","Hydrogen bonding in 1'-nitro-2'-phenyl-2',3',4',5',6',7'-hexahydro-1<i>H</i>-indole-3-spiro-3'-1'H-pyrrolizidin-2(3<i>H</i>)-one: molecular chains built from alternating R_{2}^{2}(18) and R_{2}^{2}(8) rings","Acta Crystallographica Section E","2005","61","10","o3312","o3314","10.1107/S1600536805029107","","","0.71073","MoKα","","0.0595","0.0532","","","0.1571","0.1641","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206883","7.3325","0.0014","31.43","0.005","6.3749","0.0018","90","","97.35","0.02","90","","1457.1","0.6","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","3-carboxyanilinium 5-sulfosalicylate","3-carboxyanilinium 3-carboxy-4-hydroxybenzenesulfonate","","- C14 H13 N O8 S -","- C14 H13 N O8 S -","- C56 H52 N4 O32 S4 -","4","1","BT6739","Graham Smith","3-Carboxyanilinium 3-carboxy-4-hydroxybenzenesulfonate: the 1:1 proton-transfer compound of 5-sulfosalicylic acid with 3-aminobenzoic acid","Acta Crystallographica Section E","2005","61","10","o3398","o3400","10.1107/S1600536805029491","","","0.71069","MoKα","","0.0953","0.0451","","","0.116","0.158","","","","","","0.897","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206884","11.9751","0.0007","13.4815","0.0008","17.2114","0.0011","90","","91.978","0.001","90","","2777","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-[Bis(2-methyl-1H-indol-3-yl)methyl]-1-(4-methoxyphenyl)-3-phenylazetidin- 2-one","","- C35 H31 N3 O2 -","- C35 H31 N3 O2 -","- C140 H124 N12 O8 -","4","1","BT6740","S. Selvanayagam; D. Velmurugan; K. Ravikumar; B. Sridhar; E. Ramesh","4-[Bis(2-methyl-1<i>H</i>-indol-3-yl)methyl]-1-(4-methoxyphenyl)-3-phenylazetidin-2-one","Acta Crystallographica Section E","2005","61","10","o3386","o3388","10.1107/S1600536805029557","","","0.71073","MoKα","","0.0584","0.0492","","","0.1387","0.1485","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206885","14.25","0.001","10.806","0.001","28.126","0.002","90","","96.374","0.001","90","","4304.2","0.6","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Racemic 1,1'-bi-2-naphthol dimethylformamide sesquisolvate","","- C24.5 H24.5 N1.5 O3.5 -","- C24.5 H24.5 N1.5 O3.5 -","- C196 H196 N12 O28 -","8","1","BT6743","Yuan, Ji-Xin; Song, Xin-Yuan; Ng, Seik Weng","Racemic 1,1'-bi-2-naphthol dimethylformamide sesquisolvate: a redetermination","Acta Crystallographica Section E","2005","61","10","o3457","o3458","10.1107/S1600536805030369","","","0.71073","MoKα","","0.12","0.099","","","0.23","0.254","","","","","","1.18","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206886","8.843","0.0005","8.843","","54.486","0.003","90","","90","","90","","4260.7","0.3","295","2","295","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","<i>S</i>-(-)-1,1'-Bi-2-naphthol dimethylformamide sesquisolvate","","- C24.5 H24.5 N1.5 O3.5 -","- C24.5 H24.5 N1.5 O3.5 -","- C196 H196 N12 O28 -","8","1","BT6744","Yuan, Ji-Xin; Song, Xin-Yuan; Ng, Seik Weng","(<i>S</i>)-(‒)-1,1'-Bi-2-naphthol dimethylformamide sesquisolvate","Acta Crystallographica Section E","2005","61","10","o3459","o3460","10.1107/S1600536805030370","","","0.71073","MoKα","","0.0795","0.0762","","","0.1909","0.193","","","","","","1.373","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206887","5.314","0.0003","5.314","0.0003","15.536","0.0012","90","","90","","90","","438.71","0.05","150","2","150","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","Malonamide","Malonamide","","- C3 H6 N2 O2 -","- C3 H6 N2 O2 -","- C12 H24 N8 O8 -","4","0.5","BT6745","Nichol, Gary S.; Clegg, William","Malonamide: a tetragonal polymorph","Acta Crystallographica Section E","2005","61","10","o3424","o3426","10.1107/S1600536805030539","","","0.71073","MoKα","","0.0336","0.0316","","","0.0793","0.0821","","","","","","1.232","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206888","5.3602","0.0009","7.5178","0.0008","11.791","0.002","90","","90","","90","","475.14","0.12","150","2","150","2","","","","","","","","4","P b c n","-P 2n 2ab","60","Malonamide","Malonamide","","- C3 H6 N2 O2 -","- C3 H6 N2 O2 -","- C12 H24 N8 O8 -","4","0.5","BT6746","Nichol, Gary S.; Clegg, William","Malonamide: an orthorhombic polymorph","Acta Crystallographica Section E","2005","61","10","o3427","o3429","10.1107/S1600536805030540","","","0.71073","MoKα","","0.0338","0.0306","","","0.0807","0.0829","","","","","","1.111","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206889","6.925","0.004","7.025","0.004","11.733","0.008","90","","103.44","0.03","90","","555.2","0.6","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","(3S)-3-benzyloxymethyl-1,4-dioxane-2,5-dione","","- C12 H12 O5 -","- C12 H12 O5 -","- C24 H24 O10 -","2","1","BT6747","Kooijman, Huub; Leemhuis, Mark; Nostrum, Cornelus F. van; Hennink, Wim E.; Spek, Anthony L.","(3<i>S</i>)-3-Benzyloxymethyl-1,4-dioxane-2,5-dione","Acta Crystallographica Section E","2005","61","10","o3480","o3481","10.1107/S1600536805030564","","","0.71073","MoKα","","0.0584","0.043","","","0.0943","0.1022","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206890","4.9331","0.0003","26.249","0.0013","10.4901","0.0006","90","","93.093","0.0013","90","","1356.37","0.13","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Phthalimidomethyl Phthalonitrile","4-[4-(1,3-Dioxo-2,3-dihydro-1H-isoindol-2-yl)methyl]phthalonitrile","","- C17 H9 N3 O2 -","- C17 H9 N3 O2 -","- C68 H36 N12 O8 -","4","1","BV6027","Xiu-Zhi Xu; Mei-Jin Lin; Jun-Dong Wang; Nai-Sheng Chen; Jin-Ling Huang","4-[(1,3-Dioxo-2,3-dihydro-1<i>H</i>-isoindol-2-yl)methyl]phthalonitrile","Acta Crystallographica Section E","2005","61","10","o3145","o3146","10.1107/S1600536805027443","","","0.71069","MoKα","","0.0899","0.0373","","","0.0768","0.1169","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206891","16.9476","0.0006","24.1286","0.0009","10.2457","0.0004","90","","90","","90","","4189.7","0.3","110","2","110","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Tris(tetraethylammonium) μ-3-hydroxypropanolato-di-μ-methoxo-bis[tricarbonyltungsten(0)]","","- C35 H73 N3 O10 W2 -","- C35 H71 N3 O10 W2 -","- C140 H284 N12 O40 W8 -","4","0.5","BV6028","Klausmeyer, Kevin K.; Adrian, Rafael A.","Tris(tetraethylammonium) μ-3-hydroxypropanolato-di-μ-methoxo-bis[tricarbonyltungsten(0)]","Acta Crystallographica Section E","2005","61","10","m2039","m2041","10.1107/S1600536805029041","","","0.71073","MoKα","","0.0282","0.0224","","","0.0556","0.0601","","","","","","1.019","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206892","9.925","0.005","14.92","0.007","13.969","0.007","90","","98.97","0.05","90","","2043.2","1.8","301","2","301","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(acetato-κO)tetrakis(1H-pyrazole-κN^1^)nickel(II)","","- C16 H22 N8 Ni O4 -","- C16 H22 N8 Ni O4 -","- C64 H88 N32 Ni4 O16 -","4","1","BV6029","Blaz̆ena Papánková; Svoboda, Ingrid; Fuess, Hartmut; S̆intálová, Katka","Bis(acetato-κ<i>O</i>)tetrakis(1<i>H</i>-pyrazole-κ<i>N</i>^1^)nickel(II)","Acta Crystallographica, Section E","2005","61","10","m2036","m2038","10.1107/S1600536805029193","","","0.71073","MoKα","","0.0556","0.0422","","","0.1095","0.1178","","","","","","1.031","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206893","9.9492","0.0001","13.6254","0.0002","18.9012","0.0003","90","","116.972","0.001","90","","2283.58","0.06","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{[Dimethyl(2-pyridyl)silyl]bis(trimethylsilyl)methyl}diiodoindium(III)","","- C14 H28 I2 In N Si3 -","- C14 H28 I2 In N Si3 -","- C56 H112 I8 In4 N4 Si12 -","4","1","BV6030","Lund, Clinton L.; Schachner, Jörg A.; Quail, J. Wilson; Müller, Jens","A monomeric fourfold-coordinated indium dihalide with an unusual coordination geometry","Acta Crystallographica Section E","2005","61","10","m2063","m2065","10.1107/S1600536805029284","","","0.71073","MoKα","","0.0605","0.0411","","","0.0939","0.1041","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206894","5.9691","0.0007","17.795","0.002","9.423","0.0012","90","","105.19","0.002","90","","965.9","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4,7,10-tetrakis(carbamoylmethyl)-1,4,7,10-tetraazacyclododecane","","- C16 H32 N8 O4 -","- C16 H32 N8 O4 -","- C32 H64 N16 O8 -","2","0.5","BV6031","Gareth O. Lloyd; Robert C. Luckay","1,4,7,10-Tetrakis(carbamoylmethyl)-1,4,7,10-tetraazacyclododecane","Acta Crystallographica Section E","2005","61","10","o3405","o3407","10.1107/S1600536805030023","","","0.71073","MoKα","","0.0493","0.0419","","","0.107","0.1114","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206895","6.2357","0.001","10.65","0.0011","20.472","0.002","94.641","0.008","90.978","0.013","93.824","0.011","1351.7","0.3","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","trans‒Bis(tert‒butylamine)dichloropalladium(II)","","- C8 H22 Cl2 N2 Pd -","- C8 H22 Cl2 N2 Pd -","- C32 H88 Cl8 N8 Pd4 -","4","2","BV6033","Boag, Neil M.; Clapham, Sarah","<i>trans</i>-Bis(<i>tert</i>-butylamine)dichloropalladium(II)","Acta Crystallographica Section E","2005","61","10","m2172","m2173","10.1107/S1600536805030047","","","0.71073","MoKα","","0.04","0.0384","","","0.0968","0.0976","","","","","","1.234","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206896","11.09","0.002","7.4421","0.0015","17.734","0.004","90","","97.693","0.003","90","","1450.5","0.5","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-((1H-1,2,4-triazol-1-yl)methyl)-4-(4-chlorobenzylideneamino)-2H -1,2,4-triazole-3(4H)-thione","","- C12 H10 Cl N7 S -","- C12 H10 Cl N7 S -","- C48 H40 Cl4 N28 S4 -","4","1","BV6035","Xu, Liang-Zhong; Yu, Guan-Ping; Si, Guo-Dong; Shang, Yu-Qing; Li, Wei-Hua; Hou, Bao-Rong","4-(4-Chlorobenzylideneamino)-3-(1<i>H</i>-1,2,4-triazol-1-ylmethyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","10","o3408","o3409","10.1107/S1600536805030059","","","0.71073","MoKα","","0.0799","0.0408","","","0.093","0.1127","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206897","7.9651","0.0014","6.4632","0.0012","15.445","0.003","90","","90.136","0.003","90","","795.1","0.3","150","2","150","2","","","","","","","","5","P 1 n 1","P -2yac","7","","(1S*,2S*,4S*)-3,3-Difluoro-2,4-dihydroxy-5,5-dimethylcyclooct-5(Z)-en-1-yl N,N-diethylcarbamate","","- C15 H25 F2 N O4 -","- C15 H25 F2 N O4 -","- C30 H50 F4 N2 O8 -","2","1","CF6442","John Fawcett; Jonathan M Percy; Stéphane Pintat; Clive A Smith; Emi Uneyama","(1<i>S</i>*,2<i>S</i>*,4<i>S</i>*)-3,3-Difluoro-2,4-dihydroxy-5,5-dimethylcyclooct-5(<i>Z</i>)-en-1-yl <i>N</i>,<i>N</i>-diethylcarbamate","Acta Crystallographica Section E","2005","61","10","o3319","o3321","10.1107/S1600536805024839","","","0.71073","MoKα","","0.0841","0.0817","","","0.2291","0.2304","","","","","","1.13","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206898","20.062","0.014","6.433","0.004","12.424","0.009","90","","97.346","0.012","90","","1590.3","1.9","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(1R*,3S*,8S*)-2,2-Difluoro-3,8-dihydroxy-5,5-dimethylcyclooct-4(Z)-en-1-yl N,N-diethylcarbamate","","- C15 H25 F2 N O4 -","- C15 H25 F2 N O4 -","- C60 H100 F8 N4 O16 -","4","1","CF6443","John Fawcett; Jonathan M Percy; Stéphane Pintat; Clive A Smith; Emi Uneyama","(1<i>R</i>*,3<i>S</i>*,8<i>S</i>*)-2,2-Difluoro-3,8-dihydroxy-5,5-dimethylcyclooct-4(<i>Z</i>)-en-1-yl <i>N</i>,<i>N</i>-diethylcarbamate","Acta Crystallographica Section E","2005","61","10","o3322","o3323","10.1107/S1600536805024840","","","0.71073","MoKα","","0.0457","0.0386","","","0.0916","0.0953","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206899","13.232","0.002","11.6546","0.0018","12.293","0.002","90","","92.881","0.003","90","","1893.4","0.5","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-Ferrocenyl-1-(1-indenyl)cyclohexane","","- C25 H26 Fe -","- C25 H26 Fe -","- C100 H104 Fe4 -","4","1","CF6450","Lin, Jin; Xu, Shan-Sheng; Song, Hai-Bin","1-Ferrocenyl-1-(1-indenyl)cyclohexane","Acta Crystallographica Section E","2005","61","10","m1968","m1969","10.1107/S1600536805028308","","","0.71073","MoKα","","0.0846","0.0436","","","0.103","0.121","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206900","8.413","0.002","6.167","0.002","30.683","0.006","90","","93.04","0.03","90","","1589.7","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{1-[2-(Dimethylamino)ethyliminomethyl]-2-naphthalato}thiocyanatonickel(II)","","- C16 H17 N3 Ni O S -","- C16 H17 N3 Ni O S -","- C64 H68 N12 Ni4 O4 S4 -","4","1","CF6451","You, Zhong-Lu","{1-[2-(Dimethylamino)ethyliminomethyl]-2-naphtholato}thiocyanatonickel(II)","Acta Crystallographica Section E","2005","61","10","m1963","m1964","10.1107/S1600536805028175","","","0.71073","MoKα","","0.1219","0.0619","","","0.1271","0.1514","","","","","","0.998","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206901","4.9315","0.0003","14.6161","0.001","15.5026","0.0011","90","","93.928","0.002","90","","1114.79","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dichlorobis(cyanoguanidine)zinc(II)","","- C4 H8 Cl2 N8 Zn -","- C4 H8 Cl2 N8 Zn -","- C16 H32 Cl8 N32 Zn4 -","4","1","CF6454","Fowkes, Adrian; Harrison, William T. A.","A monoclinic polymorph of dichlorobis(cyanoguanidine)zinc(II)","Acta Crystallographica Section E","2005","61","10","m2021","m2022","10.1107/S1600536805028916","","","0.71073","MoKα","","0.0666","0.0353","","","0.0692","0.0768","","","","","","0.908","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206902","47.7051","0.0005","7.627","0.0001","33.12","0.0005","90","","124.125","0.0006","90","","9975.7","0.2","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,3-dimethyl-1,1,1,5,5,5-hexaphenyltrisiloxane","","- C38 H36 O2 Si3 -","- C38 H36 O2 Si3 -","- C456 H432 O24 Si36 -","12","1.5","CF6456","Spek, Anthony L.; Ellis, Dianne D.; Hanssen, Rob W. J. M.; van Santen, Rutger A.; Abbenhuis, Hendricus C. L.","3,3-Dimethyl-1,1,1,5,5,5-hexaphenyltrisiloxane","Acta Crystallographica Section E","2005","61","10","o3324","o3326","10.1107/S1600536805029405","","","0.71073","MoKα","","0.0893","0.047","","","0.0985","0.1119","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206903","14.458","0.003","21.356","0.004","9.874","0.002","90","","90","","90","","3048.7","1.1","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","cryptotanshinone","1,6,6-Trimethyl-1,2,6,7,8,9-hexahydrophenanthro[1,2-b]furan-10,11-dione","","- C19 H20 O3 -","- C19 H20 O3 -","- C152 H160 O24 -","8","2","CI6603","Zhang, Lei; Wang, Jingkang; Qu, Yi","1,6,6-Trimethyl-1,2,6,7,8,9-hexahydrophenanthro[1,2-<i>b</i>]furan-10,11-dione","Acta Crystallographica Section E","2005","61","10","o3127","o3128","10.1107/S1600536805027303","","","0.71073","MoKα","","0.0761","0.0466","","","0.12","0.1315","","","","","","0.906","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206904","16.7345","0.0006","16.7345","0.0006","8.7634","0.0006","90","","90","","90","","2454.1","0.2","293","2","293","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","Chloro{2-[tris(hydroxymethyl)methyliminomethyl]phenolato}copper(II)","","- C11 H14 Cl Cu N O4 -","- C11 H14 Cl Cu N O4 -","- C88 H112 Cl8 Cu8 N8 O32 -","8","1","CI6617","Ni, Jia; Chen, Yao-Wen; Zhang, Haidan","Chloro{2-[tris(hydroxymethyl)methyliminomethyl]phenolato}copper(II)","Acta Crystallographica Section E","2005","61","10","m2093","m2094","10.1107/S1600536805025626","","","0.71073","MoKα","","0.0408","0.0346","","","0.0735","0.0774","","","","","","1.008","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206905","11.8884","0.0006","13.3784","0.0007","15.7892","0.0008","114.054","0.001","98.926","0.001","101.335","0.001","2169.42","0.19","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","3-(4-Chlorophenyl)-5-methyl-2-propylamino-8,9,10,11-tetrahydro- 2-benzothieno[2'3';2,3]pyrido[4,5-d]pyrimidin-4(3H)-one","","- C23 H23 Cl N4 O S -","- C23 H23 Cl N4 O S -","- C92 H92 Cl4 N16 O4 S4 -","4","2","CI6618","Liu, Jian-Chao; Chen, He-Lian; Chen, Ting; He, Hong-Wu; Ding, Ming-Wu","3-(4-Chlorophenyl)-5-methyl-2-propylamino-8,9,10,11-tetrahydro-2-benzothieno[2',3';2,3]pyrido[4,5-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","10","o3187","o3189","10.1107/S1600536805027595","","","0.71073","MoKα","","0.0834","0.0525","","","0.1343","0.1562","","","","","","1.032","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206906","11.144","0.0008","11.163","0.0007","15.769","0.0014","75.782","0.005","77.534","0.007","73.395","0.005","1799.7","0.2","122","2","122","2","","","","","","","","4","P -1","-P 1","2","","Diethyl 5-bromo-4,7-dimethoxyindan-2,2-dicarboxylate","","- C17 H21 Br O6 -","- C17 H21 Br O6 -","- C68 H84 Br4 O24 -","4","2","CI6633","Peter Hammershøj; Jørn B. Christensen","Diethyl 5-bromo-4,7-dimethoxyindan-2,2-dicarboxylate","Acta Crystallographica Section E","2005","61","10","o3278","o3280","10.1107/S1600536805028321","","","0.71073","MoKα","","0.048","0.0342","","","0.0746","0.0814","","","","","","1.094","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206907","16.569","0.001","8.033","0.001","24.643","0.003","90","","90.232","0.007","90","","3279.9","0.6","122","2","122","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4,7-Dimethoxy-indan-2,2-dicarboxylic acid diethyl ester","4,7-Dimethoxy-indan-2,2-dicarboxylic acid diethyl ester","","- C17 H22 O6 -","- C17 H22 O6 -","- C136 H176 O48 -","8","2","CI6634","Peter Hammershøj; Jørn B. Christensen","Diethyl 4,7-dimethoxyindan-2,2-dicarboxylate","Acta Crystallographica Section E","2005","61","10","o3468","o3469","10.1107/S1600536805030217","","","0.71073","MoKα","","0.1238","0.0611","","","0.119","0.1487","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206908","11.179","0.001","7.431","0.001","23.683","0.002","90","","92.53","0.01","90","","1965.5","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis{1-[3-(cyclohexylamino)propyliminomethyl]-2-naphtholato}nickel(II) dichloride 1.24 hydrate","","- C40 H54.48 Cl2 N4 Ni O3.24 -","- C40 H54.48 Cl2 N4 Ni O3.24 -","- C80 H108.96 Cl4 N8 Ni2 O6.48 -","2","0.5","CI6637","Wang, Feng-Wu","Bis{1-[3-(cyclohexylaminio)propyliminomethyl]-2-naphtholato}nickel(II) dichloride 1.24-hydrate","Acta Crystallographica Section E","2005","61","10","m1998","m2000","10.1107/S160053680502862X","","","0.71073","MoKα","","0.0569","0.0433","","","0.1051","0.1135","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206909","20.802","0.007","7.861","0.003","24.488","0.006","90","","116.72","0.02","90","","3577","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,10-Phenanthrolinium‒6-carboxypyridine-2-carboxylate‒1,10- phenanthroline‒pyridine-2,6-dicarboxylic acid‒ethanol‒water (1/1/1/1/1/1)","","- C40 H34 N6 O10 -","- C40 H34 N6 O10 -","- C160 H136 N24 O40 -","4","1","CI6638","Ai-Yun Fu; Da-Qi Wang; Cun-Lan Zhang","1,10-Phenanthrolinium‒6-carboxypyridine-2-carboxylate‒1,10-phenanthroline‒pyridine-2,6-dicarboxylic acid‒ethanol‒water (1/1/1/1/1/1)","Acta Crystallographica Section E","2005","61","10","o3119","o3121","10.1107/S1600536805027236","","","0.71073","MoKα","","0.1987","0.06","","","0.1039","0.141","","","","","","0.999","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206910","7.9337","0.0008","13.0996","0.0013","13.9361","0.0014","78.913","0.002","79.686","0.002","74.259","0.002","1355.6","0.2","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","Diethyl 2,6-dicyclohexyl-4,8-dioxo-22,3,6,7-tetrahydro-1H,5H-2,3a,4a,6,7a,8a- hexaazacyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C26 H40 N6 O6 -","- C26 H40 N6 O6 -","- C52 H80 N12 O12 -","2","1","CI6643","Li, Yi-Tao; Zhao, BaoHan; Yin, Guo-Dong; Wu, An-Xin","Diethyl 2,6-dicyclohexyl-4,8-dioxo-2,2,3,6,7-tetrahydro-1<i>H</i>,5<i>H</i>-2,3a,4a,6,7a,8a-hexaazacyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2005","61","10","o3368","o3370","10.1107/S160053680502948X","","","0.71073","MoKα","","0.0953","0.0653","","","0.1662","0.1879","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206911","7.4709","0.0009","11.6988","0.0014","12.3883","0.0015","96.299","0.002","101.097","0.002","106.844","0.002","1001","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","2-(Methoxycarbonyl)anilinium chloride monohydrate","","- C8 H12 Cl N O3 -","- C8 H12 Cl N O3 -","- C32 H48 Cl4 N4 O12 -","4","2","CI6646","Ma, Ying-Ying; Yu, Yan; Wu, Yong-Fei; Xiao, Feng-Ping; Jin, Long-Fei","2-(Methoxycarbonyl)anilinium chloride monohydrate","Acta Crystallographica Section E","2005","61","10","o3497","o3499","10.1107/S1600536805030771","","","0.71073","MoKα","","0.045","0.0406","","","0.1218","0.1283","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206912","6.218","0.0016","24.893","0.006","10.02","0.003","90","","100.65","0.004","90","","1524.2","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2-Benzotriazol-1-ylethyl)[2-(benzotriazol-2-yl)ethyl]amine","","- C16 H17 N7 -","- C16 H17 N7 -","- C64 H68 N28 -","4","1","CI6647","Zhang, Yong; Liao, Zhan-Ru; Li, Dong-Fen; Meng, Xiang-Gao","[2-(Benzotriazol-1-yl)ethyl][2-(benzotriazol-2-yl)ethyl]amine","Acta Crystallographica Section E","2005","61","10","o3396","o3397","10.1107/S1600536805029685","","","0.71073","MoKα","","0.0708","0.0588","","","0.157","0.167","","","","","","1.044","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206913","9.7048","0.0002","28.9048","0.0005","13.492","0.0002","90","","127.77","0.001","90","","2991.72","0.1","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Dihydroxydimethoxydihydrochalcone","1-(2,4-dihydroxy-6-methoxyphenyl)-3-(4-methoxyphenyl)propan-1-one","","- C17 H18 O5 -","- C17 H18 O5 -","- C136 H144 O40 -","8","2","CI6648","Ng Shea-Lin; Ibrahim Abdul Razak; Hoong-Kun Fun; Sompong Boonsri; Suchada Chantrapromma; Uma Prawat","A second monoclinic polymorph of 1-(2,4-dihydroxy-6-methoxyphenyl)-3-(4-methoxyphenyl)propan-1-one","Acta Crystallographica Section E","2005","61","10","o3234","o3236","10.1107/S1600536805028291","","","0.71073","MoKα","","0.1158","0.0538","","","0.1276","0.1558","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206914","13.0931","0.0005","13.5932","0.0006","15.6098","0.0006","90","","90","","90","","2778.19","0.19","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Physalin H","(5R,6S,8S,9R,14R,15R,17R,18S,21S,24R,26S,27R)-5α-Chloro- 16,24-cyclo-13,14-secoergosta-2-ene-18,26-dioic acid-14:17,14:27-diepoxy- 6β,13,20,22-tetrahydroxy-1,15-dioxo-γ-lactone δ-lactone 5α-chloro methanol solvate monohydrate","","- C29 H37 Cl O12 -","- C29 H37 Cl O12 -","- C116 H148 Cl4 O48 -","4","1","CI6649","Sammer Yousuf; M. Iqbal Choudhary; Atta-ur-Rahman; Shazia Anjum; Hoong-Kun Fun; Shamsher Ali","(5<i>R</i>,6<i>S</i>,8<i>S</i>,9<i>R</i>,14<i>R</i>,15<i>R</i>,17<i>R</i>,18<i>S</i>,21<i>S</i>,24<i>R</i>,26<i>S</i>,27<i>R</i>)-5α-Chloro-16,24-cyclo-13,14-secoergost-2-ene-18,26-dioic acid-14:17,14:27-diepoxy-6β,13,20,22-tetrahydroxy-1,15-dioxo-γ-lactone δ-lactone methanol solvate monohydrate","Acta Crystallographica Section E","2005","61","10","o3523","o3525","10.1107/S1600536805030011","","","0.71073","MoKα","","0.0359","0.0348","","","0.0937","0.0949","","","","","","0.847","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206915","6.2777","0.0016","34.562","0.009","9.321","0.002","90","","90.443","0.004","90","","2022.3","0.9","294","2","294","2","","","","","","","","3","C 1 c 1","C -2yc","9","","1-Ferrocenyl-1-(1H-indenyl)cycloheptane","","- C26 H28 Fe -","- C26 H28 Fe -","- C104 H112 Fe4 -","4","1","CI6650","Lin, Jin; Xu, Shan-Sheng; Song, Hai-Bin","1-Ferrocenyl-1-(1<i>H</i>-indenyl)cycloheptane","Acta Crystallographica Section E","2005","61","10","m2050","m2051","10.1107/S1600536805029302","","","0.71073","MoKα","","0.0498","0.036","","","0.0734","0.0797","","","","","","0.996","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206916","8.3222","0.0012","13.3871","0.0018","15.977","0.002","90","","90","","90","","1780","0.4","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H15 Cl3 N4 Zn -","- C15 H15 Cl3 N4 Zn -","- C60 H60 Cl12 N16 Zn4 -","4","1","CI6651","Wan, Xiang-Jian; Xu, Feng-Bo; Li, Qing-Shan; Song, Hai-Bin; Zhang, Zheng-Zhi","Trichloro[1,3-bis(2-pyridylmethyl)imidazolium]zinc(II)","Acta Crystallographica Section E","2005","61","10","m2174","m2175","10.1107/S1600536805029971","","","0.71073","MoKα","","0.0668","0.0366","","","0.0551","0.0623","","","","","","0.985","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206917","23.27","0.002","4.7","0.0002","18.96","0.0019","90","","119.44","0.003","90","","1805.9","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H20 N2 O4 -","- C21 H20 N2 O4 -","- C84 H80 N8 O16 -","4","0.5","CI6652","Dai, Yu-Mei; Shen, Hui-Ying; Huang, Jin-Feng","Terephthalic acid‒1,3-di-4-pyridylpropane (1/1)","Acta Crystallographica Section E","2005","61","10","o3410","o3411","10.1107/S160053680502996X","","","0.71073","MoKα","","","0.0427","","","0.1137","0.1196","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206918","6.9215","0.0013","7.7539","0.0016","15.797","0.003","90","","91.858","0.003","90","","847.4","0.3","294","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","","5-N-n-propyl-2-(2'-nitro benzenesulphonyl)glutamine","","- C14 H19 N3 O7 S -","- C14 H19 N3 O7 S -","- C28 H38 N6 O14 S2 -","2","1","CI6653","Xiao, Yong-Jun; Wang, Jian-Guo; Li, Zheng-Ming; Song, Hai-Bin","<i>N</i>^2^-(2-Nitrophenylsulfonyl)-<i>N</i>^5^-<i>n</i>-propylglutamine","Acta Crystallographica Section E","2005","61","10","o3461","o3463","10.1107/S1600536805030114","","","0.71073","MoKα","","0.0347","0.0287","","","0.0645","0.0685","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206919","7.9912","0.0016","8.8615","0.0018","10.399","0.002","81.37","0.03","71.64","0.03","72.01","0.03","663.6","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-nitrato-κ^4^O:O'-bis[bis(3-hydroxypyridine-κN)silver(I)] dihydrate","","- C10 H12 Ag N3 O6 -","- C10 H12 Ag N3 O6 -","- C20 H24 Ag2 N6 O12 -","2","1","CI6654","Lu, Zhen-Zhong; Gao, Shan; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Di-μ-nitrato-κ^4^<i>O</i>:<i>O</i>'-bis[bis(3-hydroxypyridine-κ<i>N</i>)silver(I)] dihydrate","Acta Crystallographica Section E","2005","61","10","m2151","m2153","10.1107/S1600536805030710","","","0.71073","MoKα","","0.0352","0.0268","","","0.0646","0.0678","","","","","","1.035","","","","has coordinates,has Fobs","198783","2020-10-21","18:00:00",""
"2206920","18.301","0.002","12.1788","0.0015","10.8967","0.0014","90","","93.001","0.002","90","","2425.4","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Methoxycarbonyl succinanilic acid","","- C12 H13 N O5 -","- C12 H13 N O5 -","- C96 H104 N8 O40 -","8","1","CI6655","Shazia Anjum; M. Iqbal Choudhary; Shamsher Ali; Hoong-Kun Fun; Atta-ur-Rahman","2-(Methoxycarbonyl)succinanilic acid","Acta Crystallographica Section E","2005","61","10","o3520","o3522","10.1107/S1600536805029703","","","0.71073","MoKα","","0.0458","0.0419","","","0.1087","0.1129","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206921","16.0863","0.001","11.005","0.0007","16.5816","0.0011","90","","111.981","0.001","90","","2722.1","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N,N'N'-Tetraphenyl-2,2'-(o-phenylenedioxy)diacetamide","","- C34 H28 N2 O4 -","- C34 H28 N2 O4 -","- C136 H112 N8 O16 -","4","0.5","CI6656","Yong-Hong Wen; Mao-Jie Li; Shu-Sheng Zhang; Xue-Mei Li","<i>N</i>,<i>N</i>,<i>N</i>'<i>N</i>'-Tetraphenyl-2,2'-(<i>o</i>-phenylenedioxy)diacetamide","Acta Crystallographica Section E","2005","61","10","o3373","o3374","10.1107/S1600536805029697","","","0.71073","MoKα","","0.0493","0.0419","","","0.1005","0.1055","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206922","8.605","0.005","8.981","0.005","9.974","0.005","107.615","0.005","103.543","0.005","94.952","0.005","703.9","0.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(Z)-ethyl 4-chloro-2-(2-(2-methoxyphenyl)hydrazono)-3-oxobutanoate","","- C13 H15 Cl N2 O4 -","- C13 H15 Cl N2 O4 -","- C26 H30 Cl2 N4 O8 -","2","1","CI6657","Alpaslan, Gökhan; Özdamar, Özgür; Odabaşoglu, Mustafa; Ersanlı, Cem Cüneyt; Erdönmez, Ahmet; Ocak Ískeleli, Nazan","(<i>Z</i>)-Ethyl 4-chloro-2-[2-(2-methoxyphenyl)hydrazono]-3-oxobutanoate","Acta Crystallographica Section E","2005","61","10","o3442","o3444","10.1107/S1600536805030163","","","0.71069","MoKα","","0.062","0.04","","","0.107","0.117","","","","","","1.03","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2206923","19.313","0.008","7.007","0.004","20.998","0.004","90","0.03","107.5","0.02","90","0.05","2710","2","292","2","292","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","3,6-Bis(p-chlorophenyl)-1,4-bis(p-tolylsulfonyl)-1,4-dihydro-1,2,4,5-tetrazine","","- C28 H22 Cl2 N4 O4 S2 -","- C28 H22 Cl2 N4 O4 S2 -","- C112 H88 Cl8 N16 O16 S8 -","4","0.5","CV6561","Wei-Xiao Hu; Lu-Ping Lv; Feng Xu; Hai-Bo Shi","3,6-Bis(<i>p</i>-chlorophenyl)-1,4-bis(<i>p</i>-tolylsulfonyl)-1,4-dihydro-1,2,4,5-tetrazine","Acta Crystallographica Section E","2005","61","10","o3152","o3153","10.1107/S1600536805027510","","","0.71073","MoKα","","0.0577","0.036","","","0.0938","0.105","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206924","9.8529","0.0007","5.4011","0.0004","21.9132","0.0014","90","","103.233","0.003","90","","1135.18","0.14","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Nitrophenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C11 H10 N4 O3 -","- C11 H10 N4 O3 -","- C44 H40 N16 O12 -","4","1","CV6563","Jun Wan; Chun-Li Li; Xue-Mei Li; Shu-Sheng Zhang; Ping-Kai Ouyang","1-(4-Nitrophenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","10","o3394","o3395","10.1107/S1600536805028552","","","0.71073","MoKα","","0.0458","0.0409","","","0.1111","0.1157","","","","","","1.032","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206925","14.6209","0.0013","9.5899","0.0009","17.9541","0.0016","90","","107.701","0.002","90","","2398.2","0.4","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N-{2,3-diphenyl-6-[(Z)-phenylmethylidene]- 2-azabicyclo[2.2.2]oct-5-ylidene}-aniline","","- C32 H28 N2 -","- C32 H28 N2 -","- C128 H112 N8 -","4","1","CV6565","K. Ravikumar; B. Sridhar; M. Mahesh; V. V. Narayana Reddy","<i>N</i>-{6-[(<i>Z</i>)-Benzylidene]-2,3-diphenyl-2-azabicyclo[2.2.2]octan-5-ylidene}aniline","Acta Crystallographica Section E","2005","61","10","o3273","o3275","10.1107/S1600536805028849","","","0.71073","MoKα","","0.0654","0.0494","","","0.1242","0.1342","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206926","11.48349","0.00005","14.3208","0.00006","7.92477","0.00003","90","","90","","90","","1303.25","0.009","298","","298","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","disodium rhodizonate","Disodium 1,2,3,4-tetraoxo-5-cyclohexene-5,6-diolate","","- C6 Na2 O6 -","- C6 Na2 O6 -","- C48 Na16 O48 -","8","0.25","CV6566","Dinnebier, Robert E.; Nuss, Hanne; Jansen, Martin","Disodium rhodizonate: a powder diffraction study","Acta Crystallographica Section E","2005","61","10","m2148","m2150","10.1107/S1600536805030552","","","0.400094","","","","","","","","","","","1.3","","","","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206927","13.9126","0.0006","6.4708","0.0002","14.4664","0.0007","90","","103.134","0.002","90","","1268.28","0.09","293","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-Thiodibenzoic acid","","- C14 H10 O4 S -","- C14 H10 O4 S -","- C56 H40 O16 S4 -","4","1","CV6569","Yu-Mei Dai; Jin-Feng Huang; Hui-Ying Shen","2,2'-Thiodibenzoic acid","Acta Crystallographica Section E","2005","61","10","o3182","o3183","10.1107/S1600536805027820","","","0.71073","MoKα","","","0.0772","","","0.1453","0.1493","","","","","","1.332","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206928","8.8833","0.0007","9.8725","0.0008","9.9162","0.0008","103.055","0.002","110.397","0.002","97.351","0.002","773.45","0.11","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-bromo-bis{bromo[N-(8-quinolyl)-o-phenylenediamine- κ^3^N,N',N'']manganese(II)}","","- C30 H26 Br4 Mn2 N6 -","- C30 H26 Br4 Mn2 N6 -","- C30 H26 Br4 Mn2 N6 -","1","0.5","CV6571","Seewald, Oliver; Flörke, Ulrich; Henkel, Gerald","Di-μ-bromo-bis{bromo[<i>N</i>-(8-quinolyl)-<i>o</i>-phenylenediamine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']manganese(II)}","Acta Crystallographica Section E","2005","61","10","m1948","m1950","10.1107/S1600536805027716","","","0.71073","MoKα","","0.0456","0.0333","","","0.0664","0.0705","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206929","8.6216","0.0005","10.3055","0.0006","11.7758","0.0006","79.462","0.001","79.377","0.001","68.876","0.001","951.48","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl 11,2,3,3a-5a-hydroxy-1-methyl-10-oxo-4-phenyl 10H-indeno[1,2-b]furo[3,4-b]pyrrole-3a-carboxylate","","- C22 H21 N O5 -","- C22 H21 N O5 -","- C44 H42 N2 O10 -","2","1","CV6572","S. Selvanayagam; Anju Joy; D. Velmurugan; K. Ravikumar; R. Raghunathan","Methyl 11,2,3,3a-5a-hydroxy-1-methyl-10-oxo-4-phenyl 10<i>H</i>-indeno[1,2-<i>b</i>]furo[3,4-<i>b</i>]pyrrole-3a-carboxylate","Acta Crystallographica Section E","2005","61","10","o3383","o3385","10.1107/S1600536805029570","","","0.71073","MoKα","","0.048","0.0435","","","0.1263","0.1312","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206930","8.7035","0.0007","9.7426","0.0008","14.5212","0.0009","70.652","0.004","89.493","0.001","77.484","0.003","1131.52","0.15","293","2","273","2","","","","","","","","5","P -1","-P 1","2","","6,7-Dimethoxy-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine diethanol solvate","","- C21 H26 F3 N3 O4 -","- C21 H26 F3 N3 O4 -","- C42 H52 F6 N6 O8 -","2","1","CV6573","Xia, Min","6,7-Dimethoxy-<i>N</i>-[3-(trifluoromethyl)phenyl]quinazolin-4-amine ethanol disolvate","Acta Crystallographica Section E","2005","61","10","o3380","o3382","10.1107/S1600536805029521","","","0.71069","MoKα","","0.0749","0.0632","","","0.1711","0.1858","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206931","5.6858","0.0012","10.018","0.002","13.902","0.003","90","","109.841","0.004","90","","744.9","0.3","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(3-hydroxy-4-methoxybenzylidene)hydrazine","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C32 H32 N4 O8 -","2","0.5","CV6575","Duan, Xue-Min; Zheng, Peng-Wu; Wang, Wei","<i>N</i>,<i>N</i>'-Bis(3-hydroxy-4-methoxybenzylidene)hydrazine","Acta Crystallographica Section E","2005","61","10","o3449","o3451","10.1107/S1600536805030205","","","0.71073","MoKα","","0.059","0.0368","","","0.0893","0.1028","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206932","7.1737","0.001","8.2486","0.0012","12.1873","0.0017","91.418","0.002","106.157","0.002","99.4","0.002","681.5","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-(4-Chlorophenyl)-N'-(4-nitrobenzoyl)urea","","- C14 H10 Cl N3 O4 -","- C14 H10 Cl N3 O4 -","- C28 H20 Cl2 N6 O8 -","2","1","CV6577","Su, Bi-Quan","<i>N</i>-(4-Chlorophenyl)-<i>N</i>'-(4-nitrobenzoyl)urea","Acta Crystallographica Section E","2005","61","10","o3492","o3494","10.1107/S160053680503076X","","","0.71073","MoKα","","0.0411","0.0326","","","0.0843","0.0884","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206933","24.438","0.002","11.2315","0.001","13.8799","0.0012","90","","96.969","0.001","90","","3781.5","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ-Adipato-κ^4^O,O':O'',O'''-bis[aqua(2,9-dimethyl-1,10-phenanthroline- κ^2^N,N)nitratocadmium(II)] dihydrate","","- C34 H40 Cd2 N6 O14 -","- C34 H40 Cd2 N6 O14 -","- C136 H160 Cd8 N24 O56 -","4","0.5","CV6578","Cai-Feng Ding; Mei Zhu; Xue-Mei Li; Ping-Kai Ouyang; Shu-Sheng Zhang","μ-Adipato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''-bis[aqua(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>)nitratocadmium(II)] dihydrate","Acta Crystallographica Section E","2005","61","10","m2058","m2059","10.1107/S1600536805029533","","","0.71073","MoKα","","0.0301","0.0267","","","0.0661","0.0681","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206934","7.3814","0.0008","26.18","0.003","12.6488","0.0014","90","","105.739","0.002","90","","2352.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(4-bromobenzyl)pyridinium bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^S,S')platinate(III)","","- C20 H11 Br N5 Pt S4 -","- C20 H11 Br N5 Pt S4 -","- C80 H44 Br4 N20 Pt4 S16 -","4","1","CV6579","Y.-C. Chen; X.-M. Ren","β-Phase of 1-(4-bromobenzyl)pyridinium bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')platinate(III)","Acta Crystallographica Section E","2005","61","10","m2176","m2178","10.1107/S1600536805030849","","","0.71073","MoKα","","0.1077","0.0592","","","0.1238","0.1375","","","","","","0.924","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206935","18.296","0.004","18.296","0.004","15.728","0.003","90","","90","","90","","5264.8","1.9","298","2","298","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","Bis(benzimidazol-2-yl)methane","","- C15 H12 N4 -","- C15 H12 N4 -","- C240 H192 N64 -","16","1","CV6580","Gui-Yun Duan; Ya-Wei Sun; Jun-Zhi Liu; Jian-Wu Wang","Bis(benzimidazol-2-yl)methane","Acta Crystallographica Section E","2005","61","10","o3476","o3477","10.1107/S1600536805030229","","","0.71073","MoKα","","0.0555","0.0416","","","0.1159","0.1303","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206936","7.313","0.0013","25.231","0.004","8.4269","0.0015","90","","97.217","0.003","90","","1542.6","0.5","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(5-((1H-1,2,4-triazol-1-yl)methyl)-1,3,4-oxadiazol-2-ylthio)-1 -(2,4-dichlorophenyl)ethanone","","- C13 H9 Cl2 N5 O2 S -","- C13 H9 Cl2 N5 O2 S -","- C52 H36 Cl8 N20 O8 S4 -","4","1","CV6581","Xu, Liang-Zhong; Yu, Guan-Ping; Yin, Shu-Mei; Zhou, Kai; Yang, Shuang-Hua","2-{5-[(1<i>H</i>-1,2,4-Triazol-1-yl)methyl]-1,3,4-oxadiazol-2-ylthio}-1-(2,4-dichlorophenyl)ethanone","Acta Crystallographica Section E","2005","61","10","o3375","o3376","10.1107/S1600536805029806","","","0.71073","MoKα","","0.0705","0.0399","","","0.0845","0.0968","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206937","12.0798","0.0012","8.55","0.0006","21.424","0.002","90","","90.07","0.009","90","","2212.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 1-{4-[4,5-bis(methoxycarbonyl)-1,2,3-triazol-1- ylmethylcarbonyl]phenyl}-1H-pyrazole-3,4-dicarboxylate","","- C21 H19 N5 O9 -","- C21 H19 N5 O9 -","- C84 H76 N20 O36 -","4","1","CV6582","Sundar, T. V.; Parthasarathi, V.; Michael Bolte; Hunnur, Raveendra K.; Bharati Badami","Dimethyl 1-{4-[4,5-bis(methoxycarbonyl)-1,2,3-triazol-1-ylmethylcarbonyl]phenyl}-1<i>H</i>-pyrazole-3,4-dicarboxylate","Acta Crystallographica Section E","2005","61","10","o3482","o3484","10.1107/S1600536805030448","","","0.71073","MoKα","","0.032","0.0298","","","0.0714","0.0722","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206938","7.268","0.004","11.813","0.001","21.282","0.003","90","","90","","90","","1827.2","1","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3,6-Bis(4-chlorophenyl)-1-isobutyryl-1,4-dihydro-1,2,4,5-tetrazine","","- C18 H16 Cl2 N4 O -","- C18 H16 Cl2 N4 O -","- C72 H64 Cl8 N16 O4 -","4","1","DN6225","Guo-Wu Rao; Wei-Xiao Hu","3,6-Bis(4-chlorophenyl)-1-isobutyryl-1,4-dihydro-1,2,4,5-tetrazine","Acta Crystallographica Section E","2005","61","10","o3276","o3277","10.1107/S1600536805018519","","","0.71073","MoKα","","0.1658","0.0399","","","0.0879","0.1215","","","","","","0.988","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206939","6.91","0.005","7.09","0.005","9.27","0.005","101.86","0.05","98.36","0.05","90.51","0.05","439.4","0.5","295","","295","","","","","","","","","6","P -1","-P 1","2","Bis(cytosinium) hexachlorostannate(IV)","Bis(cytosinium) hexachlorostannate(IV)","","- C8 H12 Cl6 N6 O2 Sn -","- C8 H12 Cl6 N6 O2 Sn -","- C8 H12 Cl6 N6 O2 Sn -","1","0.5","DN6241","Bouacida, Sofiane; Hocine Merazig; Beghidja, Adel; Beghidja, Chahrazed","Bis(cytosinium) hexachlorostannate(IV)","Acta Crystallographica Section E","2005","61","10","m2072","m2074","10.1107/S1600536805029727","","","0.71073","MoKα","","0.046","0.0407","","","0.0954","0.0983","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206940","13.74","0.0005","14.6581","0.0007","15.9408","0.0006","90","","94.51","0.003","90","","3200.6","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(ethylenediamine)zinc(II) bis(2-sulfanilamidopyrimidine) trihydrate","","- C24 H40 N12 O7 S2 Zn -","- C24 H40 N12 O7 S2 Zn -","- C96 H160 N48 O28 S8 Zn4 -","4","1","DN6244","Işık, Şamil; Köysal, Yavuz; Yavuz, Metin; Heren, Zerrin; Vurucu, Leyla","<i>trans-</i>Diaquabis(ethylenediamine)zinc(II) 2-(sulfanilamido)pyrimidine monohydrate","Acta Crystallographica Section E","2005","61","10","m2066","m2068","10.1107/S1600536805029673","","","0.71073","MoKα","","0.0588","0.0413","","","0.1079","0.1149","","","","","","0.963","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206941","7.9614","0.0004","22.054","0.001","10.1707","0.0006","90","","101.747","0.002","90","","1748.38","0.16","293","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 4-(3-amino-2,4-dicyano-5,6,7,8-tetrahydronaphthalen-1-yl)benzoate","","- C20 H17 N3 O2 -","- C20 H17 N3 O2 -","- C80 H68 N12 O8 -","4","1","DN6248","Sun-Liang Cui; Feng-Yan Zhou; Xu-Feng Lin","Methyl 4-(3-amino-2,4-dicyano-5,6,7,8-tetrahydronaphthalen-1-yl)benzoate","Acta Crystallographica Section E","2005","61","10","o3198","o3199","10.1107/S1600536805027947","","","0.7107","MoKα","","0.0532","0.053","","","0.1345","0.1346","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206942","6.0904","0.0002","8.9171","0.0003","30.8699","0.0008","90","","93.147","0.001","90","","1673.98","0.09","295","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-(Benzyloxy)spiro[2H-1,3-benzoxazine-2,1'-cyclohexan]-4(3H)-one","","- C20 H21 N O3 -","- C20 H21 N O3 -","- C80 H84 N4 O12 -","4","1","DN6250","Shan-Zhong Jian; Ming Lei","7-(Benzyloxy)spiro[2<i>H</i>-1,3-benzoxazine-2,1'-cyclohexan]-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","10","o3252","o3253","10.1107/S160053680502845X","","","0.71073","MoKα","","","0.0393","","","","0.0857","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206943","7.691","0.002","8.73","0.002","8.959","0.002","98.69","0.01","99.18","0.01","91.19","0.01","586.4","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Dichloro[cyclopropyl(2-pyridylmethylene)amino]copper(II)","","- C9 H10 Cl2 Cu N2 -","- C9 H10 Cl2 Cu N2 -","- C18 H20 Cl4 Cu2 N4 -","2","1","DN6251","Miao, Jian-Ying","Dichloro[cyclopropyl(2-pyridylmethylene)amino]copper(II)","Acta Crystallographica Section E","2005","61","10","m1981","m1983","10.1107/S1600536805028473","","","0.71073","MoKα","","0.0353","0.034","","","0.0844","0.0852","","","","","","1.162","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206944","10.4397","0.0003","10.8046","0.0003","17.8259","0.0007","90","","92.5932","0.0012","90","","2008.65","0.11","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","9-(2-Acetoxyethoxymethyl)-2-formamido-6-(4-toluenesulfonyl)oxypurine","","- C18 H19 N5 O7 S -","- C18 H19 N5 O7 S -","- C72 H76 N20 O28 S4 -","4","1","DN6253","Belyakov, Sergey; Ikaunieks, Martins; Madre, Marina","9-(2-Acetoxyethoxymethyl)-2-formamido-6-(<i>p</i>-tolylsulfonyloxy)purine","Acta Crystallographica Section E","2005","61","10","o3452","o3454","10.1107/S1600536805030175","","","0.71073","MoKα","","0.0966","0.0563","","","0.1071","0.1294","","","","","","1.128","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206945","12.688","0.002","11.1649","0.0019","14.229","0.002","90","","112.861","0.002","90","","1857.4","0.5","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2E)-2-(3,5-Dimethoxyphenyl)-3-(4-ethoxy-3-iodophenyl)acrylic acid","","- C19 H19 I O5 -","- C19 H19 I O5 -","- C76 H76 I4 O20 -","4","1","DN6255","Chen, Kai; Adelstein, S. James; Kassis, Amin I.","(2<i>E</i>)-2-(3,5-Dimethoxyphenyl)-3-(4-ethoxy-3-iodophenyl)acrylic acid","Acta Crystallographica Section E","2005","61","10","o3517","o3519","10.1107/S1600536805030667","","","0.71073","MoKα","","0.0343","0.031","","","0.0647","0.0658","","","","","","1.201","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206946","9.385","0.002","9.84","0.002","11.246","0.002","66.22","0.03","77.23","0.03","61.85","0.03","837.4","0.4","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","2,6-Dibromophenyl acridine-9-carboxylate","","- C20 H11 Br2 N O2 -","- C20 H11 Br2 N O2 -","- C40 H22 Br4 N2 O4 -","2","1","ER6021","Artur Sikorski; Karol Krzymiński; Antoni Konitz; Jerzy Błażejowski","2,6-Dibromophenyl acridine-9-carboxylate","Acta Crystallographica Section E","2005","61","10","o3112","o3114","10.1107/S1600536805027145","","","0.71073","MoKα","","0.0791","0.0278","","","0.0649","0.0812","","","","","","0.85","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206947","7.264","0.0017","22.96","0.006","10.27","0.002","90","","92.985","0.003","90","","1710.5","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-(2-Ammoniophenylamino)ethanaminium hexachlorostannate(IV) monohydrate","","- C8 H17 Cl6 N3 O Sn -","- C8 H17 Cl6 N3 O Sn -","- C32 H68 Cl24 N12 O4 Sn4 -","4","1","FL6183","Hai-Tang Li; Rui Sun; He-Ping Shi; Shu-Ping Huang","2-(2-Ammoniophenylamino)ethanaminium hexachlorostannate(IV) monohydrate","Acta Crystallographica Section E","2005","61","10","m2088","m2089","10.1107/S1600536805029454","","","0.71073","MoKα","","0.0408","0.0341","","","0.0688","0.0714","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206948","5.5062","0.0013","16.119","0.003","11.939","0.003","90","","101.77","0.02","90","","1037.4","0.4","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(2-thienyl)quinoxaline","2-(2-thienyl)quinoxaline","","- C12 H8 N2 S -","- C12 H8 N2 S -","- C48 H32 N8 S4 -","4","1","FL6184","Crundwell, Guy; Stacy, Vanessa","2-(2-Thienyl)quinoxaline","Acta Crystallographica Section E","2005","61","10","o3159","o3160","10.1107/S1600536805027522","","","0.71073","MoKα","","0.0759","0.0451","","0.1478","0.112","0.112","","","","","","1.0022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206949","9.114","0.002","7.319","0.002","25.575","0.006","90","","98.66","0.02","90","","1686.5","0.7","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","O-Ethyl-S-[1-(3,4-dimethoxyphenyl)-2-oximinopropyl]dithiocarbonate","","- C14 H19 N O4 S2 -","- C14 H19 N O4 S2 -","- C56 H76 N4 O16 S8 -","4","1","FL6186","Hartung, Jens; Daniel, Kristina; Svoboda, Ingrid; Fuess, Hartmut","<i>O</i>-Ethyl <i>S</i>-[1-(3,4-dimethoxyphenyl)-2-(hydroxyimino)propyl] dithiocarbonate","Acta Crystallographica Section E","2005","61","10","o3437","o3439","10.1107/S1600536805029909","","","0.71073","MoKα","","0.1005","0.0709","","","0.1919","0.2196","","","","","","0.927","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206950","10.7528","0.0007","10.7528","0.0007","22.281","0.003","90","","90","","120","","2231","0.4","294","2","294","2","","","","","","","","6","R -3 :H","-R 3","148","","Hexakis(dimethyl sufoxide-κO)iron(III) tribromide","","- C12 H36 Br3 Fe O6 S6 -","- C12 H36 Br3 Fe O6 S6 -","- C36 H108 Br9 Fe3 O18 S18 -","3","0.166667","FL6188","Martínez-Alanis, Paulina R.; Toscano, Rubén A.; Castillo, Ivan","Hexakis(dimethyl sufoxide-κ<i>O</i>)iron(III) tribromide","Acta Crystallographica Section E","2005","61","10","m2179","m2180","10.1107/S1600536805030886","","","0.71073","MoKα","","0.0333","0.026","","","0.0649","0.0668","","","","","","0.993","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206951","13.257","0.002","13.564","0.001","14.831","0.004","108.15","0.01","113.34","0.01","101.43","0.01","2163","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","dodeca-μ~2~-hydroxo-di-μ~3~-oxo-hexakis(1,4,7-triazacyclononane- κ^3^N,N',N'')octairon(III) octabromide octahydrate","","- C36 H118 Br8 Fe8 N18 O22 -","- C36 H102 Br8.002 Fe8 N18 O22 -","- C36 H102 Br8.002 Fe8 N18 O22 -","1","0.5","HB6243","Mata, Ignasi; Rodríguez, E.; Molins, Elies","Dodeca-μ~2~-hydroxo-di-μ~3~-oxo-hexakis(1,4,7-triazacyclononane-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')octairon(III) octabromide octahydrate","Acta Crystallographica Section E","2005","61","10","m1988","m1990","10.1107/S1600536805028436","","","0.71073","MoKα","","0.1302","0.0589","","","0.1838","0.2094","","","","","","1.118","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206952","4.9331","0.0016","11.276","0.004","9.682","0.003","90","","90.018","0.001","90","","538.6","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diaquabis[malonato(1-)-κ^2^O,O']cobalt(II)","","- C6 H10 Co O10 -","- C6 H10 Co O10 -","- C12 H20 Co2 O20 -","2","0.5","HB6253","Wang, Zi-Liang; Wei, Lin-Heng; Niu, Jing-Yang","Diaquabis[malonato(1‒)-κ^2^<i>O</i>,<i>O</i>']cobalt(II)","Acta Crystallographica Section E","2005","61","10","m1907","m1908","10.1107/S1600536805027157","","","0.71073","MoKα","","0.0338","0.0308","","","0.0744","0.0767","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206953","9.0676","0.0001","12.9618","0.0002","17.9351","0.0003","84.998","0.001","80.8","0.001","84.19","0.001","2064.73","0.05","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","Diaquatris(nicotinato-kO)bis(1,10-phenanthroline-k^2^N,N')lanthanum(III) trihydrate","","- C42 H38 La N7 O11 -","- C42 H38 La N7 O11 -","- C84 H76 La2 N14 O22 -","2","1","HB6254","Ping Wang; Yong Xiao; Zhi-Feng Li","Diaquatris(nicotinato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')lanthanum(III) trihydrate","Acta Crystallographica Section E","2005","61","10","m1902","m1903","10.1107/S160053680502725X","","","0.71073","MoKα","","0.0237","0.0204","","","0.0532","0.0542","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206954","13.0985","0.0004","10.7801","0.0004","17.0783","0.0006","90","","102.44","0.003","90","","2354.89","0.14","297","1","297","1","","","","","","","","6","P 1 21 1","P 2yb","4","","Bis[(S,S)-1,2-dimethoxy-1,2-bis(1-methyl-1H-benzimidazol-2- yl)ethane]palladium(II) dichloride","","- C40 H44 Cl2 N8 O4 Pd -","- C40 H44 Cl1.05 N8 O4 Pd -","- C80 H88 Cl2.1 N16 O8 Pd2 -","2","1","HB6256","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","Bis[(<i>S</i>,<i>S</i>)-1,2-dimethoxy-1,2-bis(1-methyl-1<i>H</i>-benzimidazol-2-yl)ethane]palladium(II) dichloride","Acta Crystallographica Section E","2005","61","10","m1991","m1994","10.1107/S1600536805028242","","","0.71073","MoKα","","0.0526","0.0509","","","0.1539","0.1565","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206955","7.9496","0.001","8.9222","0.0011","8.9747","0.0015","84.202","0.015","64.013","0.012","81.677","0.012","565.66","0.15","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Hexapotassium di-μ-dioxosulfato-bis[tetracyanoosmate(III)](Os—Os) dihydrate","","- C8 H4 K6 N8 O6 Os2 S2 -","- C8 H4 K6 N8 O6 Os2 S2 -","- C8 H4 K6 N8 O6 Os2 S2 -","1","0.5","HB6257","Yanko, Oleg G.; Kharkova, Lyudmyla B.; Pekhnyo, Vasyl I.; Volkov, Serhii V.; Naumov, Dmitry Y.; Mironov, Yuri V.","Hexapotassium di-μ-dioxosulfato-bis[tetracyanoosmate(III)](<i>Os{—</i>Os}) dihydrate","Acta Crystallographica Section E","2005","61","10","i211","i212","10.1107/S1600536805027534","","","0.71073","MoKα","","0.0241","0.0206","","","0.0532","0.0538","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206956","9.3455","0.0013","12.2596","0.0013","21.3592","0.0019","90","","90","","90","","2447.2","0.5","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[tris(1H-benzimidazole-κN^3^)manganese(II)]-μ-maleato- κ^3^O,O':κO'']","","- C25 H20 Mn N6 O4 -","- C25 H20 Mn N6 O4 -","- C100 H80 Mn4 N24 O16 -","4","1","HB6259","Zi-Qiang Hu; Yong Ni; Guo-Qiao Lai","<i>catena</i>-Poly[[tris(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)manganese(II)]-μ-maleato-κ^2^<i>O</i>,<i>O</i>':κ<i>O</i>'']","Acta Crystallographica Section E","2005","61","10","m1975","m1977","10.1107/S1600536805028333","","","0.71073","MoKα","","0.051","0.038","","","0.09","0.106","","","","","","1.179","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206957","17.319","0.002","7.2711","0.0007","17.8495","0.0018","90","","115.002","0.003","90","","2037.1","0.4","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[bis(1H-benzimidazole-κN^3^)cobalt(II)]- μ-terephthalato-κ^3^O^1^,O^1'^:O^4^]","","- C22 H16 Co N4 O4 -","- C22 H16 Co N4 O4 -","- C88 H64 Co4 N16 O16 -","4","1","HB6260","Tian-Tian Pan; Jian-Rong Su; Duan-Jun Xu","<i>catena</i>-Poly[[bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cobalt(II)]-μ-terephthalato-κ^3^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^4^]","Acta Crystallographica Section E","2005","61","10","m1928","m1930","10.1107/S1600536805027765","","","0.71073","MoKα","","0.066","0.048","","","0.121","0.131","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206958","8.4969","0.0012","13.6406","0.0019","18.179","0.003","90","","91.005","0.002","90","","2106.7","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Hexakis(4-nitropyridine N-oxide-κN^1^)cobalt(II) bis(perchlorate)","","- C30 H24 Cl2 Co N12 O26 -","- C30 H24 Cl2 Co N12 O26 -","- C60 H48 Cl4 Co2 N24 O52 -","2","0.5","HB6261","Shi, Jing Min; Chen, Ju Na; Liu, Lian Dong","Hexakis(4-nitropyridine <i>N</i>-oxide-κ<i>N</i>^1^)cobalt(II) bis(perchlorate)","Acta Crystallographica Section E","2005","61","10","m1935","m1936","10.1107/S1600536805027807","","","0.71073","MoKα","","0.0733","0.0667","","","0.1757","0.1808","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206959","13.1183","0.0005","14.2581","0.0006","13.1854","0.0005","90","","113.563","0.001","90","","2260.59","0.16","295","2","295","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Bis[hexaaquacadmium(II)] 25,26,27,28-tetrahydroxy-2,8,14,19-tetrathiacalix[4]arene-5,11,17,23- tetrasulfonate monohydrate clathrate","","- C24 H38 Cd2 O29 S8 -","- C24 H38 Cd2 O29 S8 -","- C48 H76 Cd4 O58 S16 -","2","0.5","HB6262","Pu-Zhou Hu; Jian-Ge Wang; Lu-Fang Ma; Li-Ya Wang; Seik Weng Ng","Bis[hexaaquacadmium(II)] 25,26,27,28-tetrahydroxy-2,8,14,19-tetrathiacalix[4]arene-5,11,17,23-tetrasulfonate monohydrate clathrate","Acta Crystallographica Section E","2005","61","10","m1957","m1959","10.1107/S1600536805028151","","","0.71073","MoKα","","0.042","0.041","","","0.129","0.13","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206960","19.758","0.004","13.58","0.003","11.587","0.003","90","","115.739","0.003","90","","2800.5","1.1","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H30 Hg N8 O8 S2 -","- C20 H30 Hg N8 O8 S2 -","- C80 H120 Hg4 N32 O32 S8 -","4","0.5","HB6265","Jiu-Li Chang; Li-Ya Wang; Kai Jiang","Bis[1-hydroxy-4,4,5,5-tetramethyl-2-(1,3-thiazol-2-yl-κ<i>N</i>)-2,3-dihydro-1<i>H</i>-imidazole-κ<i>N</i>^3^]dinitratomercury(II)","Acta Crystallographica Section E","2005","61","10","m2100","m2102","10.1107/S1600536805030060","","","0.71073","MoKα","","0.0282","0.0197","","","0.0503","0.0559","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206961","11.1137","0.0002","13.0414","0.0003","13.8382","0.0003","79.1515","0.001","68.8106","0.001","79.7017","0.0009","1823.18","0.07","150","1","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H47 Fe N8 O11 -","- C33 H47 Fe N8 O11 -","- C66 H94 Fe2 N16 O22 -","2","1","HB6268","Tam, Tim F.; Leung-Toung, Regis; Wang, Yingsheng; Spino, Michael; Williams, Glenn; Lough, Alan J.","Tris(2-<i>N</i>-methylaminocarbonyl-3-hydroxy-1,6-dimethyl-1,4-dihydro-4-pyridinonato)iron(III) dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","10","m2055","m2057","10.1107/S1600536805029776","","","0.71073","MoKα","","0.0757","0.0467","","","0.1107","0.1256","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206962","10.139","0.003","10.649","0.004","12.138","0.003","95.34","0.03","94.11","0.02","113.05","0.02","1192.3","0.7","295","2","295","2","","","","","","","","6","P -1","-P 1","2","([1.5]Dibenzo-18-crown-6-κ^6^)potassium chlorochromate","(6,7,9,10,12,13,15,16- octahydrodibenzo[b,e][1,4,7,10,13,16] hexaoxacyclooctadecine)potassium chlorochromate","","- C20 H24 Cl Cr K O9 -","- C20 H24 Cl Cr K O9 -","- C40 H48 Cl2 Cr2 K2 O18 -","2","1","HB6269","Kotlyar, Sergei A.; Zubatyuk, Roman I.; Shishkin, Oleg V.; Chuprin, Gennady N.; Kiriyak, Andrey V.; Kamalov, Gerbert L.","([1.5]Dibenzo-18-crown-6)potassium chlorochromate","Acta Crystallographica Section E","2005","61","10","m2163","m2165","10.1107/S1600536805030151","","","0.71073","MoKα","","0.1141","0.0676","","","0.1803","0.1969","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206963","7.5796","0.0015","19.255","0.004","17.201","0.004","90","","100.509","0.004","90","","2468.3","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","catena-Poly[bis(ethylenediamine-κ^2^N,N')copper(II) (2,3-dimercaptobutenedinitrile-κ^2^S,S')(2,3-dimercaptobutenedinitrile- κ^4^S,S',N,N')cuprate(II)]","","- C28 H52 Cd2 N20 Ni2 O2 S8 -","- C28 H52 Cd2 N20 Ni2 O2 S8 -","- C56 H104 Cd4 N40 Ni4 O4 S16 -","2","0.5","HB6270","Fu, Ai-Yun; Wang, Da-Qi; Jian-Xin Xing","<i>catena</i>-Poly[tris(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')nickel(II) [cadmium(II)-di-μ-1,2-dicyanoethylenedithiolato-κ^3^<i>S</i>,<i>S</i>':<i>S</i>'] monohydrate]","Acta Crystallographica Section E","2005","61","10","m2115","m2117","10.1107/S1600536805030291","","","0.71073","MoKα","","0.1189","0.051","","","0.0752","0.0829","","","","","","0.999","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2206964","12.2152","0.0004","10.312","0.0002","19.3617","0.0004","90","","91.257","0.001","90","","2438.27","0.11","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(1H-benzimidazole-κN^3^)(oxydiacetate-κ^3^O,O',O'')cobalt(II)","","- C25 H22 Co N6 O5 -","- C25 H22 Co N6 O5 -","- C100 H88 Co4 N24 O20 -","4","1","HB6272","Lei Cao; Duan-Jun Xu","Tris(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')cobalt(II)","Acta Crystallographica Section E","2005","61","10","m2127","m2129","10.1107/S1600536805030126","","","0.71073","MoKα","","0.07","0.041","","","0.1","0.114","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206965","11.042","0.002","9.487","0.002","17.796","0.002","90","","95.635","0.01","90","","1855.2","0.6","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(1,2-Benzenediolato-κ^2^O,O')((2,2'-biquinoline-κ^2^N,N')palladium(II)","","- C24 H16 N2 O2 Pd -","- C24 H16 N2 O2 Pd -","- C96 H64 N8 O8 Pd4 -","4","1","HB6273","Okabe, Nobuo; Aziyama, Toshihiko; Odoko, Mamiko","(1,2-Benzenediolato-κ^2^<i>O</i>,<i>O</i>')(2,2'-biquinoline-κ^2^<i>N</i>,<i>N</i>')palladium(II)","Acta Crystallographica Section E","2005","61","10","m2154","m2156","10.1107/S160053680503062X","","","0.7107","MoKα","","","0.0323","","","","0.0887","","","","","","1.068","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206966","10.4582","0.0016","12.8031","0.0019","21.161","0.003","90","","99.308","0.002","90","","2796.1","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","bis(μ-diethyl 5,6,7,8,15,16-hexahydro-6,7-dioxo-5,8,14,17- tetraazadibenzo[a,g]cyclotetradecine-13,18- dicarboxylate)-1κ^4^N:2κ^2^O^6^,O^7^;2κO^6^,O^7^:3κ^4^N- dimethanoldinickel(II)zinc(II) bis(perchlorate)","","- C50 H52 Cl2 N8 Ni2 O22 Zn -","- C50 H52 Cl2 N8 Ni2 O22 Zn -","- C100 H104 Cl4 N16 Ni4 O44 Zn2 -","2","0.5","HG6213","Li, Xiao-Zeng; He, Jun-Hong; Zhang, Wen-Qin; Liu, Bao-Lin","A new heterotrinuclear macrocyclic complex: bis(μ-diethyl 5,6,7,8,15,16-hexahydro-6,7-dioxo-5,8,14,17-tetraazadibenzo[<i>a</i>,<i>g</i>]cyclotetradecine-13,18-dicarboxylato)-1κ^4^<i>N</i>:2κ^2^<i>O</i>^6^,<i>O</i>^7^;2κ<i>O</i>^6^,<i>O</i>^7^:3κ^4^<i>N</i>-dimethanoldinickel(II)zinc(II) bis(perchlorate)","Acta Crystallographica Section E","2005","61","10","m2018","m2020","10.1107/S160053680502828X","","","0.71073","MoKα","","0.0468","0.0365","","","0.0997","0.1055","","","","","","1.066","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206967","11.252","0.003","13.999","0.004","11.315","0.003","90","","116.227","0.004","90","","1598.8","0.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[silver(I)-μ-1-phenylsulfanyl-2-(2-pyridylsulfanyl)ethane- κ^2^S^1^:N^2^] tetrafluoroborate]","","- C13 H13 Ag B F4 N S2 -","- C13 H13 Ag B F4 N S2 -","- C52 H52 Ag4 B4 F16 N4 S8 -","4","1","HG6219","Xie, Chuang; Zhou, Li-Na; Hou, Bao-Hong; Wang, Jing-Kang; Chen, Wei","<i>catena</i>-Poly[[silver(I)-μ-1-phenylsulfanyl-2-(2-pyridylsulfanyl)ethane-κ^2^<i>S</i>^1^:<i>N</i>^2^] tetrafluoroborate]","Acta Crystallographica Section E","2005","61","10","m2095","m2096","10.1107/S1600536805025146","","","0.71073","MoKα","","0.0637","0.0361","","","0.0777","0.0877","","","","","","0.989","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206968","16.1964","0.0009","8.0465","0.0004","22.5076","0.0013","90","","90","","90","","2933.3","0.3","273","2","273","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis[2-(1H-benzimidazol-2-yl)phenolato]copper(II) dimethylformamide disolvate","","- C32 H32 Cu N6 O4 -","- C32 H32 Cu N6 O4 -","- C128 H128 Cu4 N24 O16 -","4","0.5","HG6221","Xi, Yun; Li, Jun; Zhang, Fengxing","Bis[2-(1<i>H</i>-benzimidazol-2-yl)phenolato]copper(II) dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","10","m1953","m1954","10.1107/S1600536805027844","","","0.71073","MoKα","","0.0805","0.0425","","","0.1012","0.1153","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206969","17.229","0.002","15.363","0.003","27.639","0.005","90","","93.3","0.15","90","","7304","2","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","Tetrakis(μ~3~-thiourea)bis(μ~2~-thiourea)octakis(thiourea)hexacopper(I) hexaperchlorate","","- C14 H56 Cl6 Cu6 N28 O24 S14 -","- C14 H56 Cl6 Cu6 N28 O24 S14 -","- C56 H224 Cl24 Cu24 N112 O96 S56 -","4","1","HG6222","S. Athimoolam; J. Kumar; V. Ramakrishnan; R. K. Rajaram","Tetrakis(μ~3~-thiourea)bis(μ~2~-thiourea)octakis(thiourea)hexacopper(I) hexakis(perchlorate)","Acta Crystallographica Section E","2005","61","10","m2014","m2017","10.1107/S1600536805028588","","","0.71073","MoKα","","0.0569","0.0385","","","0.1016","0.1104","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206970","6.8627","0.0016","7.9031","0.0019","27.01","0.006","90","","95.406","0.004","90","","1458.4","0.6","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(Z)-(1-Naphthyl)methylene]benzimidazo[2,1-b]thiazol-3(2H)-one","","- C20 H12 N2 O S -","- C20 H12 N2 O S -","- C80 H48 N8 O4 S4 -","4","1","HG6233","Liang, Zu-Pei; Li, Jian; Li, Gao-Ning; Cao, Chang-Qing; Wang, Guang-Jian","2-[(<i>Z</i>)-(1-Naphthyl)methylene]benzimidazo[2,1-<i>b</i>]thiazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","10","o3166","o3167","10.1107/S1600536805027613","","","0.71073","MoKα","","0.1088","0.0488","","","","0.1091","","","","","","0.945","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206971","12.3847","0.0003","7.4853","0.0004","12.3351","0.0003","90","","128.764","0.004","90","","891.63","0.08","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","10-(3-Acetamidobenzylidene)anthrone","","- C23 H17 N O2 -","- C23 H17 N O2 -","- C46 H34 N2 O4 -","2","1","HG6234","Zhou, Wei; Hu, Wei-Xiao; Xia, Chun-Nian; Chen, Min-Qin","10-(3-Acetamidobenzylidene)anthrone","Acta Crystallographica Section E","2005","61","10","o3170","o3171","10.1107/S1600536805027601","","","0.71073","MoKα","","0.0762","0.0506","","","0.11","0.1505","","","","","","1.102","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206972","7.776","0.0011","16.453","0.0016","16.622","0.0016","90","","99.31","0.03","90","","2098.6","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","5-(2,4-Dichlorobenzamido)-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]- 1H-pyrazole-3-carbonitrile","","- C18 H7 Cl4 F3 N4 O -","- C18 H7 Cl4 F3 N4 O -","- C72 H28 Cl16 F12 N16 O4 -","4","1","HG6237","Zhong, Ping; Zhang, Xiao-Hong; Xiao, Hong-Ping; Hu, Mao-Lin","5-(2,4-Dichlorobenzamido)-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","10","o3110","o3111","10.1107/S1600536805027054","","","0.71073","MoKα","","0.1055","0.0925","","","0.2336","0.244","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206973","7.017","0.002","23.873","0.002","8.118","0.003","90","","100.3","0.03","90","","1338","0.6","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Benzene-1,2-diolato-κ^2^O,O')(2,2'-bipyridine-κ^2^N,N')palladium(II)","","- C16 H12 N2 O2 Pd -","- C16 H12 N2 O2 Pd -","- C64 H48 N8 O8 Pd4 -","4","1","HG6238","Okabe, Nobuo; Aziyama, Toshihiko; Odoko, Mamiko","(Benzene-1,2-diolato-κ^2^<i>O</i>,<i>O</i>')(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')palladium(II)","Acta Crystallographica Section E","2005","61","10","m1943","m1945","10.1107/S1600536805027704","","","0.7107","MoKα","","","0.0428","","","","0.1359","","","","","","1.211","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206974","10.672","0.001","6.301","0.002","15.091","0.001","90","","100.567","0.009","90","","997.6","0.3","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Bis(isoquinoline-3-carboxylato-κ^2^N,O)bis(methanol-κO)zinc(II)","","- C22 H20 N2 O6 Zn -","- C22 H20 N2 O6 Zn -","- C44 H40 N4 O12 Zn2 -","2","0.5","HG6240","Okabe, Nobuo; Muranishi, Yasunori; Mamiko, Odoko","<i>trans</i>-Bis(isoquinoline-3-carboxylato-κ^2^<i>N</i>,<i>O</i>)bis(methanol-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2005","61","10","m1946","m1947","10.1107/S1600536805027698","","","0.7107","MoKα","","","0.0328","","","","0.0862","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206975","9.461","0.002","8.3944","0.0017","14.601","0.003","90","","94.069","0.004","90","","1156.7","0.4","292","2","292","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Tetraethyl 2,2'-(p-phenylenedimethylene)dimalonate","","- C22 H30 O8 -","- C22 H30 O8 -","- C44 H60 O16 -","2","0.5","HG6241","Ai-Hua Chen; Zhi-Guo Wang; Guo-Dong Yin; An-Xin Wu","Tetraethyl 2,2'-(<i>p</i>-phenylenedimethylene)dimalonate","Acta Crystallographica Section E","2005","61","10","o3240","o3241","10.1107/S1600536805028126","","","0.71073","MoKα","","0.0796","0.0663","","","0.1817","0.1968","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206976","4.7016","0.0006","10.1325","0.0014","26.273","0.003","90","","90","","90","","1251.6","0.3","296","1","296","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4-Hexylaminophenol","4-(n-Hexylamino)phenol","","- C12 H19 N O -","- C12 H19 N O -","- C48 H76 N4 O4 -","4","1","HG6242","Herrera, Ana M.; Bernès, Sylvain; López, Delia","4-(Hexylamino)phenol","Acta Crystallographica Section E","2005","61","10","o3210","o3211","10.1107/S1600536805027868","","","0.71073","MoKα","","0.0866","0.0531","","","0.1389","0.1703","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206977","5.4659","0.001","13.6278","0.0019","32.124","0.004","90","","90","","90","","2392.9","0.6","296","2","296","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","4-Hexyloxyphenylamine","4-(n-Hexyloxy)aniline","","- C12 H19 N O -","- C12 H19 N O -","- C96 H152 N8 O8 -","8","1","HG6243","Herrera, Ana M.; Bernès, Sylvain; López, Delia","4-(Hexyloxy)aniline","Acta Crystallographica Section E","2005","61","10","o3212","o3213","10.1107/S160053680502787X","","","0.71073","MoKα","","0.1079","0.0501","","","0.1173","0.1494","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206978","10.9022","0.0007","17.636","0.001","16.8688","0.0008","90","","92.795","0.002","90","","3239.5","0.3","295","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-(2-Bromobutanoyl)spiro[2H-1,3-benzoxazine-2,1'-cyclohexan]-4(3H)-one","","- C17 H20 Br N O3 -","- C17 H20 Br N O3 -","- C136 H160 Br8 N8 O24 -","8","1","HG6244","Shan-Zhong Jian; Ming Lei","3-(2-Bromobutanoyl)spiro[2<i>H</i>-1,3-benzoxazine-2,1'-cyclohexan]-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","10","o3196","o3197","10.1107/S1600536805027881","","","0.71069","MoKα","","","0.0358","","","","0.0957","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206979","14.829","0.003","7.3472","0.0014","13.713","0.003","90","","95.313","0.003","90","","1487.6","0.5","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Methylpiperazin-1-ium 2-amino-5-iodobenzoate","","- C12 H18 I N3 O2 -","- C12 H18 I N3 O2 -","- C48 H72 I4 N12 O8 -","4","1","HG6245","Zhu, Mu-Lan; Guo, Ming-Lin","4-Methylpiperazin-1-ium 2-amino-5-iodobenzoate","Acta Crystallographica Section E","2005","61","10","o3310","o3311","10.1107/S1600536805029077","","","0.71073","MoKα","","0.066","0.0322","","","0.0721","0.088","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206980","7.146","0.004","17.906","0.009","21.697","0.011","90","","90","","90","","2776","3","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","5-((1H-1,2,4-triazol-1-yl)methyl)-4-(4-fluorobenzylideneamino)-2H- 1,2,4-triazole-3(4H)-thione","","- C12 H10 F N7 S -","- C12 H10 F N7 S -","- C96 H80 F8 N56 S8 -","8","1","HG6247","Yang, Xiu-Ying; Shang, Yu-Qing; Yu, Guan-Ping; Zhang, Pu-Yong; Li, Wei-Hua; Hou, Bao-Rong","5-[(1<i>H</i>-1,2,4-Yriazol-1-yl)methyl]-4-(4-fluorobenzylideneamino)-2<i>H</i>-1,2,4-triazole-3(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","10","o3371","o3372","10.1107/S1600536805029715","","","0.71073","MoKα","","0.0978","0.0441","","","0.0909","0.1108","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206981","9.5474","0.0012","14.1858","0.0018","18.802","0.002","90","","96.224","0.002","90","","2531.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","di-μ-acetato-κ^4^O:O'-bis[bis(1,10-phenanthroline-κ^2^N,N')manganese(II)] bis(perchlorate)","","- C52 H38 Cl2 Mn2 N8 O12 -","- C52 H38 Cl2 Mn2 N8 O12 -","- C104 H76 Cl4 Mn4 N16 O24 -","2","0.5","IS6113","Xueli Niu; Jianmin Dou; Changwen Hu; Dacheng Li; Daqi Wang","A binuclear manganese(II) complex: di-μ-acetato-κ^4^<i>O</i>:<i>O</i>'-bis[bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)] bis(perchlorate)","Acta Crystallographica Section E","2005","61","10","m1909","m1911","10.1107/S1600536805027479","","","0.71073","MoKα","","0.0529","0.0436","","","0.1238","0.1321","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206982","6.765","0.0006","23.8952","0.0019","12.0094","0.001","90","","105.67","0.001","90","","1869.2","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-Ethyl 3,4-dimethyl 4'-methylbiphenyl-2,3,4-tricarboxylate","","- C20 H20 O6 -","- C20 H20 O6 -","- C80 H80 O24 -","4","1","IS6115","Sundari Bhaskaran; D. Velmurugan; K. Ravikumar; A. K. Mohana Krishnan; C. Prakash","2-Ethyl 3,4-dimethyl 4'-methylbiphenyl-2,3,4-tricarboxylate","Acta Crystallographica Section E","2005","61","10","o3339","o3341","10.1107/S1600536805029090","","","0.71073","MoKα","","0.0941","0.0743","","","0.2014","0.217","","","","","","1.094","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206983","7.651","0.001","28.146","0.004","10.977","0.0014","90","","103.214","0.002","90","","2301.3","0.5","292","2","292","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","rac-Diethyl 2,3-bis(2-methoxybenzoyl)succinate","","- C24 H26 O8 -","- C24 H26 O8 -","- C96 H104 O32 -","4","1","IS6116","Meng, Xiang-gao; Wu, An-Xin","<i>rac</i>-Diethyl 2,3-bis(2-methoxybenzoyl)succinate","Acta Crystallographica Section E","2005","61","10","o3203","o3204","10.1107/S1600536805027856","","","0.71073","MoKα","","0.0908","0.0654","","","0.1625","0.1771","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206984","7.366","0.0015","12.422","0.003","14.785","0.003","90","","96.699","0.002","90","","1343.6","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2'-(4-Methoxybenzylidene)isonicotinohydrazide monohydrate","","- C14 H15 N3 O3 -","- C14 H15 N3 O3 -","- C56 H60 N12 O12 -","4","1","IS6117","Zuo-Liang Jing; Zhi Fan; Ming Yu; Xin Chen; Qi-Liang Deng","2'-(4-Methoxybenzylidene)isonicotinohydrazide monohydrate","Acta Crystallographica Section E","2005","61","10","o3208","o3209","10.1107/S1600536805027959","","","0.71073","MoKα","","0.0438","0.0341","","","0.0918","0.0971","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206985","8.826","0.004","10.608","0.005","11.619","0.005","64.982","0.007","83.064","0.008","83.425","0.007","976.1","0.8","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","N-benzylidene-4-(ferrocenyl)-5-(1H-1,2,4-triazol-1-yl)-1,3-thiazol-2-amine","","- C22 H17 Fe N5 S -","- C22 H17 Fe N5 S -","- C44 H34 Fe2 N10 S2 -","2","1","IS6118","Hai-Bo Yu; Ling Shao; Zhong Jin; Jian-Bing Liu; Jian-Xin Fang","<i>N</i>-Benzylidene-4-(ferrocenyl)-5-(1<i>H</i>-1,2,4-triazol-1-yl)-1,3-thiazol-2-amine","Acta Crystallographica Section E","2005","61","10","m2031","m2032","10.1107/S1600536805028953","","","0.71073","MoKα","","0.0588","0.0381","","","0.0904","0.1029","","","","","","1.038","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206986","11.569","0.0008","9.915","0.0007","14.337","0.001","90","","114.086","0.004","90","","1501.36","0.19","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6-Phenyl-5,6-dihydrobenzoimidazo[1,2-c]quinazoline","","- C20 H15 N3 -","- C20 H15 N3 -","- C80 H60 N12 -","4","1","IS6119","Mahendra, M; Gayathri, V.; Jayalakshmi, K.; Rangappa, K. S.; Sridhar, M. A.; Shashidhara Prasad, J.","6-Phenyl-5,6-dihydrobenzoimidazo[1,2-<i>c</i>]quinazoline","Acta Crystallographica Section E","2005","61","10","o3249","o3251","10.1107/S1600536805028655","","","0.71073","MoKα","","0.0573","0.0465","","","0.1224","0.1437","","","","","","1.182","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206987","21.95","0.003","9.9632","0.0015","15.538","0.002","90","","106.028","0.002","90","","3265.9","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(1H-Benzotriazol-1-yl))-1-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1- yl)ethanone","","- C16 H10 Cl2 N6 O -","- C16 H10 Cl2 N6 O -","- C128 H80 Cl16 N48 O8 -","8","1","IS6120","Jun Wan; Chun-Li Li; Xue-Mei Li; Shu-Sheng Zhang; Ping-Kai Ouyang","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(2,4-dichlorophenyl)-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanone","Acta Crystallographica Section E","2005","61","10","o3232","o3233","10.1107/S1600536805028448","","","0.71073","MoKα","","0.0678","0.0526","","","0.1203","0.1296","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206988","25.179","0.004","13.822","0.003","24.112","0.004","90","","99.58","0.01","90","","8275","3","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","antimonium phthalocyanine","Bis{[phthalocyaninato(2-)]antimony(III)} tetradecaiodotetraantimony(III)","","- C64 H32 I14 N16 Sb6 -","- C64 H32 I14 N16 Sb6 -","- C256 H128 I56 N64 Sb24 -","4","0.5","IS6121","Genivaldo Júlio Perpétuo; Jan Janczak","Bis{[phthalocyaninato(2‒)]antimony(III)} tetradecaiodotetraantimonate(III)","Acta Crystallographica Section E","2005","61","10","m2003","m2005","10.1107/S1600536805028485","","","0.71073","MoKα","","0.079","0.0476","","","0.1039","0.1093","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206989","7.4223","0.0015","8.1444","0.0016","10.642","0.002","74.01","0.03","71.64","0.03","75.44","0.03","577.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(3-methoxycarbonylamino-4-methyl-phenyl)-carbamic acid methyl ester","","- C11 H14 N2 O4 -","- C11 H14 N2 O4 -","- C22 H28 N4 O8 -","2","1","IS6122","Yong-Yan Lu; Qiu-Xiang Yin; Jing-Kang Wang; Li-Na Zhou","Dimethyl <i>N</i>,<i>N</i>'-(4-methyl-<i>m</i>-phenylene)dicarbamate","Acta Crystallographica Section E","2005","61","10","o3412","o3413","10.1107/S1600536805029958","","","0.71073","MoKα","","0.0552","0.0516","","","0.1663","0.171","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206990","22.654","0.003","7.5464","0.001","18.816","0.002","90","","123.692","0.002","90","","2676.4","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-{[3-(2-Nitrophenyl)prop-2-enylidene]amino}phenol","","- C15 H12 N2 O3 -","- C15 H12 N2 O3 -","- C120 H96 N16 O24 -","8","1","IS6123","Ying Li; Xiao-Yan Yang; Shu-Sheng Zhang; Xue-Mei Li","2-{[3-(2-Nitrophenyl)prop-2-enylidene]amino}phenol","Acta Crystallographica Section E","2005","61","10","o3337","o3338","10.1107/S1600536805029338","","","0.71073","MoKα","","0.0606","0.048","","","0.1182","0.1268","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206991","11.547","0.005","9.113","0.004","12.801","0.005","90","","101.651","0.008","90","","1319.3","1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Benzaldehyde 1-(2,3,4,6-tetra-O-acetyl-β-D- galactopyranosyl)thiosemicarbazone","","- C22 H27 N3 O9 S -","- C22 H27 N3 O9 S -","- C44 H54 N6 O18 S2 -","2","1","IS6124","Shu-Sheng Zhang; Bo Yang; Hui-Xiang Li; Xue-Mei Li","Benzaldehyde 1-(2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-galactopyranosyl)thiosemicarbazone","Acta Crystallographica Section E","2005","61","10","o3478","o3479","10.1107/S1600536805030308","","","0.71073","MoKα","","0.1083","0.0628","","","0.1111","0.1318","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206992","10.1251","0.0006","11.4082","0.0005","25.4972","0.0015","90","","90","","90","","2945.2","0.3","193","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(3aS,4S,4aS,7R,9S,9aS)-Methyl 4-benzyloxy-9-methanesulfonyloxy-2,2-dimethyl-8-oxo- octahydro-1,3-dioxa-5-thia-7a-aza-cyclopenta[f]azulene-7-carboxylate toluene solvate","","- C28 H35 N O9 S2 -","- C28 H35 N O9 S2 -","- C112 H140 N4 O36 S8 -","4","1","IS6126","Hörger, Rolf; Marsch, Michael; Geyer, Armin; Harms, Klaus","(3a<i>S</i>,4<i>S</i>,4a<i>S</i>,7<i>R</i>,9<i>S</i>,9a<i>S</i>)-Methyl 4-benzyloxy-9-methylsulfonyloxy-2,2-dimethyl-8-oxooctahydro-1,3-dioxa-5-thia-7a-azacyclopenta[<i>f</i>]azulene-7-carboxylate toluene solvate","Acta Crystallographica Section E","2005","61","10","o3447","o3448","10.1107/S160053680503031X","","","0.71073","MoKα","","","0.0269","","","","0.0491","","","","","","0.89","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206993","11.4827","0.0009","15.6864","0.0013","18.4671","0.0014","90","","90","","90","","3326.3","0.5","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-(Benzenesulfonyloxy)-2,2,6,6-tetramethylpiperidin-4-yl oxide","","- C15 H22 N O4 S -","- C15 H22 N O4 S -","- C120 H176 N8 O32 S8 -","8","1","JH6014","Zhou, Bao-Han; Meng, Xiang-Gao; Yin, Guo-Dong; Wu, An-Xin","4-(Benzenesulfonyloxy)-2,2,6,6-tetramethylpiperidin-4-yl oxide","Acta Crystallographica Section E","2005","61","10","o3377","o3379","10.1107/S1600536805028035","","","0.71073","MoKα","","0.0683","0.0467","","","0.1303","0.1455","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206994","10.5785","0.0018","3.7461","0.0006","20.002","0.003","90","","94.587","0.003","90","","790.1","0.2","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","isonicotinamide‒formamide co-crystal","isonicotinamide‒formamide (1/1)","","- C7 H9 N3 O2 -","- C7 H9 N3 O2 -","- C28 H36 N12 O8 -","4","1","JH6015","Iain D. H. Oswald; W. D. Sam Motherwell; Simon Parsons","Isonicotinamide‒formamide (1/1)","Acta Crystallographica Section E","2005","61","10","o3161","o3163","10.1107/S1600536805026632","","","0.71073","MoKα","","0.0528","0.0442","","","0.1178","0.1223","","","","","","1.059","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2206995","10.0454","0.0018","25.564","0.005","8.4997","0.0015","90","","99.427","0.003","90","","2153.3","0.7","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethyl (11bR,11cS)-rel-5,10-dihydro-7-nitro-4,11-dioxo-1H,3H,4H,11H-2-oxa- 3a,4a,10a,11a-tetraazabenz[f]indeno[2,1,7-ija]azulene-11b,11c-dicarboxylate","","- C20 H21 N5 O9 -","- C20 H21 N5 O9 -","- C80 H84 N20 O36 -","4","1","JH6016","Qin, Shuqi; Yin, Guodong","<i>rel</i>-(11b<i>R</i>,11c<i>S</i>)-Diethyl 5,10-dihydro-7-nitro-4,11-dioxo-1<i>H</i>,3<i>H</i>,4<i>H</i>,11<i>H</i>-2-oxa- 3a,4a,10a,11a-tetraazabenz[<i>f</i>]indeno[2,1,7-<i>ija</i>]azulene-11b,11c-dicarboxylate","Acta Crystallographica Section E","2005","61","10","o3164","o3165","10.1107/S1600536805027741","","","0.71073","MoKα","","0.081","0.0647","","","0.1611","0.1719","","","","","","1.054","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206996","9.4236","0.0007","7.3711","0.0005","24.5011","0.0018","90","","99.693","0.001","90","","1677.6","0.2","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 Cl2 N3 O -","- C18 H15 Cl2 N3 O -","- C72 H60 Cl8 N12 O4 -","4","1","JH6017","Jing, Zuo-Liang; Yu, Ming; Chen, Xin; Deng, Qi-Liang","4-[(2,4-Dichlorobenzylidene)amino]-1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one","Acta Crystallographica Section E","2005","61","10","o3359","o3360","10.1107/S1600536805029624","","","0.71073","MoKα","","0.0471","0.0338","","","0.0887","0.0942","","","","","","1.084","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206997","3.7619","0.0009","10.23","0.002","11.81","0.003","98.634","0.004","92.415","0.005","99.326","0.004","442.38","0.18","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","4-Nitrophenol‒carbamide (1/1)","","- C7 H9 N3 O4 -","- C7 H9 N3 O4 -","- C14 H18 N6 O8 -","2","1","JH6018","Ya-Juan Zhao; Xin-Hua Li","4-Nitrophenol‒urea (1/1)","Acta Crystallographica Section E","2005","61","10","o3366","o3367","10.1107/S1600536805029442","","","0.71073","MoKα","","0.0793","0.061","","","0.1293","0.1412","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206998","7.0054","0.0014","8.2661","0.0017","14.445","0.003","74.5","0.03","77.09","0.03","88.37","0.03","785.2","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","1-Carboxymethyl-3-hydroxypyridinium nitrate‒3-hydroxypyridinium-1-acetate (1/1)","","- C14 H15 N3 O9 -","- C14 H15 N3 O9 -","- C28 H30 N6 O18 -","2","1","JH6021","Zhu-Yan Zhang; Shan Gao; Li-Hua Huo; Jing-Gui Zhao","1-Carboxymethyl-3-hydroxypyridinium nitrate‒3-hydroxypyridinium-1-acetate (1/1)","Acta Crystallographica Section E","2005","61","10","o3487","o3489","10.1107/S1600536805030618","","","0.71073","MoKα","","0.0643","0.0496","","","0.1683","0.1807","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206999","6.149","0.001","11.255","0.001","27.402","0.001","90","","90.431","0.001","90","","1896.4","0.4","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","MOPS","3-(morpholinium-1-yl)propanesulfonate","","- C7 H15 N O4 S -","- C7 H15 N O4 S -","- C56 H120 N8 O32 S8 -","8","2","KP6056","Maksymilian Chruszcz; Heping Zheng; Marcin Cymborowski; Anna Gawlicka-Chruszcz; Wladek Minor","3-(Morpholinium-1-yl)propanesulfonate","Acta Crystallographica Section E","2005","61","10","o3190","o3191","10.1107/S1600536805027728","","","0.71074","MoKα","","0.0308","0.0264","","","0.0725","0.0751","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207000","8.1968","0.0011","10.218","0.0014","16.581","0.002","86.447","0.002","85.668","0.003","70.083","0.002","1301","0.3","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","Ethyl 5-amino-1-(4-chlorophenyl-5,5-dimethyl-2-oxo-1,3,2-dioxaphosphinan-2-yl)- 3-(6-chloro-3-pyridylmethylamino)-1H-pyrazole-4-carboxylate","","- C23 H26 Cl2 N5 O5 P -","- C23 H26 Cl2 N5 O5 P -","- C46 H52 Cl4 N10 O10 P2 -","2","1","KP6058","Zai-Gang Luo; De-Qing Shi; Xiang-Gao Meng","Ethyl 5-amino-1-(4-chlorophenyl-5,5-dimethyl-2-oxo-1,3,2-dioxaphosphinan-2-yl)-3-(6-chloro-3-pyridylmethylamino)-1<i>H</i>-pyrazole-4-carboxylate","Acta Crystallographica Section E","2005","61","10","o3307","o3309","10.1107/S160053680502917X","","","0.71073","MoKα","","0.0722","0.05","","","0.1137","0.1395","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207001","13.64","0.0003","8.79","0.0003","15.231","0.0005","90","","100.697","0.001","90","","1794.4","0.09","150","2","150","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","2,4-Pentanedionatobis(dimethylaminoethanol)nickel(II) chloride","","- C13 H29 Cl N2 Ni O4 -","- C13 H29 Cl N2 Ni O4 -","- C52 H116 Cl4 N8 Ni4 O16 -","4","1","LH6466","Sohail, Manzar; Kieran C. Molloy; Mazhar, Muhammad; G. Kociok-Köhn; Khosa, M. Kaleem","Bis[2-(dimethylamino)ethanol-κ^2^<i>N</i>,<i>O</i>](pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')nickel(II) chloride","Acta Crystallographica Section E","2005","61","10","m2001","m2002","10.1107/S1600536805028424","","","0.71073","MoKα","","0.0681","0.0498","","","0.122","0.1369","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207002","7.2099","0.0005","13.6448","0.0009","29.631","0.003","90","","90","","90","","2915","0.4","296","","296","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Acetyl-4-(4-ethoxyphenyldiazenyl)phenol","","- C16 H16 N2 O3 -","- C16 H16 N2 O3 -","- C128 H128 N16 O24 -","8","1","LH6476","Deveci, Özlem; Işık, Şamil; Albayrak, Çiǧdem; Ağar, Erbil","2-Acetyl-4-(4-ethoxyphenyldiazenyl)phenol","Acta Crystallographica Section E","2005","61","10","o3226","o3227","10.1107/S1600536805028072","","","0.71073","MoKα","","0.1385","0.0534","","","0.1357","0.1726","","","","","","0.885","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207003","16.326","0.003","13.119","0.003","17.644","0.003","90","","106.069","0.002","90","","3631.4","1.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","cobaltocenium triflate","Bis(η^5^-cyclopentadienyl)cobalt(III) trifluoromethanesulfonate","","- C11 H10 Co F3 O3 S -","- C11 H10 Co F3 O3 S -","- C132 H120 Co12 F36 O36 S12 -","12","3","LH6486","Andrews, Christopher G.; Macdonald, Charles L. B.","Cobaltocenium trifluoromethanesulfonate","Acta Crystallographica Section E","2005","61","10","m2103","m2105","10.1107/S1600536805029879","","","0.71073","MoKα","","0.1692","0.0715","","","0.1663","0.2122","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207004","11.574","0.003","20.21","0.005","14.919","0.003","90","","128.638","0.013","90","","2725.8","1.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(N-vanillylidenetyrosinato-κ^3^O,N,O')(2,2'-bipyridine-κ^2^N,N') oxovanadium(IV) methanol solvate hydrate","","- C28 H29 N3 O8 V -","- C28 H29 N3 O8 V -","- C112 H116 N12 O32 V4 -","4","1","LH6492","Bu-Qin Jing; Lian-Zhi Li; Da-Qi Wang; Tao Xu","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')oxo(<i>N</i>-vanillylidenetyrosinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')vanadium(IV) methanol solvate monohydrate","Acta Crystallographica Section E","2005","61","10","m2106","m2108","10.1107/S1600536805029855","","","0.71073","MoKα","","0.1175","0.0598","","","0.1539","0.1983","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207005","13.408","0.002","10.517","0.002","29.505","0.006","90","","92.9","0.02","90","","4155.2","1.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2'-Hydroxy-3'-(morpholin-4-yl-methyl)-4',6'-dimethoxy-2-chloro-chalcone","","- C22 H24 Cl N O5 -","- C22 H24 Cl N O5 -","- C176 H192 Cl8 N8 O40 -","8","1","LH6493","Tao Liu; Zhong-Miao Xu; Yong-Zhou Hu","2'-Hydroxy-3'-(morpholin-4-yl-methyl)-4',6'-dimethoxy-2-chloro-chalcone","Acta Crystallographica Section E","2005","61","10","o3389","o3390","10.1107/S1600536805029648","","","0.71073","MoKα","","0.1235","0.0434","","","0.0783","0.0878","","","","","","0.813","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207006","6.5934","0.0004","8.0307","0.0005","11.2873","0.0008","80.62","0.001","82.639","0.001","77.613","0.001","573.24","0.06","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(benzylaminium) tetraaquadisulfatomanganate(II)","","- C14 H28 Mn N2 O12 S2 -","- C14 H28 Mn N2 O12 S2 -","- C14 H28 Mn N2 O12 S2 -","1","0.5","LH6494","Naumov, Panc̆e; Jordanovska, Vera; Ng, Seik Weng","Bis(benzylaminium) tetraaquadisulfatomanganate(II)","Acta Crystallographica, Section E","2005","61","10","m1970","m1971","10.1107/S1600536805028370","","","0.71073","MoKα","","0.034","0.033","","","0.101","0.103","","","","","","1.1","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207007","7.418","0.0007","10.2724","0.0009","14.262","0.001","90","","90.588","0.002","90","","1086.72","0.16","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Chloro-4-hydroxyanthraquinone","","- C14 H7 Cl O3 -","- C14 H7 Cl O3 -","- C56 H28 Cl4 O12 -","4","1","LH6495","Ng, Seik Weng","1-Chloro-4-hydroxyanthraquinone","Acta Crystallographica Section E","2005","61","10","o3230","o3231","10.1107/S1600536805028400","","","0.71073","MoKα","","0.112","0.061","","","0.164","0.2","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207008","8.0518","0.0002","9.3238","0.0002","13.5469","0.0003","96.3421","0.0012","100.272","0.0014","94.966","0.0013","988.7","0.04","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","cis-bis(2,2'-bipyridyl)difluorovanadium(III) tetrafluoroborate","","- C20 H16 B F6 N4 V -","- C20 H16 B F6 N4 V -","- C40 H32 B2 F12 N8 V2 -","2","1","LH6496","Kavitha, Savaridasson Jose; Panchanatheswaran, Krishnaswamy; Low, John N.; Glidewell, Christopher","Racemic <i>cis</i>-bis(2,2'-bipyridyl)difluorovanadium(III) tetrafluoroborate","Acta Crystallographica Section E","2005","61","10","m1965","m1967","10.1107/S1600536805028060","","","0.71073","MoKα","","0.0566","0.048","","","0.1286","0.1332","","","","","","1.174","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207009","9.7112","0.0019","13.589","0.003","10.711","0.002","90","","107.362","0.004","90","","1349.1","0.5","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4-phenyl-3-thioxo-1,2,4-triazolidin-1-yl)-2-(1H-1,2,4-triazol-1-yl)ethanone","","- C12 H12 N6 O S -","- C12 H12 N6 O S -","- C48 H48 N24 O4 S4 -","4","1","LH6499","Xu, Liang-Zhong; Yu, Guan-Ping; Huang, Yong-Wei; Si, Guo-Dong; Li, Kai","1-(4-Phenyl-3-thioxo-1,2,4-triazolidin-1-yl)-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanone","Acta Crystallographica Section E","2005","61","10","o3403","o3404","10.1107/S1600536805029867","","","0.71073","MoKα","","0.1025","0.0448","","","0.0945","0.1156","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207010","10.363","0.002","10.438","0.002","11.45","0.002","64.66","0.01","80.87","0.02","69.07","0.01","1045.5","0.4","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H20 N2 O5 Pd -","- C24 H20 N2 O5 Pd -","- C48 H40 N4 O10 Pd2 -","2","1","LH6500","Okabe, Nobuo; Muranishi, Yasunori; Odoko, Mamiko","(1,1-Cyclobutanedicarboxylato-κ^2^<i>O</i>,<i>O</i>')(2,2'-biquinoline-κ^2^<i>N</i>,<i>N</i>')palladium(II) monohydrate","Acta Crystallographica Section E","2005","61","10","m2060","m2062","10.1107/S160053680502965X","","","0.7107","MoKα","","","0.0268","","","","0.0753","","","","","","1.223","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2207011","9.7231","0.0004","11.789","0.0003","11.1187","0.0004","90","","97.363","0.002","90","","1263.98","0.08","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Nitrophenyl 2-iodobenzoate","","- C13 H8 I N O4 -","- C13 H8 I N O4 -","- C52 H32 I4 N4 O16 -","4","1","LH6502","Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher","4-Nitrophenyl 2-iodobenzoate: sheets built from C—H···O hydrogen bonds and two-centre iodo‒nitro interactions","Acta Crystallographica Section E","2005","61","10","o3334","o3336","10.1107/S1600536805029272","","","0.71073","MoKα","","0.0325","0.0262","","","0.0548","0.0575","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207012","8.3","0.007","12.223","0.009","13.964","0.01","81.108","0.013","86.415","0.012","79.596","0.013","1375.7","1.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Tetra-aqua-bis[2,3-bis(5-methyl-1,3,4-thiadiazole-2- thiomethyl)quinoxaline]-nickel(II) diperchlorate diacetone solvate","","- C38 H48 Cl2 N12 Ni O14 S8 -","- C38 H48 Cl2 N12 Ni O14 S8 -","- C38 H48 Cl2 N12 Ni O14 S8 -","1","0.5","LH6503","Xie, Ya-Bo; Wang, Xiang-Jie; Wang, Dao","Tetraaquabis[2,3-bis(5-methyl-1,3,4-thiadiazol-2-ylsulfanylmethyl)quinoxaline]nickel(II) bis(perchlorate) acetone disolvate","Acta Crystallographica Section E","2005","61","10","m2086","m2087","10.1107/S1600536805029892","","","0.71073","MoKα","","0.1328","0.0631","","","0.0906","0.1112","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207013","30.224","0.002","4.8017","0.0003","8.7257","0.0006","90","","90","","90","","1266.33","0.14","295","2","295","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","5-Nitrosalicylaldehyde benzoylhydrazone","","- C14 H11 N3 O4 -","- C14 H11 N3 O4 -","- C56 H44 N12 O16 -","4","1","LH6505","Ali, Hapipah M.; Puvaneswary, Subramaniam; Ng, Seik Weng","5-Nitrosalicylaldehyde benzoylhydrazone","Acta Crystallographica Section E","2005","61","10","o3464","o3465","10.1107/S1600536805030497","","","0.71073","MoKα","","0.053","0.035","","","0.088","0.113","","","","","","1.17","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207014","7.6183","0.0015","10.714","0.002","12.039","0.002","90","","105.661","0.004","90","","946.2","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dicarbonyl(η^5^-1-carboxycyclopentadienyl)methyliron(II)","","- C9 H8 Fe O4 -","- C9 H8 Fe O4 -","- C36 H32 Fe4 O16 -","4","1","LH6507","Bala, Muhammad D.; Munyaneza, Apollinaire; Coville, Neil J.","Dicarbonyl(η^5^-1-carboxycyclopentadienyl)methyliron(II)","Acta Crystallographica Section E","2005","61","10","m2124","m2126","10.1107/S1600536805030473","","","0.71073","MoKα","","0.03","0.0246","","","0.0674","0.0695","","","","","","1.083","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207015","10.116","0.002","11.045","0.003","11.239","0.003","100.554","0.004","110.267","0.004","115.736","0.004","975","0.4","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","1-[(Z)-3-Ferrocenyl-1-(4-fluorophenyl)-1-methoxyprop-2-en-2-yl]- 1H-1,2,4-triazole","","- C22 H20 F Fe N3 O -","- C22 H20 F Fe N3 O -","- C44 H40 F2 Fe2 N6 O2 -","2","1","LH6508","Liu, Jian-Bing; Dai, Hong; Li, Li-Chun; Tao, Wei-Feng; Fang, Jian-Xin","1-[(<i>Z</i>)-3-Ferrocenyl-1-(4-fluorophenyl)-1-methoxyprop-2-en-2-yl]-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","10","m2166","m2168","10.1107/S1600536805030898","","","0.71073","MoKα","","0.07","0.0422","","","0.0867","0.0988","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207016","22.5587","0.0011","11.8751","0.0004","19.2336","0.0011","90","","112.057","0.004","90","","4775.3","0.4","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5,11,17,23-Tetranitro-25,26,27,28-tetrapentyloxycalix[4]arene","","- C48 H60 N4 O12 -","- C48 H60 N4 O12 -","- C192 H240 N16 O48 -","4","0.5","LH6509","Vysotsky, Myroslav O.; Böhmer, Volker; Bru Roig, Miriam; Bolte, Michael","5,11,17,23-Tetranitro-25,26,27,28-tetrapentyloxycalix[4]arene","Acta Crystallographica Section E","2005","61","10","o3526","o3528","10.1107/S1600536805030862","","","0.71073","MoKα","","0.0948","0.0824","","","0.236","0.2472","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207017","7.5961","0.0013","11.6988","0.0012","11.8222","0.0015","90","","90.063","0.012","90","","1050.6","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N^9^,N^7^-Dimethylhypoxanthinium iodide","","- C7 H9 I N4 O -","- C7 H9 I N4 O -","- C28 H36 I4 N16 O4 -","4","1","NC6045","Nasiri, Hamid Reza; Schwalbe, Harald; Bolte, Michael; Wöhnert, Jens","<i>N</i>^9^,<i>N</i>^7^-Dimethylhypoxanthinium iodide","Acta Crystallographica Section E","2005","61","10","o3353","o3354","10.1107/S1600536805029375","","","0.71073","MoKα","","0.0567","0.0419","","","0.1011","0.1078","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207018","9.9452","0.0003","9.9452","","22.581","0.002","90","","90","","90","","2233.4","0.2","293","2","293","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","Bis[2-(benzimidazol-2-yl)phenolato-κ^2^N,O] cobalt(II)","","- C26 H18 Co N4 O2 -","- C26 H18 Co N4 O2 -","- C104 H72 Co4 N16 O8 -","4","0.5","NG6183","Bu, Huai-Yu; Liu, Yong-Jun; Liu, Qing-Fang; Jia, Jing-Fen","Bis[2-(benzimidazol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>]cobalt(II)","Acta Crystallographica Section E","2005","61","10","m1986","m1987","10.1107/S1600536805028084","","","0.71073","MoKα","","0.0519","0.044","","","0.111","0.1144","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207019","11.0814","0.0013","11.95","0.0014","14.2178","0.0017","103.038","0.002","100.388","0.002","103.746","0.001","1726.4","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(hexane-1,6-diaminium) di-μ~5~-hydrogenphosphato-penta-μ~2~-oxo-pentakis[dioxomolybdenum(VI)] dihydrate","","- C12 H42 Mo5 N4 O25 P2 -","- C12 H42 Mo5 N4 O25 P2 -","- C24 H84 Mo10 N8 O50 P4 -","2","1","NG6184","Fang, Rui-Qin; Zhang, Xian-Ming","Bis(hexane-1,6-diaminium) di-μ~5~-hydrogenphosphato-penta-μ~2~-oxo-pentakis[dioxomolybdenum(VI)] dihydrate","Acta Crystallographica Section E","2005","61","10","m1933","m1934","10.1107/S1600536805027686","","","0.71073","MoKα","","0.0231","0.0211","","","0.0509","0.0519","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207020","13.3866","0.0017","7.3166","0.0007","8.0595","0.001","90","","112.503","0.003","90","","729.28","0.15","193","2","193","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","catena-Poly[[bis(N,N-dimethylformamide-κO)nickel(II)]-di- μ-1,5-dicyanamido-κN^1^:κN^5^]","","- C10 H14 N8 Ni O2 -","- C10 H14 N8 Ni O2 -","- C20 H28 N16 Ni2 O4 -","2","0.25","NG6186","Xiao-Ping Shen; Ai-Hua Yuan","<i>catena</i>-Poly[[bis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)nickel(II)]-di-μ-1,5-dicyanamido-κ<i>N</i>^1^:κ<i>N</i>^5^]","Acta Crystallographica Section E","2005","61","10","m1937","m1939","10.1107/S1600536805027674","","","0.71073","MoKα","","0.0228","0.0225","","","0.0614","0.0617","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207021","7.4257","0.0012","17.214","0.002","12.028","0.002","90","","106.863","0.007","90","","1471.4","0.4","293.15","","293.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[aqua(piperazin-1-ium-κN^4^)copper(II)]-μ-5- sulfonatoisophthalato-κO^1^:κO^3^]","","- C12 H16 Cu N2 O8 S -","- C12 H16 Cu N2 O8 S -","- C48 H64 Cu4 N8 O32 S4 -","4","1","NG6189","Qing-Yan Liu; Li Xu","<i>catena</i>-Poly[[aqua(piperazin-1-ium-κ<i>N</i>^4^)copper(II)]-μ-5-sulfonatoisophthalato-κ<i>O</i>^1^:κ<i>O</i>^3^]","Acta Crystallographica Section E","2005","61","10","m1972","m1974","10.1107/S1600536805028266","","","0.71073","MoKα","","0.0948","0.0653","","","0.1315","0.1445","","","","","","1.002","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207022","8.1081","0.0004","16.0311","0.0008","8.9223","0.0004","90","","94.202","0.001","90","","1156.62","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[1-(2,6-dimethylanilino)propane-1,2-dione dioximato]nickel(II)","","- C22 H28 N6 Ni O4 -","- C22 H28 N6 Ni O4 -","- C44 H56 N12 Ni2 O8 -","2","0.5","NG6197","Batı, Hümeyra; Zülfikaroğlu, Ayşin; Taş, Murat; Andac, Omer; Harrison, William T. A.","Bis[1-(2,6-dimethylanilino)propane-1,2-dione dioximato]nickel(II)","Acta Crystallographica Section E","2005","61","10","m2033","m2035","10.1107/S1600536805028965","","","0.71073","MoKα","","0.0546","0.0339","","","0.0849","0.0934","","","","","","0.976","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207023","18.334","0.0008","12.0404","0.0005","19.1304","0.0008","90","","90","","90","","4223","0.3","223","2","223","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","catena-Poly[[bis(O,O'-dicyclohexyl dithiophosphato-κ^2^,S,S')zinc(II)]- μ-1,2-bis(4-pyridylmethylene)hydrazine-κ^2^N:N']","","- C36 H54 N4 O4 P2 S4 Zn -","- C36 H54 N4 O4 P2 S4 Zn -","- C144 H216 N16 O16 P8 S16 Zn4 -","4","0.5","NG6201","Chen, Danlin; Lai, Chian Sing; Tiekink, Edward R. T.","<i>catena</i>-Poly[[bis(<i>O</i>,<i>O</i>'-dicyclohexyldithiophosphato-κ^2^,<i>S</i>,<i>S</i>')zinc(II)]-μ-1,2-bis(4-pyridylmethylene)hydrazine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2005","61","10","m2052","m2054","10.1107/S1600536805029466","","","0.71069","MoKα","","0.073","0.057","","","0.128","0.137","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207024","12.417","0.003","10.152","0.003","14.541","0.005","90","","109.492","0.005","90","","1727.9","0.9","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H12 Cl2 N2 Pd S2 -","- C17 H12 Cl2 N2 Pd S2 -","- C68 H48 Cl8 N8 Pd4 S8 -","4","1","NG6202","Song, Rui-Feng; Liu, Jia-Hui; Qian, Hui; Zhao, Kai-Yuan","Dichloro[8-(1,3-benzothiazol-2-ylsulfanylmethyl)quinoline-κ<i>N</i>,<i>N</i>']palladium(II)","Acta Crystallographica Section E","2005","61","10","m2142","m2144","10.1107/S1600536805030096","","","0.7107","MoKα","","0.0246","0.0234","","","0.0581","0.0588","","","","","","1.105","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207025","10.547","0.002","12.804","0.003","11.195","0.002","90","","104.08","0.03","90","","1466.4","0.5","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-1-Ferrocenyl-3-hydroxyl-3-[(2-pyridyl)]prop-2-en-1-one","","- C18 H15 Fe N O2 -","- C18 H15 Fe N O2 -","- C72 H60 Fe4 N4 O8 -","4","1","NG6204","Yao-Cheng Shi; Hong-Jian Cheng","(<i>Z</i>)-1-Ferrocenyl-3-hydroxy-3-(2-pyridyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","10","m2139","m2141","10.1107/S1600536805030102","","","0.71073","MoKα","","0.0626","0.0386","","","0.1016","0.1299","","","","","","1.097","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207026","16.4609","0.001","17.6108","0.0011","13.8677","0.0009","90","","90","","90","","4020.1","0.4","292","2","292","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","N,N'-Bis(benzimidazol-1-ium-2-ylmethyl)-N,N'-bis(benzimidazol-2- ylmethyl)cyclohexane-1,2-trans-diamine bis(perchlorate) dihydrate","","- C38 H44 Cl2 N10 O10 -","- C38 H44 Cl2 N10 O10 -","- C152 H176 Cl8 N40 O40 -","4","0.5","OB6538","Li, Ji; Meng, Xiang-Gao; Liao, Zhan-Ru","<i>N</i>,<i>N</i>'-Bis(benzimidazol-1-ium-2-ylmethyl)-<i>N</i>,<i>N</i>'-bis(benzimidazol-2-ylmethyl)cyclohexane-1,2-<i>trans</i>-diamine bis(perchlorate) dihydrate","Acta Crystallographica Section E","2005","61","10","o3421","o3423","10.1107/S1600536805022865","","","0.71073","MoKα","","0.0675","0.0587","","","0.1657","0.1739","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207027","31.62","0.008","10.443","0.003","20.993","0.005","90","","116.931","0.004","90","","6180","3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,3-trans-1,4-cis-1,2-Bis(2,4-dichlorophenyl)-1,2,3,3a,8,8a- hexahydrobenzo[e]pentalene-3-spiro-2'-indan-3a,1'-diol acetone solvate","","- C35 H30 Cl4 O3 -","- C35 H30 Cl4 O3 -","- C280 H240 Cl32 O24 -","8","1","OB6560","Da-Qing Shi; Zheng-Yi Li; Chun-Ling Shi; Guo-Lan Dou","1,3-<i>trans</i>-1,4-<i>cis</i>-1,2-Bis(2,4-dichlorophenyl)-1,2,3,3a,8,8a-hexahydrobenzo[<i>e</i>]pentalene-3-spiro-2'-indan-3a,1'-diol acetone solvate","Acta Crystallographica Section E","2005","61","10","o3219","o3221","10.1107/S1600536805028114","","","0.71073","MoKα","","0.1286","0.0562","","","0.127","0.1698","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207028","7.3546","0.0005","23.7901","0.0017","7.4919","0.0005","90","","108.738","0.006","90","","1241.36","0.15","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-6-[(1-napthylamino)methylene]cyclohexa-2,4-dien-1-one","","- C17 H13 N O2 -","- C17 H13 N O2 -","- C68 H52 N4 O8 -","4","1","OB6563","Özek, Arzu; Yüce, Süheyla; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","2-Hydroxy-6-[(1-napthylamino)methylene]cyclohexa-2,4-dien-1-one","Acta Crystallographica Section E","2005","61","10","o3179","o3181","10.1107/S1600536805027546","","","0.71073","MoKα","","0.0758","0.0458","","","0.1005","0.111","","","","","","0.996","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207029","14.026","0.003","11.12","0.002","14.491","0.003","90","","99.349","0.009","90","","2230.1","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,5-Bis(4-tert-butylphenyl)-3,4-dinitrothiophene","","- C24 H26 N2 O4 S -","- C24 H26 N2 O4 S -","- C96 H104 N8 O16 S4 -","4","1","OB6565","Ping-Hsin Huang; Yu-Da Cheng; Yuh-Sheng Wen; Ming-Chang P. Yeh; Jiann T. Lin","2,5-Bis(4-<i>tert</i>-butylphenyl)-3,4-dinitrothiophene","Acta Crystallographica Section E","2005","61","10","o3168","o3169","10.1107/S1600536805026097","","","0.71073","MoKα","","0.0341","0.0302","","","0.0742","0.0772","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207030","9.239","0.002","7.3884","0.0015","15.649","0.003","90","","92.329","0.003","90","","1067.3","0.4","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,3,4-trimethoxy-6-methylbenzaldehyde","","- C11 H14 O4 -","- C11 H14 O4 -","- C44 H56 O16 -","4","1","OB6571","Wu-Jun Zhang; Ming Lu; Da-Chang Li; Chun-Bao Li","2,3,4-Trimethoxy-6-methylbenzaldehyde","Acta Crystallographica Section E","2005","61","10","o3222","o3223","10.1107/S1600536805027273","","","0.71073","MoKα","","0.0746","0.0406","","","0.1024","0.1193","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207031","8.0524","0.0016","19.884","0.004","8.1541","0.0016","90","","116.57","0.03","90","","1167.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-Bis(pyrimidin-2-ylsulfanyl)ethane","","- C10 H10 N4 S2 -","- C10 H10 N4 S2 -","- C40 H40 N16 S8 -","4","1","OB6574","Xie, Chuang; Zhou, Li-Na; Hou, Bao-Hong; Wang, Jing-Kang; Chen, Wei","1,2-Bis(pyrimidin-2-ylsulfanyl)ethane","Acta Crystallographica Section E","2005","61","10","o3174","o3175","10.1107/S1600536805027558","","","0.71073","MoKα","","0.1139","0.0878","","","0.2786","0.3067","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207032","14.873","0.0014","7.9521","0.0008","23.763","0.002","90","","90","","90","","2810.5","0.5","292","2","292","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","(2RS,3SR)-Diethyl 2,3-bis(3,4,5-trimethoxybenzoyl)succinate","","- C28 H34 O12 -","- C28 H34 O12 -","- C112 H136 O48 -","4","1","OB6575","Meng, Xiang-Gao; Wu, An-Xin","(2<i>RS</i>,3<i>SR</i>)-Diethyl 2,3-bis(3,4,5-trimethoxybenzoyl)succinate","Acta Crystallographica Section E","2005","61","10","o3117","o3118","10.1107/S1600536805027285","","","0.71073","MoKα","","0.0679","0.0481","","","0.1142","0.1248","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207033","7.4789","0.0014","7.6632","0.0014","14.374","0.003","90","","91.754","0.004","90","","823.4","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","18-crown-6 ammoniate","1,4,7,10,13,16-Hexaoxacyclooctadecane‒ammonia (1/2)","","- C12 H30 N2 O6 -","- C12 H30 N2 O6 -","- C24 H60 N4 O12 -","2","0.5","OB6577","Nuss, Hanne; Jansen, Martin","1,4,7,10,13,16-Hexaoxacyclooctadecane‒ammonia (1/2)","Acta Crystallographica Section E","2005","61","10","o3142","o3144","10.1107/S1600536805027364","","","0.71073","MoKα","","0.075","0.0483","","","0.1109","0.1233","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207034","10.341","0.002","11.867","0.002","14.409","0.003","90.62","0.02","92.68","0.02","91.03","0.02","1765.9","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","2-Amino-4,6-diphenyl-4H-1,3-oxazinium trifluoroacetate","","- C18 H15 F3 N2 O3 -","- C18 H15 F3 N2 O3 -","- C72 H60 F12 N8 O12 -","4","2","OB6578","Shen-Lin Huang; Cui-Rong Sun","2-Amino-4,6-diphenyl-4<i>H</i>-1,3-oxazinium trifluoroacetate","Acta Crystallographica Section E","2005","61","10","o3149","o3151","10.1107/S1600536805027376","","","0.71073","MoKα","","0.0891","0.0447","","","0.1043","0.115","","","","","","0.942","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207035","6.714","0.003","8.63","0.004","11.403","0.004","98.64","0.011","102.57","0.02","102.911","0.012","614.7","0.5","296","1","","","","","","","","","","5","P -1","-P 1","2","","4-(3-Methylanilino)pyridine-3-sulfonamide","","- C12 H13 N3 O2 S -","- C12 H13 N3 O2 S -","- C24 H26 N6 O4 S2 -","2","1","OB6579","Gu-Ping Tang; Jian-Ming Gu","4-(3-Methylanilino)pyridine-3-sulfonamide","Acta Crystallographica Section E","2005","61","10","o3140","o3141","10.1107/S1600536805027388","","","0.71069","MoKα","","","0.0696","","","","0.1796","","","","","","1.002","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207036","8.5045","0.001","8.5868","0.001","9.085","0.0011","80.306","0.002","75.645","0.002","75.245","0.002","617.6","0.13","292","2","292","2","","","","","","","","3","P -1","-P 1","2","","(2RS,3SR)-Diethyl 2,3-bis(3,4-dimethoxybenzoyl)succinate","","- C26 H30 O10 -","- C26 H30 O10 -","- C26 H30 O10 -","1","0.5","OB6580","Wang, Zhi-Guo; Chen, Ai-Hua; Hu, Sheng-Li; Wu, An-Xin","(2<i>RS</i>,3<i>SR</i>)-Diethyl 2,3-bis(3,4-dimethoxybenzoyl)succinate","Acta Crystallographica Section E","2005","61","10","o3172","o3173","10.1107/S160053680502756X","","","0.71073","MoKα","","0.0509","0.0455","","","0.1263","0.1325","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207037","11.709","0.003","10.306","0.002","14.847","0.006","90","","103.36","0.03","90","","1743.1","0.9","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","10-(3,4-Dimethoxybenzylidene)anthrone","","- C23 H18 O3 -","- C23 H18 O3 -","- C92 H72 O12 -","4","1","OB6581","Wei Zhou; Weixiao Hu; Chunnian Xia","10-(3,4-Dimethoxybenzylidene)anthrone","Acta Crystallographica Section E","2005","61","10","o3433","o3434","10.1107/S1600536805028278","","","0.71073","MoKα","","0.0899","0.0353","","","0.0891","0.1096","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207038","11.5465","0.0006","8.9066","0.0004","11.9102","0.0006","90","","116.112","0.002","90","","1099.83","0.1","293","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Phenyl 1,3-thiazolidine-2-thione-3-carboxylate","","- C10 H9 N O2 S2 -","- C10 H9 N O2 S2 -","- C40 H36 N4 O8 S8 -","4","1","OB6582","Jian-Quan Weng; De-Long Shen; Cheng-Xia Tang","Phenyl 2-thioxo-1,3-thiazolidine-3-carboxylate","Acta Crystallographica Section E","2005","61","10","o3289","o3290","10.1107/S1600536805028941","","","0.7107","MoKα","","","0.068","","","","0.22","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207039","15.2031","0.0014","7.5946","0.0007","15.127","0.0014","90","","100.143","0.002","90","","1719.3","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-methyl-4-(2,3-dimethoxylphenyl)-5-cyano-6-oxo- pyridin-3-carboxylate","","- C18 H18 N2 O5 -","- C18 H18 N2 O5 -","- C72 H72 N8 O20 -","4","1","OB6584","Wang, Yu-Cheng; Wang, Xiang-Shan; Zeng, Zhao-Sen; Shi, Da-Qing","Ethyl 5-cyano-4-(2,3-dimethoxyphenyl)-2-methyl-6-oxopyridine-3-carboxylate","Acta Crystallographica Section E","2005","61","10","o3261","o3263","10.1107/S1600536805028679","","","0.71073","MoKα","","0.0622","0.0466","","","0.1299","0.1372","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207040","16.659","0.003","5.1494","0.0009","13.916","0.002","90","","113.821","0.003","90","","1092.1","0.3","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Fluoro-3-phenoxybenzoic acid","","- C13 H9 F O3 -","- C13 H9 F O3 -","- C52 H36 F4 O12 -","4","1","OB6585","Chopra, Deepak; Mohan, T. P.; Sreedhar, K. S.; Guru Row, T. N.","4-Fluoro-3-phenoxybenzoic acid","Acta Crystallographica Section E","2005","61","10","o3228","o3229","10.1107/S160053680502831X","","","0.71073","MoKα","","0.0776","0.0686","","","0.1541","0.1594","","","","","","1.245","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207041","7.7779","0.0012","8.2973","0.0013","16.883","0.003","87.899","0.003","79.054","0.003","70.276","0.003","1006.5","0.3","290","2","290","2","","","","","","","","4","P -1","-P 1","2","","2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid","","- C19 H18 N4 O8 -","- C19 H18 N4 O8 -","- C38 H36 N8 O16 -","2","1","OB6586","Chopra, Deepak; Mohan, T.P.; Vishalakshi, B.; Guru Row, T. N.","2,6-Bis(4,6-dimethoxypyrimidin-2-yloxy)benzoic acid","Acta Crystallographica Section E","2005","61","10","o3281","o3282","10.1107/S160053680502859X","","","0.71073","MoKα","","0.1049","0.0652","","","0.1339","0.1582","","","","","","1.137","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207042","12.0711","0.0018","10.0544","0.0015","15.751","0.002","90","","102.39","0.003","90","","1867.1","0.5","292","2","292","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9,9-bis(methoxycarbonylethyl)fluorene","","- C21 H22 O4 -","- C21 H22 O4 -","- C84 H88 O16 -","4","1","OB6587","Hu, Wei-Bing; Liu, Hong-Xia; Tian, Da-Ting; Liu, Cheng-Mei; Liu, Zu-Li","9,9-Bis(methoxycarbonylethyl)fluorene","Acta Crystallographica Section E","2005","61","10","o3346","o3348","10.1107/S1600536805029351","","","0.71073","MoKα","","0.0844","0.06","","","0.1672","0.1873","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207043","6.8307","0.0006","13.5005","0.0007","7.6421","0.0007","90","","94.888","0.003","90","","702.18","0.1","120","2","120","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","fac-Trichloro(pyrazolato)bis(pyrazole)platinum(IV)","","- C9 H11 Cl3 N6 Pt -","- C9 H11 Cl3 N6 Pt -","- C18 H22 Cl6 N12 Pt2 -","2","0.5","OB6588","Khripun, Anatoly V.; Haukka, Matti; Nikolaeva, Dina N.; Kukushkin, Vadim Yu.","<i>fac</i>-Trichloro(pyrazolato)bis(pyrazole)platinum(IV)","Acta Crystallographica Section E","2005","61","10","m2069","m2071","10.1107/S1600536805029661","","","0.71073","MoKα","","0.0342","0.0307","","","0.0776","0.0808","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207044","9.1011","0.0006","5.7856","0.0008","21.4502","0.001","90","","100.557","0.005","90","","1110.35","0.18","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Diphenylarsino-1-(diphenylphosphino)ethane","","- C26 H24 As P -","- C26 H24 As P -","- C52 H48 As2 P2 -","2","0.5","OB6589","Shawkataly, Omar bin; Chong, Mei-Lin; Fun, Hoong-Kun; Didierjean, Claude; Aubry, Andrε'","2-Diphenylarsino-1-(diphenylphosphino)ethane","Acta Crystallographica Section E","2005","61","10","o3351","o3352","10.1107/S1600536805029545","","","0.71073","MoKα","","","0.039","","","","0.0961","","","","","","0.946","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207045","12.2069","0.0011","22.302","0.002","17.83","0.0016","90","","91.049","0.002","90","","4853.2","0.8","297","2","297","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,3-(bis(diphenylphosphino)propane bis(diphenylphosphino)amine platinum(II) chloride","","- C52 H49 Cl4 N P4 Pt -","- C52 H49 Cl4 N P4 Pt -","- C208 H196 Cl16 N4 P16 Pt4 -","4","1","OM6258","İri̇şli̇, Sevi̇l; Şen, Ayten","[Bis(diphenylphosphino)amine-κ^2^<i>P</i>,<i>P</i>'][1,3-bis(diphenylphosphino)propane-κ^2^<i>P</i>,<i>P</i>']platinum(II) dichloride dichloromethane solvate","Acta Crystallographica Section E","2005","61","10","m2097","m2099","10.1107/S1600536805029880","","","0.71073","MoKα","","0.0702","0.0554","","","0.0965","0.1015","","","","","","1.136","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207046","8.689","0.0011","9.7518","0.0013","10.2035","0.0013","116.398","0.002","99.417","0.002","97.919","0.002","741.99","0.17","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H18 Cu F6 N4 O4 S2 -","- C28 H18 Cu F6 N4 O4 S2 -","- C28 H18 Cu F6 N4 O4 S2 -","1","0.5","OM6259","Perkins, William J.; Maxwell, Tamara; Goforth, Andrea M.; Smith, Mark D.; Peterson Jr, LeRoy; zur Loye, Hans-Conrad","<i>catena</i>-Poly[[bis(α-thenoyltrifluoroacetonato)copper(II)]-μ-1,4-di-4-pyridyl-2,3-diazabuta-1,3-diene]","Acta Crystallographica Section E","2005","61","10","m2047","m2049","10.1107/S1600536805028631","","","0.71073","MoKα","","0.037","0.036","","","0.0937","0.0946","","","","","","1.069","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2207047","19.5053","0.0016","14.0326","0.0012","20.2636","0.0017","90","","90","","90","","5546.4","0.8","295","2","295","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","N,N'-Dimethyl-1,4-diazoniabicyclo[2.2.2]octane tetrachlorocobaltate(II)","","- C8 H18 Cl4 Co N2 -","- C8 H18 Cl4 Co N2 -","- C128 H288 Cl64 Co16 N32 -","16","2","OM6260","Qu, Yang; Sun, Xian-Ming","<i>N</i>,<i>N</i>'-Dimethyl-1,4-diazoniabicyclo[2.2.2]octane tetrachlorocobaltate(II)","Acta Crystallographica Section E","2005","61","10","m2121","m2123","10.1107/S160053680503045X","","","0.71073","MoKα","","0.0475","0.0351","","","0.0819","0.0884","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207048","21.7982","0.0005","11.3347","0.0004","21.4881","0.0008","90","","118.189","0.002","90","","4679.5","0.3","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrakis(tert-butyl isocyanide-2κC)dichloro-1κCl,3κCl-di-μ-cyano-1:3κ^2^N:C;2:3κ^2^C:N- bis[1,3(η^4^)-cycloocta-1,5-diene)dirhodium(I)ruthenium(II)","","- C38 H60 Cl2 N6 Rh2 Ru -","- C38 H60 Cl2 N6 Rh2 Ru -","- C152 H240 Cl8 N24 Rh8 Ru4 -","4","0.5","OM6262","Imhof, Wolfgang; Halbauer, Kathi; Görls, Helmar","Tetrakis(<i>tert</i>-butyl isocyanide-2κ<i>C</i>)dichloro-1κ<i>Cl</i>,3κ<i>Cl</i>-di-μ-cyano-1κ<i>N</i>:2κ<i>C</i>;2κ<i>C</i>:3κ<i>N</i>-bis[1,3(η^4^)-cycloocta-1,5-diene]dirhodium(I)ruthenium(II)","Acta Crystallographica Section E","2005","61","10","m2130","m2132","10.1107/S1600536805030461","","","0.71073","MoKα","","0.0598","0.0387","","","0.0969","0.1072","","","","","","1.026","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2207049","7.4272","0.001","11.0766","0.0014","13.6124","0.0017","110.095","0.002","99.798","0.002","104.067","0.002","979.8","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","5-Methyl-2-phenyl-4-[(Z)-4-(tolylamino)phenylmethylene]pyrazol-3(2H)-one","","- C24 H21 N3 O -","- C24 H21 N3 O -","- C48 H42 N6 O2 -","2","1","RN6061","Ma, Rong-Ming","3-Methyl-1-phenyl-4-[(<i>Z</i>)-phenyl(<i>p-</i>tolylamino)methylene]-1<i>H-</i>pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","10","o3264","o3265","10.1107/S1600536805026656","","","0.71073","MoKα","","0.0578","0.0398","","","0.1081","0.1214","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207050","8.2076","0.0008","10.4721","0.0011","10.7474","0.0011","97.328","0.002","108.678","0.002","110.504","0.002","789.18","0.14","292","2","292","2","","","","","","","","7","P -1","-P 1","2","dipiperazinium heptachloro-triiododibismuthate","Bis(piperazinium) di-μ-chloro-pentachloro-triiododibismuthate","","- C8 H32 Bi2 Cl7 I3 N4 O4 -","- C8 H32 Bi2 Cl7 I3 N4 O4 -","- C8 H32 Bi2 Cl7 I3 N4 O4 -","1","0.5","RN6062","Ping-Fan Wu; Xiang-Gao Meng; Wen-Jia Chen; Dong-Sheng Li; Yong-Ge Wei","Bis(piperazinium) di-μ-chloro-pentachlorotriiododibismuthate(III) tetrahydrate","Acta Crystallographica Section E","2005","61","10","m2133","m2135","10.1107/S1600536805030424","","","0.71073","MoKα","","0.0487","0.0463","","","0.129","0.1316","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207051","9.487","0.004","11.537","0.005","13.007","0.005","99.162","0.006","109.646","0.006","100.661","0.005","1279.4","0.9","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Diaquabis(1,10-phenanthroline-κ^2^N,N')cadmium(II) pentafluoride-oxide niobate","","- C24 H20 Cd F5 N4 Nb O3 -","- C24 H20 Cd F5 N4 Nb O3 -","- C48 H40 Cd2 F10 N8 Nb2 O6 -","2","1","RN6066","Zhu, Gang; Tang, Zongxun","Diaquabis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II) pentafluorooxoniobate(V)","Acta Crystallographica Section E","2005","61","10","m2118","m2120","10.1107/S1600536805030394","","","0.71073","MoKα","","0.0497","0.0337","","","0.0805","0.0924","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207052","10.693","0.005","12.896","0.006","17.673","0.008","90","","90.871","0.009","90","","2436.8","1.9","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,5,3',5'-Tetramethyl-N,N'-bis(salicylidene)biphenyl-4,4'-diamine","","- C30 H28 N2 O2 -","- C30 H28 N2 O2 -","- C120 H112 N8 O8 -","4","1","RZ6110","Xu, Li; Kim, Youngmee; Kim, Sung-Jin","3,5,3',5'-Tetramethyl-<i>N</i>,<i>N</i>'-bis(salicylidene)biphenyl-4,4'-diamine","Acta Crystallographica Section E","2005","61","10","o3344","o3345","10.1107/S1600536805029260","","","0.71073","MoKα","","0.1702","0.0643","","","0.1323","0.1734","","","","","","0.928","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207053","8.569","0.0018","6.3333","0.0013","23.34","0.005","90","","91.532","0.004","90","","1266.2","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(2,4-Dinitrophenyl)-N'-(2-pyridylmethylene)hydrazine","pyridine-2-carbaldehyde 2,4-dinitrophenylhydrazone","","- C12 H9 N5 O4 -","- C12 H9 N5 O4 -","- C48 H36 N20 O16 -","4","1","RZ6111","Ming Yu; Zhi Fan; Zuo-Liang Jing; Xin Chen; Chun-Hua Diao; Qi-Liang Deng","<i>N</i>-(2,4-Dinitrophenyl)-<i>N</i>'-(2-pyridylmethylene)hydrazine","Acta Crystallographica Section E","2005","61","10","o3342","o3343","10.1107/S160053680502934X","","","0.71073","MoKα","","0.081","0.0401","","","0.0951","0.1177","","","","","","0.989","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207054","10.5812","0.0003","12.9766","0.0004","17.5935","0.0005","90","","95.863","0.001","90","","2403.09","0.12","105","2","105","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,6-Bis(2-chlorophenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","","- C29 H22 Cl2 N2 O2 -","- C29 H22 Cl2 N2 O2 -","- C116 H88 Cl8 N8 O8 -","4","1","RZ6112","J. Suresh; V. P. Alex Raja; S. Natarajan; S. Perumal; A. Mostad; R. V. Krishnakumar","2,6-Bis(2-chlorophenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","Acta Crystallographica Section E","2005","61","10","o3391","o3393","10.1107/S1600536805029569","","","0.71073","MoKα","","0.0428","0.0341","","","0.0902","0.0977","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207055","4.5955","0.0002","11.4301","0.0004","14.8292","0.0006","74.1696","0.0012","83.0827","0.0014","80.8197","0.0013","737.36","0.05","150","","150","","","","","","","","","4","P -1","-P 1","2","","N-Pyridin-3-ylmethylene-N-[5-(pyridine-3-ylmethyl sulfanyl)-[1,3,4]thiadiazol-2-yl]-hydrazine'","","- C14 H12 N6 S2 -","- C14 H12 N6 S2 -","- C28 H24 N12 S4 -","2","1","RZ6113","Khoo, Teng-Jin; Cowley, Andrew R.; Watkin, David J.; Tahir, M. Ibrahim M.; Crouse, Karen A.","<i>N</i>-(3-Pyridylmethylene)-<i>N</i>'-[5-(3-pyridylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]hydrazine","Acta Crystallographica Section E","2005","61","10","o3414","o3415","10.1107/S1600536805030035","","","0.71073","MoKα","","0.0795","0.0434","","0.0599","0.0493","0.0493","","","","","","1.0733","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207056","15.8702","0.0011","12.9262","0.0011","13.9436","0.0011","90","","109.468","0.003","90","","2696.9","0.4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Aquapentakis(1H-imidazole-κN3)nickel(II) dibromosuccinate","","- C19 H24 Br2 N10 Ni O5 -","- C19 H24 Br2 N10 Ni O5 -","- C76 H96 Br8 N40 Ni4 O20 -","4","0.5","RZ6115","Dai-Xi Li; Ying-Jue Shen; Yuan Xiao; Le Sun; Juan Wang; Ze-Zhao Hua","Aquapentakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) dibromosuccinate","Acta Crystallographica Section E","2005","61","10","m2145","m2147","10.1107/S1600536805030084","","","0.71073","MoKα","","0.0757","0.0496","","","0.1444","0.1555","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207057","16.136","0.002","12.752","0.002","17.771","0.002","90","","99.486","0.001","90","","3606.7","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H42 Cl5 Co N4 O6 -","- C32 H42 Cl5 Co N4 O6 -","- C128 H168 Cl20 Co4 N16 O24 -","4","1","RZ6117","Yuan, Chun-Lan","<i>trans</i>-Bis{2,4-dichloro-6-[(3-cyclohexylaminopropylimino)methyl]phenolato}cobalt(III) perchlorate","Acta Crystallographica Section E","2005","61","10","m2112","m2114","10.1107/S1600536805030345","","","0.71073","MoKα","","0.0951","0.0734","","","0.1503","0.1604","","","","","","1.153","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207058","13.0319","0.0007","8.4862","0.0004","14.4047","0.0009","90","","110.539","0.003","90","","1491.77","0.14","291","1","291","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","rac-(1S,11S,15S)-1-Hydroxymethylbicyclo[9.3.1]pentadecan-15-ol","","- C16 H30 O2 -","- C16 H30 O2 -","- C64 H120 O8 -","4","1","RZ6120","Fresu, Sonia; Müller, Kai-Sven; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","<i>rac</i>-(1<i>S</i>,11<i>S</i>,15<i>S</i>)-1-Hydroxymethylbicyclo[9.3.1]pentadecan-15-ol","Acta Crystallographica Section E","2005","61","10","o3440","o3441","10.1107/S1600536805030527","","","0.71073","MoKα","","0.0704","0.0361","","","0.0839","0.0899","","","","","","0.895","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207059","8.3335","0.0009","14.9777","0.0016","11.4724","0.0012","90","","107.99","0.002","90","","1361.9","0.3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(2-Hydroxybenzylideneamino)-3-(1H-1,2,4-yriazol-1-ylmethyl)-1H-1,2,4- triazole-5(4H)-thione","","- C12 H11 N7 O S -","- C12 H11 N7 O S -","- C48 H44 N28 O4 S4 -","4","1","RZ6121","Zhi-Qiang Hu; Yu-Qing Shang; Guan-Ping Yu; Wei-Hua Li; Liang-Zhong Xu; Bao-Rong Hou","4-(2-Hydroxybenzylideneamino)-3-(1<i>H</i>-1,2,4-triazol-1-ylmethyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","10","o3455","o3456","10.1107/S1600536805030503","","","0.71073","MoKα","","0.0387","0.031","","","0.0803","0.0866","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207060","5.2739","0.001","9.5018","0.0017","16.56","0.003","90","","99.157","0.003","90","","819.3","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(4-methylimidazolium) chloranilate","","- C14 H14 Cl2 N4 O4 -","- C14 H14 Cl2 N4 O4 -","- C28 H28 Cl4 N8 O8 -","2","0.5","SG6025","Wang, Zi-Liang; Wei, Lin-Heng","A hydrogen-bonded supramolecular complex between the chloranilic acid dianion (CA) and the 4-methylimidazole cation","Acta Crystallographica Section E","2005","61","10","o3129","o3130","10.1107/S160053680502684X","","","0.71073","MoKα","","0.0514","0.0432","","","0.1062","0.113","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207061","8.699","0.005","12.618","0.005","11.835","0.005","90","","102.934","0.005","90","","1266.1","1","85","2","85","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","adamantane-1,2-diacetate","(±)-adamantane-1,2-diyl diacetate","","- C14 H20 O4 -","- C14 H20 O4 -","- C56 H80 O16 -","4","1","SG6027","Myint, Mo Aung; Blackman, Allan G.; Tan, Eng Wui","(±)-Adamantane-1,2-diyl diacetate","Acta Crystallographica Section E","2005","61","10","o3154","o3155","10.1107/S1600536805027509","","","0.71069","MoKα","","0.036","0.0334","","","0.0945","0.0969","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207062","9.386","0.004","10.059","0.005","13.561","0.006","77.549","0.006","82.877","0.006","68.646","0.006","1162.9","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(3-methylmercapto-5-mercapto-1,2,4-thiadiazole)dibutyltin(IV)","","- C14 H24 N4 S6 Sn -","- C14 H24 N4 S6 Sn -","- C28 H48 N8 S12 Sn2 -","2","1","SG6028","Jun-Hong Zhang; Ru-Fen Zhang; Chun-Lin Ma; Da-Qi Wang","Dibutylbis(3-methylsulfanyl-1,2,4-thiadiazole-5-thiolato)tin(IV)","Acta Crystallographica Section E","2005","61","10","m2075","m2077","10.1107/S1600536805028710","","","0.71073","MoKα","","0.0478","0.0339","","","0.0734","0.0819","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207063","10.9568","0.0004","6.4297","0.0003","11.5999","0.0005","90","","104.816","0.002","90","","790.03","0.06","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Propane 1,2-diaminium hydrogenarsenate","","- C3 H13 As N2 O4 -","- C3 H13 As N2 O4 -","- C12 H52 As4 N8 O16 -","4","1","SG6029","Todd, Malcolm J.; Harrison, William T. A.","Propane-1,2-diaminium hydrogenarsenate","Acta Crystallographica Section E","2005","61","10","m2026","m2028","10.1107/S1600536805028722","","","0.71073","MoKα","","0.0423","0.0292","","","0.0556","0.0589","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207064","9.1429","0.0008","10.6796","0.0009","12.0826","0.0012","89.916","0.002","74.203","0.002","84.889","0.002","1130.38","0.18","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","di-m-4-aminobenzoato-bis[(4-aminobenzoato)(2,2'-diamino-4,4'- bithiazole)manganese(II)] dihydrate","","- C40 H40 Mn2 N12 O10 S4 -","- C40 H40 Mn2 N12 O10 S4 -","- C40 H40 Mn2 N12 O10 S4 -","1","0.5","SG6030","Bing-Xin Liu; Duan-Jun Xu","A dimeric manganese(II) complex bridged by 4-aminobenzoate","Acta Crystallographica Section E","2005","61","10","m2011","m2013","10.1107/S1600536805029016","","","0.71073","MoKα","","0.035","0.032","","","0.08","0.081","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207065","7.938","0.0005","9.3745","0.0004","22.734","0.0016","90","","98.219","0.005","90","","1674.37","0.17","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-Isopropyl-2-(4-methoxybenzylidene)-3,4-dihydronaphthalen-1(2H)-one","","- C21 H22 O2 -","- C21 H22 O2 -","- C84 H88 O8 -","4","1","SG6031","Al Jouari, Ghali; Kerbal, Abdelali; El Bali, Brahim; Bolte, Michael","4-Isopropyl-2-(4-methoxybenzylidene)-3,4-dihydronaphthalen-1(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","10","o3330","o3331","10.1107/S1600536805029028","","","0.71073","MoKα","","0.0432","0.0375","","","0.1008","0.1049","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207066","7.7961","0.0016","19.346","0.004","10.732","0.002","90","","101.78","0.03","90","","1584.5","0.6","283","2","283","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[bis[bis(1H-benzotriazole)zinc(II)]-μ~4~-benzene- 1,2,4,5-trtracarboxylato]","","- C34 H22 N12 O8 Zn2 -","- C34 H22 N12 O8 Zn2 -","- C68 H44 N24 O16 Zn4 -","2","0.5","SG6032","Zhe An; Hao Sun; Rong-Shun Wang","<i>catena</i>-Poly[bis[bis(1<i>H</i>-benzotriazole)zinc(II)]-μ~4~-benzene-1,2,4,5-tetracarboxylato], a one-dimensional coordination polymer with double chains","Acta Crystallographica Section E","2005","61","10","m2157","m2159","10.1107/S1600536805030734","","","0.71073","MoKα","","0.0502","0.037","","","0.0814","0.0864","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207067","11.1149","0.0014","12.467","0.0016","18.646","0.002","90","","99.415","0.002","90","","2549","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1'-Phenyl-2',3',5',6',7',7a'-hexahydroindan-2-spiro-2'-1H-pyrrolizidine-3'- spiro-11'-indeno[1,2-b]quinoxaline-1,3-dione","","- C35 H25 N3 O2 -","- C35 H25 N3 O2 -","- C140 H100 N12 O8 -","4","1","SJ6126","D. Gayathri; P. G. Aravindan; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu","1'-Phenyl-2',3',5',6',7',7a'-hexahydroindan-2-spiro-2'-1<i>H</i>-pyrrolizine-3'-spiro-11'-indeno[1,2-<i>b</i>]quinoxaline-1,3-dione","Acta Crystallographica Section E","2005","61","10","o3124","o3126","10.1107/S1600536805027261","","","0.71073","MoKα","","0.0586","0.0467","","","0.1193","0.1279","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207068","8.1791","0.0005","9.2534","0.0004","31.556","0.002","90","","91.637","0.003","90","","2387.3","0.2","200","2","200","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Dichlorobis[(-)-2,3,5,6-tetrahydro-6-phenylimidazo[2,1-b]thiazole]nickel(II)","","- C22 H24 Cl2 N4 Ni S2 -","- C22 H24 Cl2 N4 Ni S2 -","- C88 H96 Cl8 N16 Ni4 S8 -","4","2","SU6211","Javier A. Cabeza; Ignacio del Río; Gabriela Sánchez-Vega; Santiago García-Granda","Dichlorobis[(<i>S</i>)-2,3,5,6-tetrahydro-6-phenylimidazo[2,1-<i>b</i>]thiazole]nickel(II)","Acta Crystallographica Section E","2005","61","10","m1984","m1985","10.1107/S1600536805027893","","","1.5418","CuKα","","0.1032","0.0755","","","0.185","0.2448","","","","","","1.184","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207069","4.939","0.001","16.595","0.003","20.254","0.004","90","","90","","90","","1660.1","0.6","299","2","299","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","5,7-Dibromo-N-tosylquinolin-8-amine","","- C16 H12 Br2 N2 O2 S -","- C16 H12 Br2 N2 O2 S -","- C64 H48 Br8 N8 O8 S4 -","4","1","SU6228","Silva, Luiz Everson da; Joussef, Antonio Carlos; Foro, Sabine; Schmidt, Boris","5,7-Dibromo-<i>N</i>-tosylquinolin-8-amine","Acta Crystallographica Section E","2005","61","10","o3435","o3436","10.1107/S160053680502773X","","","1.5418","CuKα","","0.0466","0.0413","","","0.1052","0.1089","","","","","","1.079","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207070","8.247","0.001","7.242","0.001","11.414","0.002","90","","99.548","0.003","90","","672.25","0.17","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","butyrophenone derivative","4-tert-Butyl-γ-chlorobutyrophenone","","- C14 H19 Cl O -","- C14 H19 Cl O -","- C28 H38 Cl2 O2 -","2","0.5","SU6230","Anilkumar, H. G.; Vijay, T.; Yathirajan, H. S.; Narasimhamurthy, T.; Rathore, R. S.","4-<i>tert</i>-Butyl-γ-chlorobutyrophenone","Acta Crystallographica Section E","2005","61","10","o3332","o3333","10.1107/S1600536805028771","","","0.71073","MoKα","","0.0977","0.0651","","","0.1278","0.1402","","","","","","1.158","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207071","5.9593","0.0005","13.4318","0.0012","14.4116","0.0013","117.219","0.001","92.646","0.002","98.159","0.002","1007.32","0.15","208","1","208","1","","","","","","","","5","P -1","-P 1","2","","(Z)-1-Phenyl-3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2- yl)phenylamino]but-2-en-1-one","","- C22 H26 B N O3 -","- C22 H26 B N O3 -","- C44 H52 B2 N2 O6 -","2","1","TK6252","Andreas Decken; Diane A. Dickie; Paul A. Chapman; Christopher M. Vogels; Stephen A. Westcott","(<i>Z</i>)-1-Phenyl-3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylamino]but-2-en-1-one","Acta Crystallographica Section E","2005","61","10","o3147","o3148","10.1107/S1600536805027455","","","0.71073","MoKα","","0.062","0.039","","","0.095","0.103","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207072","8.442","0.002","9.858","0.002","13.61","0.003","80.156","0.001","89.412","0.001","87.877","0.001","1115.2","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","trans-diiodotetrakis(tetrahydrofuran)calcium(II)","","- C16 H32 Ca I2 O4 -","- C16 H32 Ca I2 O4 -","- C32 H64 Ca2 I4 O8 -","2","1","TK6253","Henderson, Kenneth W.; Rood, Jeffrey A.; Noll, Bruce C.","A low-temperature investigation of <i>trans</i>-diiodotetrakis(tetrahydrofuran)calcium(II)","Acta Crystallographica Section E","2005","61","10","m2006","m2007","10.1107/S1600536805028254","","","0.71073","MoKα","","0.067","0.058","","","0.158","0.171","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207073","8.911","0.007","11.568","0.009","12.595","0.01","113.744","0.011","97.157","0.014","106.082","0.013","1100","1.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Bis(N-isopropyl-N-phenylthiocarbamoyl) disulfide","","- C20 H23 N2 S4 -","- C20 H23 N2 S4 -","- C40 H46 N4 S8 -","2","1","TK6254","Raya, Indah; Baba, Ibrahim; Rosli, Fatimatul Z.; Bohari. M. Yamin","Bis(<i>N</i>-isopropyl-<i>N</i>-phenylthiocarbamoyl) disulfide","Acta Crystallographica Section E","2005","61","10","o3131","o3132","10.1107/S1600536805026838","","","0.71073","MoKα","","0.06","0.041","","","0.114","0.125","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207074","10.8432","0.0005","11.019","0.0005","11.4895","0.0005","87.389","0.004","75.577","0.004","65.539","0.004","1207.6","0.11","298","1","298","1","","","","","","","","7","P -1","-P 1","2","","μ-oxalato-1κ^2^O^1^,O^2^:2κ^2^O^1'^,O^2'^-bis[bis(1-benzyl-1H-pyrazole- κN^2^)(trifluoromethanesulfonato-κO)copper(II)]","","- C44 H40 Cu2 F6 N8 O10 S2 -","- C44 H40 Cu2 F6 N8 O10 S2 -","- C44 H40 Cu2 F6 N8 O10 S2 -","1","0.5","TK6256","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","A copper(II)‒oxalate compound resulting from the fixation of carbon dioxide: μ-oxalato-bis[bis(1-benzyl-1<i>H</i>-pyrazole)(trifluoromethanesulfonato)copper(II)]","Acta Crystallographica Section E","2005","61","10","m1904","m1906","10.1107/S160053680502739X","","","0.71073","MoKα","","0.036","0.033","","","0.104","0.111","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207075","12.0231","0.0019","5.7685","0.0008","14.434","0.002","90","","114.393","0.011","90","","911.7","0.2","296","","296","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","4-Amino-5-(2-hydroxyphenyl)-2H-1,2,4-triazole-3(4H)-thione","","- C8 H8 N4 O S -","- C8 H8 N4 O S -","- C32 H32 N16 O4 S4 -","4","1","TK6257","Dinçer, Muharrem; Özdemir, Namık; Çetin, Ahmet; Cansız, Ahmet; Şekerci, Memet","4-Amino-5-(2-hydroxyphenyl)-2<i>H</i>-1,2,4-triazole-3(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","10","o3214","o3216","10.1107/S1600536805027972","","","0.71073","MoKα","","0.046","0.038","","","0.106","0.11","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207076","15.518","0.003","9.3215","0.0018","22.942","0.005","90","","90","","90","","3318.6","1.2","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N'-(4-Hydroxybenzylidene)benzohydrazide dimethylformamide solvate","","- C17 H19 N3 O3 -","- C17 H19 N3 O3 -","- C136 H152 N24 O24 -","8","1","TK6258","Jing, Zuo-Liang; Fan, Zhi; Yu, Ming; Chen, Xin; Deng, Qi-Liang","<i>N</i>'-(4-Hydroxybenzylidene)benzohydrazide dimethylformamide solvate","Acta Crystallographica Section E","2005","61","10","o3495","o3496","10.1107/S1600536805030679","","","0.71073","MoKα","","0.137","0.046","","","0.101","0.149","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207077","6.1571","0.0003","13.7052","0.0006","7.7208","0.0003","90","","91.715","0.001","90","","651.22","0.05","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C H8 As N3 O4 -","- C H8 As N3 O4 -","- C4 H32 As4 N12 O16 -","4","1","TK6259","Wilkinson, Hazel S.; Harrison, William T. A.","Guanidinium dihydrogenarsenate","Acta Crystallographica Section E","2005","61","10","m2023","m2025","10.1107/S1600536805028825","","","0.71073","MoKα","","0.025","0.021","","","0.057","0.058","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207078","7.811","0.005","8.621","0.005","9.054","0.005","72.972","0.005","86.553","0.005","64.96","0.005","526.7","0.5","85","2","85","2","","","","","","","","6","P -1","-P 1","2","","bis(2,2'-bipyridine-κ^2^N,N')platinum(II) bis(perchlorate)","","- C20 H16 Cl2 N4 O8 Pt -","- C20 H16 Cl2 N4 O8 Pt -","- C20 H16 Cl2 N4 O8 Pt -","1","0.5","TK6260","Clare, Bronya R.; McInnes, Claire S.; Blackman, Allan G.","Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')platinum(II) bis(perchlorate)","Acta Crystallographica Section E","2005","61","10","m2042","m2043","10.1107/S1600536805029089","","","0.71069","MoKα","","0.014","0.014","","","0.036","0.036","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207079","39.113","0.006","4.5063","0.0007","20.469","0.003","90","","116.449","0.002","90","","3230.1","0.9","294","2","294","2","","","","","","","","4","C 1 c 1","C -2yc","9","","9-Benzyl-3,6-dibromo-9H-carbazole","","- C19 H13 Br2 N -","- C19 H13 Br2 N -","- C152 H104 Br16 N8 -","8","2","TK6261","Duan, Xue-Min; Huang, Peng-Mian; Zheng, Peng-Wu; Li, Jiang-sheng","9-Benzyl-3,6-dibromo-9<i>H</i>-carbazole","Acta Crystallographica Section E","2005","61","10","o3361","o3363","10.1107/S1600536805029430","","","0.71073","MoKα","","0.118","0.045","","","0.076","0.095","","","","","","0.94","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207080","13.305","0.007","5.676","0.004","12.455","0.006","90","","107.784","0.016","90","","895.6","0.9","296","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Benzoyl-1,3-oxazolidin-2-one","","- C10 H9 N O3 -","- C10 H9 N O3 -","- C40 H36 N4 O12 -","4","1","TK6290","Jing-Li Cheng; Cheng-Xia Tan; Guo-Nian Zhu","3-Benzoyl-1,3-oxazolidin-2-one","Acta Crystallographica Section E","2005","61","10","o3194","o3195","10.1107/S1600536805027984","","","0.71075","MoKα","","","0.034","","","","0.075","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207081","12.401","0.0013","5.5664","0.0006","17.3648","0.0018","90","","100.858","0.002","90","","1177.2","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2'-Biimidazol-1-ium trichloroacetate","","- C8 H7 Cl3 N4 O2 -","- C8 H7 Cl3 N4 O2 -","- C32 H28 Cl12 N16 O8 -","4","1","WK6059","Ji-Xin Yuan","2,2'-Biimidazol-1-ium trichloroacetate","Acta Crystallographica Section E","2005","61","10","o3294","o3296","10.1107/S1600536805029004","","","0.71073","MoKα","","0.0673","0.0554","","","0.1176","0.1235","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207082","9.6366","0.0001","9.6366","0.0001","11.6119","0.0003","90","","90","","120","","933.86","0.03","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","silver caesium nonamolybdenum undecasulfide","","- Ag1.91 Cs1.16 Mo9 S11 -","- Ag1.908 Cs1.161 Mo9 S11 -","- Ag3.816 Cs2.322 Mo18 S22 -","2","0.166667","WM6090","Salloum, D.; Gougeon, P.; Potel, M.","Ag~1.91~Cs~1.16~Mo~9~S~11~: a novel quaternary reduced molybdenum sulfide containing Mo~9~ clusters","Acta Crystallographica Section E","2005","61","10","i213","i215","10.1107/S1600536805028205","","","0.71069","MoKα","","0.0262","0.0217","","","0.045","0.0457","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207083","3.874","0.002","3.874","0.002","9.704","0.004","90","","90","","90","","145.64","0.12","295","2","295","2","","","","","","","","3","I 4/m m m","-I 4 2","139","Erbium dicobalt disilicide","Dicobalt erbium disilicon","","- Co2 Er Si2 -","- Co2 Er Si2 -","- Co4 Er2 Si4 -","2","0.0625","WM6091","Demchenko, Pavlo; Kończyk, Joanna; Bodak, Oksana; Marciniak, Bernard; Matvijishyn, Roman","Erbium dicobalt disilicide, ErCo~2~Si~2~","Acta Crystallographica Section E","2005","61","10","i218","i220","10.1107/S1600536805030722","","","0.71073","MoKα","","0.0229","0.0223","","","0.0494","0.0497","","","","","","1.169","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207084","10.282","0.002","10.417","0.002","11.765","0.002","90","","97.42","0.03","90","","1249.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Diaminopyridinium pyridinium-2,6-dicarboxylate","","- C12 H12 N4 O4 -","- C12 H12 N4 O4 -","- C48 H48 N16 O16 -","4","1","WN6355","Aghabozorg, Hossein; Akbari Saei, Ali; Ramezanipour, Farshid","2,6-Diaminopyridinium pyridinium-2,6-dicarboxylate: a redetermination","Acta Crystallographica Section E","2005","61","10","o3242","o3244","10.1107/S1600536805027431","","","0.71073","MoKα","","0.1069","0.0523","","","0.1405","0.1667","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207085","13.74","0.003","9.405","0.002","9.997","0.002","90","","102.19","0.004","90","","1262.7","0.5","292","2","292","2","","","","","","","","3","P 1 c 1","P -2yc","7","","(RS)-2,6-Dimethoxy-4-(2-methoxypropyl)phenol","","- C12 H18 O4 -","- C12 H18 O4 -","- C48 H72 O16 -","4","2","WN6371","Meng, Xiang-Gao; Wu, An-Xin","(<i>RS</i>)-2,6-Dimethoxy-4-(2-methoxypropyl)phenol","Acta Crystallographica Section E","2005","61","10","o3176","o3178","10.1107/S1600536805027790","","","0.71073","MoKα","","0.072","0.0571","","","0.15","0.1641","","","","","","0.967","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207086","21.8765","0.0012","14.3774","0.0008","11.7603","0.0007","90","","107.05","0.001","90","","3536.4","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(2-Acetamido-5-methylbenzoyl)indole","","- C18 H16 N2 O2 -","- C18 H16 N2 O2 -","- C144 H128 N16 O16 -","8","1","WN6372","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","2-(2-Acetamido-5-methylbenzoyl)-1<i>H-</i>indole","Acta Crystallographica Section E","2005","61","10","o3291","o3293","10.1107/S160053680502893X","","","0.71073","MoKα","","0.1088","0.0766","","","0.2021","0.2164","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207087","4.79","0.0009","13.772","0.003","17.158","0.003","90","","90","","90","","1131.9","0.4","292","2","292","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H9 Br2 N O3 -","- C9 H9 Br2 N O3 -","- C36 H36 Br8 N4 O12 -","4","1","WN6374","Qin, Shuqi; Yin, Guodong; Zhou, Baohan","2,3-Bis(bromomethyl)-1-methoxy-4-nitrobenzene","Acta Crystallographica Section E","2005","61","10","o3257","o3258","10.1107/S1600536805028618","","","0.71073","MoKα","","0.0595","0.0395","","","0.1102","0.133","","","","","","1.126","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207088","7.3382","0.0003","21.8714","0.0007","14.0755","0.0004","90","","100.464","0.001","90","","2221.5","0.13","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]-1-methylquinolinium 4-methylbenzenesulfonate","2-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]-1-methylquinolinium 4-methylbenzenesulfonate","","- C26 H25 N O5 S -","- C26 H25 N O5 S -","- C104 H100 N4 O20 S4 -","4","1","WN6375","Boonwasana Jindawong; Suchada Chantrapromma; Hoong-Kun Fun; Chatchanok Karalai","2-[(<i>E</i>)-2-(3-Hydroxy-4-methoxyphenyl)ethenyl]-1-methylquinolinium 4-methylbenzenesulfonate","Acta Crystallographica Section E","2005","61","10","o3237","o3239","10.1107/S1600536805028643","","","0.71073","MoKα","","0.0538","0.0409","","","0.0984","0.1067","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207089","7.7","0.002","9.989","0.003","11.23","0.003","102.49","0.004","108.484","0.004","97.688","0.004","780.5","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2-(2,3-dimethylphenoxy)-1-(pyridin-2-yl)-2-(1H-1,2,4-triazol-1-yl)ethanone","","- C17 H16 N4 O2 -","- C17 H16 N4 O2 -","- C34 H32 N8 O4 -","2","1","WN6377","Dai, Hong; Liu, Jian-Bing; Tao, Wei-Feng; Shao, Ling; Jin, Zhong; Fang, Jian-Xin","2-(2,3-Dimethylphenoxy)-1-(pyridin-2-yl)-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanone","Acta Crystallographica Section E","2005","61","10","o3466","o3467","10.1107/S1600536805030400","","","0.71073","MoKα","","0.0776","0.0436","","","0.1055","0.126","","","","","","1.028","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207090","7.42","0.0016","7.663","0.0016","16.407","0.003","90","","95.787","0.004","90","","928.1","0.3","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-[4-(4-Formyl-2-methoxyphenoxy)butoxy]-3-methoxybenzaldehyde","","- C20 H22 O6 -","- C20 H22 O6 -","- C40 H44 O12 -","2","0.5","WN6378","Duan, Zhong-Yu; Zhang, Wen-Jun","4-[4-(4-Formyl-2-methoxyphenoxy)butoxy]-3-methoxybenzaldehyde","Acta Crystallographica Section E","2005","61","10","o3355","o3356","10.1107/S160053680502951X","","","0.71073","MoKα","","0.0569","0.0355","","","0.0863","0.1014","","","","","","1.035","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207091","8.7299","0.0008","10.8999","0.001","9.7586","0.0008","90","","98.363","0.002","90","","918.71","0.14","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,2,3-trihydroxybenzene:1,3,5-triazine (1/1)","","- C9 H9 N3 O3 -","- C9 H9 N3 O3 -","- C36 H36 N12 O12 -","4","1","WN6380","Liliana Dobrzańska","1,2,3-Trihydroxybenzene‒1,3,5-triazine (1/1)","Acta Crystallographica Section E","2005","61","10","o3416","o3418","10.1107/S1600536805029995","","","0.71073","MoKα","","0.1196","0.0496","","","0.0884","0.1072","","","","","","0.89","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207092","11.4622","0.0004","7.3284","0.0002","26.7829","0.0009","90","","109.709","0.002","90","","2117.96","0.12","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","An unnaturally cage xanthone from <i>Cratoxylum cochinchinese</i>","8-hydroxy-13-methoxy-17,17-dimethyl-15-(3-methyl-2-butenyl)-3,16- dioxapentacyclo[11.4.1.0^2,11^.0^2,15^.0^4,9^]octadeca-4,6,8,11- tetraene-10-14-dione","","- C24 H26 O6 -","- C24 H26 O6 -","- C96 H104 O24 -","4","1","WN6381","Suchada Chantrapromma; Nawong Boonnak; Hoong-Kun Fun","8-Hydroxy-13-methoxy-17,17-dimethyl-15-(3-methyl-2-butenyl)-3,16-dioxapentacyclo[11.4.1.0^2,11^.0^2,15^.0^4,9^]octadeca-4,6,8,11-tetraene-10,14-dione","Acta Crystallographica Section E","2005","61","10","o3505","o3507","10.1107/S1600536805030801","","","0.71073","MoKα","","0.0689","0.0627","","","0.178","0.1827","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207093","6.9694","0.0019","7.833","0.002","12.99","0.004","90","","105.175","0.004","90","","684.4","0.3","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(3-nitrobenzylidene)hydrazine","","- C14 H10 N4 O4 -","- C14 H10 N4 O4 -","- C28 H20 N8 O8 -","2","0.5","WN6382","Zheng, Peng-Wu; Wang, Wei; Duan, Xue-Min","<i>N</i>,<i>N</i>'-Bis(3-nitrobenzylidene)hydrazine","Acta Crystallographica Section E","2005","61","10","o3485","o3486","10.1107/S1600536805030631","","","0.71073","MoKα","","0.0641","0.0381","","","0.0949","0.1158","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207094","8.0012","0.0002","4.6257","0.0001","17.1148","0.0005","90","","96.413","0.001","90","","629.47","0.03","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-(4-Aminophenyl)-3-(3-bromophenyl)prop-2-en-1-one","","- C15 H12 Br N O -","- C15 H12 Br N O -","- C30 H24 Br2 N2 O2 -","2","1","WN6384","S. Sathiya Moorthi; K. Chinnakali; S. Nanjundan; R. Santhi; Hoong-Kun Fun","1-(4-Aminophenyl)-3-(3-bromophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","10","o3514","o3516","10.1107/S1600536805030783","","","0.71073","MoKα","","0.0356","0.0302","","","0.0804","0.0884","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207095","24.083","0.003","7.393","0.001","18.82","0.003","90","","117.765","0.002","90","","2965","0.7","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","1-Benzoyl-6-methyl-3-methylsulfanyl-6,7-dihydro-1H-pyrano[4,3-c]pyrazol-4-one","","- C15 H14 N2 O3 S -","- C15 H14 N2 O3 S -","- C120 H112 N16 O24 S8 -","8","2","WW6380","Hao, Jing-Jun; Gao, Feng; Wang, You-Ming; Li, Zheng-Ming","1-Benzoyl-6-methyl-3-methylsulfanyl-6,7-dihydro-1<i>H</i>-pyrano[4,3-<i>c</i>]pyrazol-4-one","Acta Crystallographica Section E","2005","61","10","o3470","o3471","10.1107/S1600536805025547","","","0.71073","MoKα","","0.0444","0.033","","","0.0779","0.0832","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207096","8.3002","0.0006","20.6868","0.0014","8.5584","0.0006","90","","90","","90","","1469.52","0.18","130","2","130","2","","","","","","","","4","P c a 21","P 2c -2ac","29","N-(nitroso)-8,9-benzo-1-aza-4,7,10,13-tetraoxacyclopentadeca-8-ene","11-Nitroso-6,7,10,11,12,13,15,16-octahydro-9H-5,8,14,17- tetraoxa-11-azabenzocyclopentadecene","","- C14 H20 N2 O5 -","- C14 H20 N2 O5 -","- C56 H80 N8 O20 -","4","1","WW6393","Simonov, Yurii A.; Gonta, Maria V.; Yavolovskii, Arkadii A.","11-Nitroso-6,7,10,11,12,13,15,16-octahydro-9<i>H</i>-5,8,14,17-tetraoxa-11-azabenzocyclopentadecene","Acta Crystallographica Section E","2005","61","10","o3136","o3139","10.1107/S1600536805027315","","","0.71073","MoKα","","0.0304","0.029","","","0.0703","0.0712","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207097","9.756","0.002","10.608","0.002","11.716","0.003","110.123","0.004","98.754","0.004","92.119","0.004","1120","0.4","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","Diethyl 5,10-dihydro-9-methoxy-6-nitro-4,11-dioxo-cis-1H,3H,4H,11H-2-oxa- 3a,4a,10a,11a-tetraazabenz[f]indeno[2,1,7-ija]azulene-11b,11c-dicarboxylate","","- C21 H23 N5 O10 -","- C21 H23 N5 O10 -","- C42 H46 N10 O20 -","2","1","WW6404","Zhou, Bao-Han; Qu, Jiang-Lan; Wu, An-Xin","Diethyl 5,10-dihydro-9-methoxy-6-nitro-4,11-dioxo-<i>cis</i>-1<i>H</i>,3<i>H</i>,4<i>H</i>,11<i>H</i>-2-oxa-3a,4a,10a,11a-tetraazabenz[<i>f</i>]indeno[2,1,7-<i>ija</i>]azulene-11b,11c-dicarboxylate","Acta Crystallographica Section E","2005","61","10","o3297","o3298","10.1107/S1600536805028977","","","0.71073","MoKα","","0.057","0.0448","","","0.1257","0.1346","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207098","23.5242","0.0018","11.1168","0.0009","23.8578","0.0019","90","","115.325","0.001","90","","5639.5","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Tris(2,2'-biimidazole)nickel(II) phthalate","Tris(2,2'-biimidazole)nickel(II) phthalate","","- C26 H22 N12 Ni O4 -","- C26 H22 N12 Ni O4 -","- C208 H176 N96 Ni8 O32 -","8","2","WW6413","Yang, Li-Ning; Li, Jun; Zhang, Feng-Xing","Tris(2,2'-biimidazole)nickel(II) phthalate","Acta Crystallographica Section E","2005","61","10","m2169","m2171","10.1107/S1600536805030941","","","0.71073","MoKα","","0.0698","0.0433","","","0.1315","0.1459","","","","","","1.054","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207099","3.9737","0.0009","18.16","0.004","8.1865","0.0019","90","","102.596","0.004","90","","576.5","0.2","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 1H-1,2,4-triazole-3-carboxylate","","- C4 H5 N3 O2 -","- C4 H5 N3 O2 -","- C16 H20 N12 O8 -","4","1","WW6417","Guo, Xianghai; Wang, Qing-Xian","Methyl 1<i>H</i>-1,2,4-triazole-3-carboxylate","Acta Crystallographica Section E","2005","61","10","o3217","o3218","10.1107/S1600536805028102","","","0.71073","MoKα","","0.0591","0.0372","","","0.0966","0.1105","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207100","15.411","0.0018","6.6402","0.0008","14.6523","0.0017","90","","108.898","0.002","90","","1418.6","0.3","292","2","292","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","2,5-Bis(2-methoxyphenyl)furan","","- C18 H16 O3 -","- C18 H16 O3 -","- C72 H64 O12 -","4","1","WW6423","Meng, Xiang-Gao; Wu, An-Xin","2,5-Bis(2-methoxyphenyl)furan","Acta Crystallographica Section E","2005","61","10","o3192","o3193","10.1107/S1600536805027911","","","0.71073","MoKα","","0.0916","0.0528","","","0.1205","0.139","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207101","9.9075","0.0004","19.0621","0.0007","13.5418","0.0005","90","","108.977","0.002","90","","2418.47","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,4-Dinitro-N,N,N',N'-tetraphenylthiophene-2,5-diamine","","- C28 H20 N4 O4 S -","- C28 H20 N4 O4 S -","- C112 H80 N16 O16 S4 -","4","1","WW6424","Huang, Ping-Hsin; Shen, Jiun-Yi; Chang, Yu-Tang; Wen, Yuh-Sheng; Yeh, Ming-Chang P.; Lin, Jiann T.","3,4-Dinitro-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetraphenylthiophene-2,5-diamine","Acta Crystallographica Section E","2005","61","10","o3315","o3316","10.1107/S1600536805029120","","","0.71073","MoKα","","0.0543","0.0393","","","0.0943","0.1006","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207102","9.5977","0.0019","11.444","0.002","14.018","0.003","78.5","0.03","71.77","0.03","86.82","0.03","1433","0.6","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[aquasilver(I)-μ-4,4'-bipyridine] catena-poly[[aqua(naphthalene-1,4-dicarboxylato)silver(I)]-μ-4,4'-bipyridine] polyhydrate","","- C32 H28 Ag2 N4 O7 -","- C32 H28 Ag2 N4 O7 -","- C64 H56 Ag4 N8 O14 -","2","1","XU6029","Ling Ye; Ying Wu","<i>catena</i>-Poly[aquasilver(I)-μ-4,4'-bipyridine] <i>catena</i>-poly[[aqua(naphthalene-1,4-dicarboxylato)silver(I)]-μ-4,4'-bipyridine] polyhydrate","Acta Crystallographica Section E","2005","61","10","m1894","m1896","10.1107/S1600536805026802","","","0.71073","MoKα","","0.05","0.037","","","0.09","0.096","","","","","","1.097","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207103","10.836","0.003","22.2556","0.0015","10.023","0.002","90","","114.11","0.03","90","","2206.3","0.9","293","","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-[1-(ferrocenylcarbonyl)prop-1-en-2-ylamino]-3-hydroxypropionate dichloromethane solvate","","- C20 H25 Cl2 Fe N O4 -","- C20 H25 Cl2 Fe N O4 -","- C80 H100 Cl8 Fe4 N4 O16 -","4","1","XU6040","Yao-Cheng Shi; Chun-Xia Sui; Hua-Mei Yang","Ethyl 2-[1-(ferrocenylcarbonyl)prop-1-en-2-ylamino]-3-hydroxypropionate dichloromethane solvate","Acta Crystallographica Section E","2005","61","10","m1900","m1901","10.1107/S1600536805027212","","","0.71073","MoKα","","0.129","0.065","","","0.162","0.202","","","","","","1.055","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207104","11.278","0.002","11.532","0.002","10.802","0.002","90","","90","","90","","1404.9","0.4","295","2","295","2","","","","","","","","5","P n n m","-P 2 2n","58","","catena-poly[[di-μ-acetato-1κO:2κO'-bis[(acetato-κ^2^O,O')nickel(II)]]- di-μ-4,4'-bipyridine-1κN:1'κN';2κN:2'κN']","","- C14 H14 N2 Ni O4 -","- C14 H14 N2 Ni O4 -","- C56 H56 N8 Ni4 O16 -","4","0.5","XU6044","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","The ribbon structure of nickel(II) acetate‒4,4'-bipyridine","Acta Crystallographica Section E","2005","61","10","m1897","m1899","10.1107/S1600536805027078","","","0.71073","MoKα","","0.106","0.074","","","0.137","0.148","","","","","","1.18","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207105","9.337","0.003","9.531","0.002","9.538","0.002","119.477","0.004","101.018","0.005","94.14","0.005","711.4","0.3","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Hexaaquamanganese(II) dichloride bis(hexamethylenetetraamine) tetrahydrate","","- C12 H44 Cl2 Mn N8 O10 -","- C12 H44 Cl2 Mn N8 O10 -","- C12 H44 Cl2 Mn N8 O10 -","1","0.5","XU6047","Chen, Zi-Lu; Li, Shi-Bing; Qiu, Zhi-Hui; Zeng, Qing-Fen; Liang, Fu-Pei","Hexaaquamanganese(II) dichloride bis(hexamethylenetetramine) tetrahydrate","Acta Crystallographica Section E","2005","61","10","m1931","m1932","10.1107/S1600536805027571","","","0.71073","MoKα","","0.074","0.042","","","0.096","0.111","","","","","","1.038","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207106","17.136","0.003","10.946","0.002","20.658","0.004","90","","108.39","0.03","90","","3676.7","1.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","{μ-2-[1-(N,N-Dimethylamino)ethyl]ferrocene-1,1'-diylbis(diphenylphosphine)- κ^2^P:P'}bis[chlorogold(I)]","","- C38 H37 Au2 Cl2 Fe N P2 -","- C38 H37 Au2 Cl2 Fe N P2 -","- C152 H148 Au8 Cl8 Fe4 N4 P8 -","4","1","XU6048","Sam, Zolisa A.; Oskarsson, Åke; Elmroth, Sofi K. C.; Roodt, Andreas","{μ-2-[1-(<i>N</i>,<i>N</i>-Dimethylamino)ethyl]ferrocene-1,1'-diylbis(diphenylphosphine)- κ^2^<i>P</i>:<i>P</i>'}bis[chlorogold(I)]","Acta Crystallographica, Section E","2005","61","10","o2090","o2092","10.1107/S1600536805029582","","","0.71073","MoKα","","","0.049","","","","0.109","","","","","","0.992","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207107","10.383","0.003","17.997","0.005","20.207","0.006","90","","96.928","0.005","90","","3748.4","1.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-3-Mercaptobenzoato-κ^2^O:S-bis(triphenyltin)","","- C43 H34 O2 S Sn2 -","- C43 H34 O2 S Sn2 -","- C172 H136 O8 S4 Sn8 -","4","1","XU6049","Qing-Fu Zhang; Ru-Fen Zhang; Chun-Lin Ma","μ-3-Mercaptobenzoato-κ^2^<i>O</i>:<i>S</i>-bis(triphenyltin)","Acta Crystallographica Section E","2005","61","10","m1923","m1924","10.1107/S1600536805027637","","","0.71073","MoKα","","0.044","0.027","","","0.061","0.071","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207108","10.116","0.002","8.7131","0.0018","24.608","0.005","90","","96.763","0.004","90","","2153.9","0.8","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethyl 2,6-bis(2-hydroxyethyl)-4,8-dioxo-1,2,5,6-tetrahydrohydro-2,3a,4a,6,7a,8a- hexaazacyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C18 H28 N6 O8 -","- C18 H28 N6 O8 -","- C72 H112 N24 O32 -","4","1","XU6051","Li, Yi-Tao; Chen, Yun-Feng; She, Neng-Fang; Wu, An-Xin","Diethyl 2,6-bis(2-hydroxyethyl)-4,8-dioxo-1,2,5,6-tetrahydrohydro-2,3a,4a,6,7a,8a-hexaazacyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2005","61","10","o3364","o3365","10.1107/S1600536805027625","","","0.71073","MoKα","","0.069","0.054","","","0.14","0.155","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207109","5.9847","0.0005","21.365","0.002","7.87","0.0006","90","","103.605","0.001","90","","978.05","0.14","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(N-phenylpyrazole-1-carboximidothioato-κ^2^N^2^,S)nickel(II)","","- C20 H16 N6 Ni S2 -","- C20 H16 N6 Ni S2 -","- C40 H32 N12 Ni2 S4 -","2","0.5","XU6054","Hossaini Sadr, Moayad; Sardroodi, Jahanbin; Shagagi, Zohre; Ng, Seik Weng","Bis(<i>N</i>-phenylpyrazole-1-carboximidothioato-κ^2^<i>N</i>^2^,<i>S</i>)nickel(II)","Acta Crystallographica Section E","2005","61","10","m1955","m1956","10.1107/S1600536805027960","","","0.71073","MoKα","","0.086","0.065","","","0.16","0.173","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207110","8.8145","0.0003","11.8211","0.0005","25.887","0.001","90","","97.046","0.001","90","","2676.98","0.18","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[diaqua(pyrimidin-2-ylsulfanylacetato)lanthanum(III)]-di- μ-pyrimidin-2-ylsulfanylacetato] trihydrate]","","- C18 H25 La N6 O11 S3 -","- C18 H25 La N6 O11 S3 -","- C72 H100 La4 N24 O44 S12 -","4","1","XU6055","Hao, Hong-Qing; Zhang, Hui; Chen, Jian-Gu; Ng, Seik Weng","<i>catena</i>-Poly[[[diaqua(pyrimidin-2-ylsulfanylacetato)lanthanum(III)]-di-μ-pyrimidin-2-ylsulfanylacetato] trihydrate]","Acta Crystallographica Section E","2005","61","10","m1960","m1962","10.1107/S1600536805028096","","","0.71073","MoKα","","0.047","0.044","","","0.107","0.11","","","","","","1.16","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207111","11.1861","0.0017","10.3346","0.0016","19.517","0.003","90","","101.377","0.003","90","","2211.9","0.6","292","2","292","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H17 Cl2 N3 O2 S -","- C24 H17 Cl2 N3 O2 S -","- C96 H68 Cl8 N12 O8 S4 -","4","1","YA6254","Liu, Jian-Chao; Peng, Hao; Meng, Xiang-Gao; Ding, Ming-Wu; He, Hong-Wu","8-(4-Chlorophenoxy)-7-(4-chlorophenyl)-1,2,5-trimethylthieno[2',3';2,3]pyrido[4,5-<i>d</i>]pyrimidin-6(7<i>H</i>)-one","Acta Crystallographica Section E","2005","61","10","o3259","o3260","10.1107/S1600536805028783","","","0.71073","MoKα","","0.069","0.05","","","0.136","0.158","","","","","","1.1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207112","24.987","0.003","7.438","0.001","17.215","0.002","90","","104.57","0.01","90","","3096.6","0.7","295","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(2,2'-Bipyridyl-κ^2^N,N')(chloranilato-κ^2^O,O')copper(II)","","- C16 H8 Cl2 Cu N2 O4 -","- C16 H8 Cl2 Cu N2 O4 -","- C128 H64 Cl16 Cu8 N16 O32 -","8","1","YA6258","Reinoso, Santiago; Vitoria, Pablo; San Felices, Leire; Lezama, Luis; Gutiérrez-Zorrilla, Juan M.","(2,2'-Bipyridyl-κ^2^<i>N</i>,<i>N</i>')(chloranilato-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2005","61","10","m1925","m1927","10.1107/S1600536805027649","","","0.71073","MoKα","","0.111","0.035","","","0.055","0.065","","","","","","0.74","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207113","11.1489","0.0006","11.9699","0.0006","12.5693","0.0006","99.302","0.001","93.69","0.001","107.155","0.001","1570.48","0.14","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H58 Cu3 N12 O20 S2 -","- C56 H56 Cu3 N12 O20 S2 -","- C56 H56 Cu3 N12 O20 S2 -","1","0.5","YA6263","Fan, Sai-Rong; Zhu, Long-Guan","<i>catena</i>-Poly[[hexakis(1<i>H</i>-benzimidazole)bis(μ^2^-5-sulfonatosalicylato)tricopper(II)] octahydrate]","Acta Crystallographica Section E","2005","61","10","m2080","m2082","10.1107/S160053680503000X","","","0.71073","MoKα","","0.075","0.07","","","0.159","0.161","","","","","","1.22","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207114","6.303","0.002","7.745","0.003","17.424","0.001","90","","96.64","0.01","90","","844.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H7 N O S -","- C9 H7 N O S -","- C36 H28 N4 O4 S4 -","4","1","YA6265","Davis, Rohan A.; Carroll, Anthony R.; Quinn, Ronald J.; Healy, Peter C.; Tiekink, Edward R. T.","4-(2-Thienyl)-1<i>H</i>-pyrrole-2-carbaldehyde","Acta Crystallographica Section E","2005","61","10","o3401","o3402","10.1107/S1600536805029636","","","0.71069","MoKα","","0.086","0.036","","","0.092","0.112","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207116","22.216","0.002","9.2475","0.001","23.913","0.002","90","","105.778","0.002","90","","4727.6","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triethylaminium 4-(2-chlorobenzoyl)-3-methyl-1-(p-tolyl)-5-pyrazol-5-olate","","- C24 H30 Cl N3 O2 -","- C24 H30 Cl N3 O2 -","- C192 H240 Cl8 N24 O16 -","8","2","AC6201","Duan, Xue-Min; Fan, Mei-Lian; Zheng, Peng-Wu","Triethylaminium 4-(2-chlorobenzoyl)-3-methyl-1-(<i>p</i>-tolyl)-1<i>H</i>-pyrazol-5-olate","Acta Crystallographica Section E","2005","61","11","o3831","o3833","10.1107/S1600536805033441","","","0.71073","MoKα","","0.0942","0.0563","","","0.1533","0.1799","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207119","8.083","0.002","12.274","0.003","11.04","0.003","90","","95.2","0.03","90","","1090.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Amino-4-methylsulfonyl-1-phenyl-1H-pyrazole","","- C10 H11 N3 O2 S -","- C10 H11 N3 O2 S -","- C40 H44 N12 O8 S4 -","4","1","AC6208","Viktor Kettmann; Jan Lokaj; Viktor Milata; Petra C̆ernuchová; André Loupy; Giang Vo-Thanh","5-Amino-4-methylsulfonyl-1-phenyl-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2005","61","11","o3852","o3854","10.1107/S1600536805033556","","","0.71073","MoKα","","0.0488","0.0383","","","0.0992","0.1055","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207121","8.3295","0.0005","12.611","0.0008","15.3711","0.0012","90","","94.642","0.006","90","","1609.34","0.19","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Chloro[hydrotris(pyrazol-1-yl)borato]oxo(1H-pyrazole)vanadium(IV)","","- C12 H14 B Cl N8 O V -","- C12 H14 B Cl N8 O V -","- C48 H56 B4 Cl4 N32 O4 V4 -","4","1","AC6210","McLauchlan, Craig C.; McDonald, Kenneth J.","Chloro[hydrotris(pyrazol-1-yl)borato]oxo(1<i>H</i>-pyrazole)vanadium(IV)","Acta Crystallographica Section E","2005","61","11","m2379","m2381","10.1107/S1600536805033568","","","0.71073","MoKα","","0.0806","0.0735","","","0.1231","0.1261","","","","","","1.235","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207122","12.225","0.003","7.618","0.002","11.639","0.003","90","","102.66","0.004","90","","1057.6","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Acetone 4-phenylthiosemicarbazone","","- C10 H13 N3 S -","- C10 H13 N3 S -","- C40 H52 N12 S4 -","4","1","AC6214","Venkatraman, Ramaiyer; Swesi, Abdurazak T.; Bohari M. Yamin","Acetone 4-phenylthiosemicarbazone","Acta Crystallographica Section E","2005","61","11","o3914","o3916","10.1107/S1600536805034409","","","0.71073","MoKα","","0.047","0.043","","","0.12","0.123","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207129","10.418","0.005","16.043","0.005","11.484","0.005","90","","98.031","0.005","90","","1900.6","1.4","292","2","292","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(3-methylisoquinoline-κN)silver(I) nitrate","","- C20 H18 Ag N3 O3 -","- C20 H18 Ag N3 O3 -","- C80 H72 Ag4 N12 O12 -","4","0.5","AT6040","Xian-Wu Dong; Hua Wu; Jian-Fang Ma","Bis(3-methylisoquinoline-κ<i>N</i>)silver(I) nitrate","Acta Crystallographica Section E","2005","61","11","m2400","m2401","10.1107/S1600536805034112","","","0.71073","MoKα","","0.0539","0.0455","","","0.16","0.165","","","","","","1.084","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207130","9.0708","0.0018","15.997","0.006","12.113","0.002","90","0.04","111.28","0.03","90","0.03","1637.8","0.8","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Diisopropyl N,N'-(4-methyl-m-phenylene)dicarbamate","","- C15 H22 N2 O4 -","- C15 H22 N2 O4 -","- C60 H88 N8 O16 -","4","1","AT6041","Yong-Yan Lu; Qiu-Xiang Yin; Jing-Kang Wang; Lina Zhou","Diisopropyl <i>N</i>,<i>N</i>'-(4-methyl-<i>m</i>-phenylene)dicarbamate","Acta Crystallographica Section E","2005","61","11","o3874","o3875","10.1107/S1600536805034124","","","0.71073","MoKα","","0.0491","0.0399","","","0.0971","0.1035","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207132","14.882","0.005","12.213","0.003","10.461","0.003","90","","104.68","0.013","90","","1839.3","0.9","296","1","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-[4-Cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenylsulfonyl)- 2-hydroxy-2-methylpropionamide","","- C18 H14 F4 N2 O4 S -","- C18 H14 F4 N2 O4 S -","- C72 H56 F16 N8 O16 S4 -","4","1","AT6044","Xiu-Rong Hu; Jian-Ming Gu","<i>N</i>-[4-Cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenylsulfonyl)-2-hydroxy-2-methylpropionamide","Acta Crystallographica Section E","2005","61","11","o3897","o3898","10.1107/S1600536805034501","","","0.71075","MoKα","","","0.04","","","","0.0981","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207133","7.7629","0.0007","14.0592","0.0012","15.099","0.0013","90","","93.955","0.002","90","","1644","0.2","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(4aS,10aR)-1,2,3,4,4a,10a-Hexahydro-6,7-dimethoxy-1,1,4a-trimethylphenanthrene- 9,10-dione","","- C19 H24 O4 -","- C19 H24 O4 -","- C76 H96 O16 -","4","1","AT6045","Yi Xiong; Cui-Rong Sun; Mao-Lin Hu; Miao-Chang Liu","(4a<i>SR</i>,10a<i>RS</i>)-1,2,3,4,4a,10a-Hexahydro-6,7-dimethoxy-1,1,4a-trimethylphenanthrene-9,10-dione","Acta Crystallographica Section E","2005","61","11","o3899","o3900","10.1107/S1600536805034495","","","0.71073","MoKα","","0.0927","0.0831","","","0.1603","0.1649","","","","","","1.317","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207135","7.336","0.0003","8.747","0.0004","10.35","0.0003","90","","90.763","0.002","90","","664.08","0.05","150","2","150","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Dibromo(η^5^,η^5^-propane-2,2-diyldicyclopentadienyl)zirconium(IV)","","- C13 H14 Br2 Zr -","- C13 H14 Br2 Zr -","- C26 H28 Br4 Zr2 -","2","0.5","BD6012","Erben, Milan; Císařová, Ivana; Vinklárek, Jaromír; Picka, Michal","Dibromo(η^5^,η^5^-propane-2,2-diyldicyclopentadienyl)zirconium(IV)","Acta Crystallographica Section E","2005","61","11","m2424","m2425","10.1107/S1600536805034690","","","0.71073","MoKα","","0.0365","0.0269","","","0.0597","0.0648","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207139","16.534","0.005","7.538","0.002","11.228","0.003","90","","108.554","0.005","90","","1326.6","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-3-methoxybenzaldehyde (pyridine-2-carbonyl)hydrazone","","- C14 H13 N3 O3 -","- C14 H13 N3 O3 -","- C56 H52 N12 O12 -","4","1","BH6037","Liu, Ming-Li; Dou, Jian-Min; Wang, Da-Qi; Li, Da-Cheng","2-Hydroxy-3-methoxybenzaldehyde (pyridine-2-carbonyl)hydrazone","Acta Crystallographica Section E","2005","61","11","o3876","o3878","10.1107/S1600536805034100","","","0.71073","MoKα","","0.0952","0.0435","","","0.102","0.1291","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207140","12.764","0.009","7.361","0.005","31.03","0.02","90","","90","","90","","2915","3","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","6-[4-(2-Chloroethyloxy)naphthyl]fulvene","","- C18 H15 Cl O -","- C18 H15 Cl O -","- C144 H120 Cl8 O8 -","8","1","BH6042","Li, Jie; Ma, Jian-Ping; Huang, Ru-Qi; Dong, Yu-Bin","6-[4-(2-Chloroethyloxy)naphthyl]fulvene","Acta Crystallographica Section E","2005","61","11","o3901","o3902","10.1107/S1600536805034483","","","0.71073","MoKα","","0.1184","0.0619","","","0.1262","0.1445","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207141","8.491","0.0017","9.655","0.0019","10.812","0.002","70.66","0.03","67.36","0.03","72.18","0.03","755.5","0.3","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","catena-poly[[diaquacobalt(II)]-μ- {μ-mellitato-κ^2^O^1^:O^4^-bis[pentaaquacobalt(II)]}- κ^4^O^2^,O^3^:O^5^,O^6^] hexahydrate]","","- C12 H36 Co3 O30 -","- C12 H36 Co3 O30 -","- C12 H36 Co3 O30 -","1","0.5","BR6215","Ji-Chun Cui","A triclinic polymorph of <i>catena</i>-poly[[diaquacobalt(II)]-μ-{μ-mellitato-κ^2^<i>O</i>^1^:<i>O</i>^4^-bis[pentaaquacobalt(II)]}-κ^4^<i>O</i>^2^,<i>O</i>^3^:<i>O</i>^5^,<i>O</i>^6^] hexahydrate]","Acta Crystallographica Section E","2005","61","11","m2209","m2211","10.1107/S160053680503134X","","","0.71073","MoKα","","0.0316","0.0266","","","0.0753","0.0802","","","","","","0.976","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207142","8.28","0.0017","10.668","0.002","15.501","0.003","86.62","0.03","85.99","0.03","70.92","0.03","1289.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaquatetrakis(μ-2-phenylquinoline-4-carboxylato- κ^2^O:O')dicopper(II)(Cu—Cu)","","- C64 H44 Cu2 N4 O10 -","- C64 H44 Cu2 N4 O10 -","- C64 H44 Cu2 N4 O10 -","1","0.5","BR6220","Che, Guang-Bo; Liu, Chun-Bo; Cui, Yun-Cheng; Li, Chuan-Bi","Diaquatetrakis(μ-2-phenylquinoline-4-carboxylato-κ^2^<i>O</i>:<i>O</i>')dicopper(II)(<i>Cu</i>—<i>Cu</i>)","Acta Crystallographica Section E","2005","61","11","m2449","m2451","10.1107/S1600536805034793","","","0.71073","MoKα","","0.0568","0.0459","","","0.1171","0.1227","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207143","10.088","0.002","10.182","0.002","15.247","0.002","86.53","0.02","88.44","0.02","89.81","0.02","1562.7","0.5","143","2","143","2","","","","","","","","3","P -1","-P 1","2","","1^1^,1^3^,4^1^,4^3^-Tetrahydro-1,4(4,7)-di(benzo[c]thiophena)cyclohexaphane","","- C20 H20 S2 -","- C20 H20 S2 -","- C80 H80 S8 -","4","2","BT6742","Kannan, Arunchalam; Dix, Ina; Hopf, Henning; Jones, Peter G.","[2.2]Dihydroisobenzothiophenophane","Acta Crystallographica Section E","2005","61","11","o3562","o3564","10.1107/S160053680502979X","","","0.71073","MoKα","","0.058","0.0443","","","0.0974","0.1068","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207144","8.9585","0.0013","10.5522","0.0015","12.3183","0.0018","79.442","0.002","78.703","0.002","71.864","0.002","1075.8","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","Lamotrigine benzoate dimethylformamide solvate","3,5-diamino-6-(2,3-dichlorophenyl)-1,2,4-triazin-2-ium benzoate dimethylformamide solvate","","- C19 H20 Cl2 N6 O3 -","- C19 H20 Cl2 N6 O3 -","- C38 H40 Cl4 N12 O6 -","2","1","BT6748","Balasubramanian Sridhar; Krishnan Ravikumar","Lamotriginium benzoate dimethylformamide solvate","Acta Crystallographica Section E","2005","61","11","o3805","o3807","10.1107/S1600536805033428","","","0.71073","MoKα","","0.0993","0.081","","","0.2264","0.2448","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207145","13.9094","0.0009","6.8497","0.0005","21.8148","0.0014","90","","90","","90","","2078.4","0.2","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Poly[(μ~6~-1,4-benzenedicarboxylato)hemi(μ~6~-succinato)gadolinium(III)]","","- C20 H12 Gd2 O12 -","- C20 H12 Gd2 O12 -","- C80 H48 Gd8 O48 -","4","0.5","BT6749","Chun-Xiang Wang; Zhi-Feng Li","Poly[bis(μ~4~-1,4-benzenedicarboxylato)(μ~6~-succinato)digadolinium(III)]","Acta Crystallographica Section E","2005","61","11","m2212","m2213","10.1107/S1600536805031314","","","0.71073","MoKα","","0.019","0.0173","","","0.0433","0.044","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207146","10.483","0.001","12.133","0.001","12.87","0.001","96.24","0.01","108.27","0.01","107.14","0.01","1448.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1'-Methyl-4',5-diphenyl-5,6,7,8,9,10-hexahydro-1,3- cycloheptapyrimidino[2,3-b]thiazole-2-spiro-3'-pyrrolidine-2'-spiro- 3''-1H-indole-2'',3(2H,3''H)-dione","","- C34 H32 N4 O2 S -","- C34 H32 N4 O2 S -","- C68 H64 N8 O4 S2 -","2","1","BT6750","D. Gayathri; D. Velmurugan; K. Ravikumar; M. Purvachandran; R. Raghunathan","1'-Methyl-4',5-diphenyl-5,6,7,8,9,10-hexahydro-1,3-cycloheptapyrimidino[2,3-<i>b</i>]thiazole-2-spiro-3'-pyrrolidine-2'-spiro-3''-1<i>H</i>-indole-2'',3(2<i>H</i>,3''<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","11","o3556","o3558","10.1107/S1600536805031272","","","0.71073","MoKα","","0.0489","0.0423","","","0.1166","0.1225","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207147","9.1006","0.0018","18.019","0.004","12.701","0.003","90","","95.23","0.03","90","","2074.1","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[tris(ethylenediamine)manganese(II)] di-μ-tellurido-bis[ditelluridostannate(IV)]","","- C12 H48 Mn2 N12 Sn2 Te6 -","- C12 H48 Mn2 N12 Sn2 Te6 -","- C24 H96 Mn4 N24 Sn4 Te12 -","2","0.5","BT6751","Anna Kromm; William S. Sheldrick","Bis[tris(ethylenediamine)manganese(II)] di-μ-tellurido-bis[ditelluridostannate(IV)] (monoclinic modification)","Acta Crystallographica Section E","2005","61","11","m2234","m2236","10.1107/S1600536805031703","","","0.71073","MoKα","","0.0467","0.0365","","","0.1032","0.1063","","","","","","1.382","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207148","6.1397","0.0005","7.6596","0.0007","11.1439","0.001","72.484","0.001","89.979","0.001","85.553","0.002","498.12","0.08","273","2","273","2","","","","","","","","5","P 1","P 1","1","","N,6-Bis(4-fluorophenyl)-2-(4-hydroxyphenyl)-3,4,5,6-tetrahydro-2H-pyran- 3-carboxamide","","- C24 H21 F2 N O3 -","- C24 H21 F2 N O3 -","- C24 H21 F2 N O3 -","1","1","BT6753","G. Y. S. K. Swamy; K. Ravikumar; L. K. Wadhwa; Rahul Saxena; Saranjit Singh","(2<i>R</i>*,3<i>R</i>*,6<i>S</i>*)-<i>N</i>,6-Bis(4-fluorophenyl)-2-(4-hydroxyphenyl)-3,4,5,6-tetrahydro-2<i>H</i>-pyran-3-carboxamide","Acta Crystallographica Section E","2005","61","11","o3608","o3610","10.1107/S1600536805031818","","","0.71073","MoKα","","0.0489","0.0444","","","0.0984","0.101","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207149","7.9154","0.0009","13.7376","0.0014","22.98","0.003","90","","90","","90","","2498.8","0.5","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(Z)-[2-(1-Methyl-1H-indol-3-yl)methylidene]cyclohexanone","","- C16 H17 N O -","- C16 H17 N O -","- C128 H136 N8 O8 -","8","1","BT6754","K. Ravikumar; B. Sridhar; C. J.Saikia; R. C. Boruah","(<i>Z</i>)-[2-(1-Methyl-1<i>H</i>-indol-3-yl)methylidene]cyclohexanone","Acta Crystallographica Section E","2005","61","11","o3672","o3673","10.1107/S1600536805032563","","","0.71073","MoKα","","0.0636","0.0516","","","0.133","0.1411","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207150","9.8697","0.0008","16.446","0.0014","21.4643","0.0018","90","","90","","90","","3484","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3'-Nitro-4'-(4-methylphenyl)spiro[1H-indole-3,2'-pyrrolidin]-2-one","","- C19 H19 N3 O3 -","- C19 H19 N3 O3 -","- C152 H152 N24 O24 -","8","1","BT6755","S. Selvanayagam; P. Rathisuganya; B. Shaherin; D. Velmurugan; K. Ravikumar; M. Poornachandran","4'-(4-Methylphenyl)-3'-nitrospiro[1<i>H</i>-indole-3,2'-pyrrolidin]-2-one","Acta Crystallographica Section E","2005","61","11","o3693","o3695","10.1107/S1600536805032526","","","0.71073","MoKα","","0.091","0.0631","","","0.1367","0.151","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207151","11.318","0.0008","11.6376","0.0008","23.098","0.0016","90","","103","0.001","90","","2964.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-[3-Benzoyl-4-(4-chlorophenyl)-1-methylpyrrolidin-2-yl]-1-(4-methoxyphenyl)- 3-phenylazetidine-2-one","","- C34 H31 Cl N2 O3 -","- C34 H31 Cl N2 O3 -","- C136 H124 Cl4 N8 O12 -","4","1","BT6756","S. Selvanayagam; D. Velmurugan; K. Ravikumar; E. Ramesh","4-[3-Benzoyl-4-(4-chlorophenyl)-1-methylpyrrolidin-2-yl]-1-(4-methoxyphenyl)-3-phenylazetidin-2-one","Acta Crystallographica Section E","2005","61","11","o3696","o3698","10.1107/S1600536805032538","","","0.71073","MoKα","","0.0833","0.0576","","","0.135","0.1487","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207152","9.559","0.002","9.559","0.002","14.808","0.006","90","","90","","90","","1353.1","0.7","293","2","293","2","","","","","","","","6","I -4","I -4","82","not relevant","Bis(trimethylammonium) decaselenidotetragermanatomanganate(II)","","- C6 H20 Ge4 Mn N2 Se10 -","- C6 H18 Ge4 Mn N2 Se10 -","- C12 H36 Ge8 Mn2 N4 Se20 -","2","0.25","BT6757","Tobias van Almsick; William S. Sheldrick","Bis(trimethylammonium) decaselenidotetragermanatomanganate(II)","Acta Crystallographica Section E","2005","61","11","m2348","m2350","10.1107/S1600536805032770","","","0.71073","MoKα","","0.0318","0.0269","","","0.0633","0.0657","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207153","7.5163","0.0009","12.199","0.002","9.73","0.001","90","","97.735","0.002","90","","884","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Methyl-4-nitro-1H-imidazole-2-carboxylic acid dihydrate","","- C5 H9 N3 O6 -","- C5 H9 N3 O6 -","- C20 H36 N12 O24 -","4","1","BT6758","Wu, Hai-Qiang; Liu, Zhi-Gang; Ng, Seik Weng","1-Methyl-4-nitro-1<i>H</i>-imidazole-2-carboxylic acid dihydrate","Acta Crystallographica Section E","2005","61","11","o3759","o3760","10.1107/S1600536805032800","","","0.71073","MoKα","","0.049","0.036","","","0.099","0.109","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207154","9.4033","0.0006","10.2886","0.0007","7.1791","0.0005","90","","90","","90","","694.55","0.08","298","2","298","2","","","","","","","","5","I m m 2","I 2 -2","44","","catena-poly[[tetraaquacobalt(II)-μ-pyrazine] phthalate]","","- C12 H16 Co N2 O8 -","- C12 H16 Co N2 O8 -","- C24 H32 Co2 N4 O16 -","2","0.25","BT6759","Ng, Seik Weng","Rerefinement of <i>catena</i>-poly[[tetraaquacobalt(II)-μ-pyrazine] phthalate] in a lower-symmetry space group","Acta Crystallographica Section E","2005","61","11","m2297","m2298","10.1107/S1600536805032575","","","0.71073","MoKα","","0.023","0.023","","","0.074","0.074","","","","","","1.25","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207155","17.0109","0.0006","11.5436","0.0004","20.6095","0.0006","90","","92.2816","0.0017","90","","4043.8","0.2","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","1-(2-Bromo-5-methoxyphenyl)-8-chloro-6-(2-fluorophenyl)- 4H-1,2,4-triazolo[4,3-a][1,4]benzodiazepine","","- C23 H15 Br Cl F N4 O -","- C23 H15 Br Cl F N4 O -","- C184 H120 Br8 Cl8 F8 N32 O8 -","8","1","BT6760","Harrison, William T. A.; Yathirajan, H. S.; Anilkumar, H. G.; Sarojini, B. K.; Narayana, B.; Lobo, K. G.","1-(2-Bromo-5-methoxyphenyl)-8-chloro-6-(2-fluorophenyl)-4<i>H</i>-1,2,4-triazolo[4,3-<i>a</i>][1,4]benzodiazepine","Acta Crystallographica Section E","2005","61","11","o3810","o3812","10.1107/S1600536805032927","","","0.71073","MoKα","","0.0578","0.0349","","","0.0678","0.0746","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207156","19.428","0.001","7.0016","0.0005","11.5352","0.0008","90","","90","","90","","1569.1","0.18","295","2","295","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","Dichloro(methanol-κO)[2-(2-pyridylmethyliminomethyl)phenolato- κ^3^N,N',O]iron(III)","","- C14 H15 Cl2 Fe N2 O2 -","- C14 H15 Cl2 Fe N2 O2 -","- C56 H60 Cl8 Fe4 N8 O8 -","4","1","BT6761","Jin-Hua Zhang; Jun Li; Feng-Xing Zhang; Ng, Seik Weng","Dichloro(methanol-κ<i>O</i>)[2-(2-pyridylmethyliminomethyl)phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]iron(III)","Acta Crystallographica Section E","2005","61","11","m2338","m2339","10.1107/S1600536805033143","","","0.71073","MoKα","","0.031","0.025","","","0.06","0.062","","","","","","0.96","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207157","10.121","0.003","10.424","0.003","22.891","0.005","88.01","0.03","79.45","0.03","65.94","0.03","2165.8","1.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","tris(acetic acid-κO)-μ~3~-oxo-hexakis(μ~2~-trichloroacetato- κ^2^O:O')trimanganese(II,III,III)","","- C18 H12 Cl18 Mn3 O19 -","- C18 H12 Cl18 Mn3 O19 -","- C36 H24 Cl36 Mn6 O38 -","2","1","BT6762","Lis, Tadeusz; Kinzhybalo, Vasyl; Zieba, Krzysztof","A trinuclear mixed-valence manganese carboxylate: tris(acetic acid-κ<i>O</i>)-μ~3~-oxo-hexakis(μ~2~-trichloroacetato-κ^2^<i>O</i>:<i>O</i>')trimanganese(II,III,III)","Acta Crystallographica Section E","2005","61","11","m2382","m2384","10.1107/S1600536805033416","","","0.71073","MoKα","","0.066","0.0543","","","0.0937","0.097","","","","","","1.159","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207158","22.942","0.002","6.7388","0.0007","17.9594","0.0018","90","","116.019","0.002","90","","2495.1","0.4","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,9-dimethyl-l,10-phenanthroline dihydrate","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C112 H128 N16 O16 -","8","1","BT6763","Köroglu, Ahmet; Bulut, Ahmet; Uçar, Ibrahim; Nichol, Gary S.; Harrington, Ross W.; Clegg, William","A second monoclinic polymorph of 2,9-dimethyl-1,10-phenanthroline dihydrate","Acta Crystallographica Section E","2005","61","11","o3723","o3725","10.1107/S1600536805033179","","","0.71073","MoKα","","0.0746","0.0622","","","0.1478","0.1541","","","","","","1.223","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207159","6.0754","0.0011","14.343","0.003","7.5288","0.0013","90","","90","","90","","656.1","0.2","150","2","150","2","","","","","","","","4","C m c 21","C 2c -2","36","Violuric acid monohydrate","Violuric acid monohydrate","","- C4 H5 N3 O5 -","- C4 H5 N3 O5 -","- C16 H20 N12 O20 -","4","0.5","BT6764","Nichol, Gary S.; Clegg, William","Violuric acid monohydrate: a definitive redetermination at 150 K","Acta Crystallographica Section E","2005","61","11","o3788","o3790","10.1107/S160053680503343X","","","0.71073","MoKα","","0.0294","0.0282","","","0.0826","0.0849","","","","","","1.103","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207160","14.718","0.002","18.686","0.002","15.32","0.002","90","","104.337","0.002","90","","4082.1","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis{[(Z)-(3-Methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4- ylidene)(phenyl)methyl]benzylamido-κ^2^N,O}copper(II)","","- C48 H40 Cu N6 O2 -","- C48 H40 Cu N6 O2 -","- C192 H160 Cu4 N24 O8 -","4","1","BT6765","Bao, Feng; Feng, Juan; Ng, Seik Weng","Bis{<i>N</i>-[(<i>Z</i>)-(3-Methyl-5-oxo-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazol-4-ylidene)(phenyl)methyl]benzylamido-κ^2^<i>N</i>,<i>O</i>}copper(II)","Acta Crystallographica Section E","2005","61","11","m2393","m2394","10.1107/S1600536805033805","","","0.71073","MoKα","","0.06","0.036","","","0.094","0.111","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207161","11.698","0.001","11.698","","11.661","0.001","90","","90","","120","","1381.94","0.17","295","2","295","2","","","","","","","","4","R -3 :H","-R 3","148","Cobalt(II) formate hydroxide","poly[μ~3~-formato-μ~3~-hydroxo-cobalt(II)]","","- C H2 Co O3 -","- C H2 Co O3 -","- C18 H36 Co18 O54 -","18","1","BT6766","Fu, Yun-Long; Ren, Jia-Lin; Xu, Zhi-Wei; Ng, Seik Weng","Cobalt(II) formate hydroxide","Acta Crystallographica Section E","2005","61","11","m2395","m2396","10.1107/S1600536805033817","","","0.71073","MoKα","","0.033","0.031","","","0.076","0.077","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207162","19.447","0.002","10.986","0.001","15.084","0.002","90","","121.231","0.002","90","","2755.6","0.5","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(4,4'-bipyridinium) tetrakis(oxalato-κ^2^O,O')zirconate(IV)","","- C28 H20 N4 O16 Zr -","- C28 H20 N4 O16 Zr -","- C112 H80 N16 O64 Zr4 -","4","0.5","BT6767","Fu, Yun-Long; Ren, Jia-Lin; Xu, Zhi-Wei; Ng, Seik Weng","Bis(4,4'-bipyridinium) tetrakis(oxalato-κ^2^<i>O</i>,<i>O</i>')zirconate(IV)","Acta Crystallographica Section E","2005","61","11","m2397","m2399","10.1107/S1600536805033829","","","0.71073","MoKα","","0.071","0.047","","","0.103","0.112","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207163","21.93","0.004","8.4753","0.0017","24.041","0.005","90","","102.77","0.03","90","","4357.8","1.6","292","2","292","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","not relevant","Bis[(1,4,7,10,13,16-hexaoxocyclooctadecane)caesium(I)] di-μ~2~-diselenido-bis[selenidoarsenate(III)]","","- C24 H48 As2 Cs2 O12 Se6 -","- C24 H48 As2 Cs2 O12 Se6 -","- C96 H192 As8 Cs8 O48 Se24 -","4","1","BT6769","Tobias Van Almsick; William S. Sheldrick","Bis[(1,4,7,10,13,16-hexaoxocyclooctadecane)caesium(I)] di-μ~2~-diselenido-bis[selenidoarsenate(III)]","Acta Crystallographica Section E","2005","61","11","m2431","m2433","10.1107/S1600536805034604","","","0.71073","MoKα","","0.1107","0.0515","","","0.106","0.1226","","","","","","0.944","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207164","21.26","0.006","6.1189","0.001","13.662","0.003","90","","90.35","0.01","90","","1777.2","0.7","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","17-isopropyl-3-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro- 6H-cyclopenta[a]phenanthrene","","- C22 H32 O -","- C22 H32 O -","- C88 H128 O4 -","4","1","BT6770","Kooijman, Huub; Sarabèr, Florence C. E.; Groot, Aede de; Spek, Anthony L.","17-Isopropyl-3-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6<i>H</i>-cyclopenta[<i>a</i>]phenanthrene","Acta Crystallographica Section E","2005","61","11","o3908","o3909","10.1107/S1600536805034641","","","0.71073","MoKα","","0.0878","0.0486","","","0.1121","0.1313","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207165","13.962","0.0018","15.403","0.002","16.157","0.002","73.823","0.002","72.46","0.002","68.58","0.002","3028.2","0.7","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(1,10-phenanthroline)(3-sulfonatobenzoato)zinc(II) trihydrate","","- C31 H26 N4 O8 S Zn -","- C31 H26 N4 O8 S Zn -","- C124 H104 N16 O32 S4 Zn4 -","4","2","BT6771","Zhang, Li-Ping; Zhu, Long-Guan","Bis(1,10-phenanthroline)(3-sulfonatobenzoato)zinc(II) trihydrate","Acta Crystallographica Section E","2005","61","11","m2438","m2439","10.1107/S1600536805034951","","","0.71073","MoKα","","0.123","0.073","","","0.172","0.198","","","","","","1.021","","","","has coordinates","203559","2020-10-21","18:00:00",""
"2207166","8.2864","0.0014","14.469","0.002","17.703","0.003","90","","99.681","0.003","90","","2092.3","0.6","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E,E,E)-2-(2-{[3-(2,6-Dichlorophenyl)-1-methyl-trans-2- propenylidene]aminooxymethyl}phenyl)-2-methoxyimino-N-methylacetamide","","- C21 H21 Cl2 N3 O3 -","- C21 H21 Cl2 N3 O3 -","- C84 H84 Cl8 N12 O12 -","4","1","BV6032","Yan, Fan-Yong; Liu Dong-Qing; Zeng Tao; Zhou, Ren-bing; Duan Xue-Min","(<i>E</i>,<i>E</i>,<i>E</i>)-2-(2-{[3-(2,6-Dichlorophenyl)-1-methyl-<i>trans</i>-2-propenylidene]aminooxymethyl}phenyl)-2-methoxyimino-<i>N</i>-methylacetamide","Acta Crystallographica Section E","2005","61","11","o3621","o3622","10.1107/S1600536805031028","","","0.71073","MoKα","","0.0651","0.0421","","","0.102","0.1182","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207167","33.358","0.003","37.815","0.004","9.657","0.001","90","","90","","90","","12182","2","193","2","193","2","","","","","","","","5","F d d 2","F 2 -2d","43","","cis-4-[2-4-Chlorophenyl)ethenyl]-1-methylpyridium tetraphenylborate","","- C38 H33 B Cl N -","- C38 H33 B Cl N -","- C608 H528 B16 Cl16 N16 -","16","1","CF6452","Jin, Dan; Zhang, Feng; Zhang, Yong; Zhang, De-Chun","4-[2-(4-Chlorophenyl)ethenyl]-<i>N</i>-methylpyridinium tetraphenylborate","Acta Crystallographica Section E","2005","61","11","o3618","o3620","10.1107/S160053680503151X","","","0.7107","MoKα","","0.0706","0.0584","","","0.133","0.1405","","","","","","1.104","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207168","9.7267","0.0013","16.584","0.002","9.0476","0.0012","90","","100.734","0.002","90","","1433.9","0.3","292","2","292","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-oxo-3-(3,4,5-trimethoxyphenyl)propanoate","","- C14 H18 O6 -","- C14 H18 O6 -","- C56 H72 O24 -","4","1","CF6459","Meng, Xiang-Gao; Wu, An-Xin","Ethyl 3-oxo-3-(3,4,5-trimethoxyphenyl)propanoate","Acta Crystallographica Section E","2005","61","11","o3611","o3612","10.1107/S1600536805031387","","","0.71073","MoKα","","0.0801","0.0574","","","0.1506","0.1681","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207169","8.8805","0.0012","14.404","0.002","13.754","0.002","90","","92.423","0.002","90","","1757.8","0.4","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","o-Phenylene bis(benzenesulfonate)","","- C18 H14 O6 S2 -","- C18 H14 O6 S2 -","- C72 H56 O24 S8 -","4","1","CF6460","Li Wu; Xue-Fang Shi; Zhi-Yong Xing; Wen-Qin Zhang","<i>o</i>-Phenylene bis(benzenesulfonate)","Acta Crystallographica Section E","2005","61","11","o3684","o3685","10.1107/S1600536805032332","","","0.71073","MoKα","","0.0525","0.0358","","","0.0841","0.0934","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207170","7.434","0.004","5.972","0.002","17.603","0.009","90","","90","","90","","781.5","0.6","296","1","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2,3,6,7-Tetrahydrobenzo[1,2-b;4,5-b']difuran","","- C10 H10 O2 -","- C10 H10 O2 -","- C40 H40 O8 -","4","0.5","CF6462","Jian-Ming Gu; Xiu-Rong Hu; Wei-Ming Xu","2,3,6,7-Tetrahydrobenzo[1,2-<i>b</i>;4,5-<i>b</i>']difuran","Acta Crystallographica Section E","2005","61","11","o3674","o3675","10.1107/S1600536805032083","","","0.71075","MoKα","","","0.0387","","","","0.1134","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207171","15.166","0.001","9.9706","0.0009","12.909","0.001","90","","112.398","0.001","90","","1804.8","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[trimethyltin(IV)]-μ-(3-trimethylstannylsulfanyl)benzoato- κ^2^O:O']","","- C13 H22 O2 S Sn2 -","- C13 H22 O2 S Sn2 -","- C52 H88 O8 S4 Sn8 -","4","1","CF6463","Zhang, Qing-Fu; Zhang, Ru-Fen; Ma, Chun-Lin; Ng, Seik Weng","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-3-(trimethylstannylsulfanyl)benzoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","11","m2374","m2375","10.1107/S1600536805033866","","","0.71073","MoKα","","0.044","0.026","","","0.065","0.077","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207172","9.6232","0.0005","10.8138","0.0006","27.219","0.002","90","","90","","90","","2832.5","0.3","295","2","295","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","Aqua(pyridine-κN)(N-salicylideneglycinato-κ^3^N,O,O')copper(II)","","- C14 H14 Cu N2 O4 -","- C14 H14 Cu N2 O4 -","- C112 H112 Cu8 N16 O32 -","8","2","CF6465","Li, Yu-Guang; Zhu, Hai-Liang; Chen, Xin-Zhi; Ng, Seik Weng","Aqua(pyridine-κ<i>N</i>)(<i>N</i>-salicylideneglycinato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2005","61","11","m2385","m2387","10.1107/S1600536805033647","","","0.71073","MoKα","","0.058","0.041","","","0.108","0.137","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207173","15.11","0.003","9.2097","0.0019","17.084","0.004","90","","90","","90","","2377.4","0.9","203","2","203","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Ethopabate","Methyl 4-acetamido-2-ethoxybenzoate","","- C12 H15 N O4 -","- C12 H15 N O4 -","- C96 H120 N8 O32 -","8","1","CF6466","Gao, Fei; Yin, Cai-Xia; Huo, Fang-Jun; Yang, Pin","Ethopabate","Acta Crystallographica Section E","2005","61","11","o3870","o3871","10.1107/S1600536805034082","","","0.71073","MoKα","","0.06","0.037","","","0.0807","0.0863","","","","","","0.866","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207174","4.9309","0.0002","11.7571","0.0004","8.7944","0.0003","90","","99.8608","0.0014","90","","502.31","0.03","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","N-(2-Methyl-3,6-dinitrophenyl)acetamide","","- C9 H9 N3 O5 -","- C9 H9 N3 O5 -","- C18 H18 N6 O10 -","2","1","CF6468","Watkin, David J.; Motherwell, W. D. S.; Cooper, Richard I.; Pantos, Stefan; Steadman, Oliver I.","<i>N</i>-(2-Methyl-3,6-dinitrophenyl)acetamide","Acta Crystallographica Section E","2005","61","11","o3888","o3890","10.1107/S1600536805034355","","","0.71073","MoKα","","0.0242","0.0242","","0.0615","0.0615","0.0615","","","","","","1.0942","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207175","10.1961","0.001","7.56","0.0008","18.243","0.002","90","","105.59","0.02","90","","1354.5","0.3","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Dihydroechioidinin","5,2'-Dihydroxy-7-methoxyflavanone","","- C16 H14 O5 -","- C16 H14 O5 -","- C64 H56 O20 -","4","1","CI6641","Krishnaiah, M.; Ravi Kumar, R.; Jagadeesh Kumar, N.; Gunasekar, D.; Jayaprakasam, B.","5,2'-Dihydroxy-7-methoxyflavanone","Acta Crystallographica Section E","2005","61","11","o3565","o3567","10.1107/S1600536805030758","","","0.71073","MoKα","","0.1501","0.0638","","","0.1559","0.2006","","","","","","0.963","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207176","19.301","0.002","6.95","0.001","11.173","0.001","90","","90","","90","","1498.8","0.3","298","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","{2,4-Dichloro-6-[2- (dimethylamino)ethyliminomethyl]phenolato}thiocyanatocopper(II)","","- C12 H13 Cl2 Cu N3 O S -","- C12 H13 Cl2 Cu N3 O S -","- C48 H52 Cl8 Cu4 N12 O4 S4 -","4","0.5","CI6642","You, Zhong-Lu","{2,4-Dichloro-6-[2-(dimethylamino)ethyliminomethyl]phenolato}thiocyanatocopper(II)","Acta Crystallographica Section E","2005","61","11","m2226","m2227","10.1107/S1600536805031107","","","0.71073","MoKα","","0.0695","0.048","","","0.1048","0.1149","","","","","","1.021","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207177","10.286","0.003","4.6163","0.0011","17.111","0.004","90","","104.995","0.004","90","","784.8","0.3","292","2","292","2","","","","","","","","4","C 1 2 1","C 2y","5","","5-Methyl L-glutamate","","- C6 H11 N O4 -","- C6 H11 N O4 -","- C24 H44 N4 O16 -","4","1","CI6645","Wu, Yong-Fei; Li, Fen-Fang; Jin, Long-Fei","5-Methyl <small>L</small>-glutamate","Acta Crystallographica Section E","2005","61","11","o3752","o3753","10.1107/S1600536805032952","","","0.71073","MoKα","","0.0567","0.0506","","","0.146","0.1598","","","","","","1.147","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207178","9.912","0.001","8.74","0.002","11.689","0.003","90","","99.51","0.03","90","","998.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Dimethanolbis(quinoline-8-carboxylato-κ^2^N,O)cobalt(II)","","- C22 H20 Co N2 O6 -","- C22 H20 Co N2 O6 -","- C44 H40 Co2 N4 O12 -","2","0.5","CI6659","Che, Guang-Bo; Liu, Chun-Bo; Cui, Yun-Cheng; Li, Chuan-Bi","<i>trans</i>-Dimethanolbis(quinoline-8-carboxylato-κ^2^<i>N</i>,<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2005","61","11","m2207","m2208","10.1107/S1600536805031211","","","0.71073","MoKα","","0.0458","0.0358","","","0.0839","0.0887","","","","","","1.088","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207179","9.479","0.0004","12.244","0.0005","13.9979","0.0006","75.869","0.001","83.737","0.001","70.93","0.001","1488.23","0.11","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Harunmadagacarin B","10,12,12-Tris(3,3-dimethylallyl)-6,7-dihydroxy-2,2,9- trimethyl-1H-pyrano[2,3-b]anthracen-5(12H)-one","","- C35 H42 O4 -","- C35 H42 O4 -","- C70 H84 O8 -","2","1","CI6660","Simeon F. Kouam; M. Iqbal Choudhary; Atta-ur-Rahman; Shazia Anjum; Shamsher Ali","10,12,12-Tris(3,3-dimethylallyl)-6,7-dihydroxy-2,2,9-trimethyl-1<i>H</i>-pyrano[2,3-<i>b</i>]anthracen-5(12<i>H</i>)-one","Acta Crystallographica Section E","2005","61","11","o3545","o3547","10.1107/S1600536805031223","","","0.71073","MoKα","","0.0563","0.0477","","","0.1285","0.1374","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207180","12.479","0.003","15.731","0.004","14.274","0.004","90","","100.59","0.004","90","","2754.4","1.2","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[N-(2-hydroxyethyl)-N'-(2-oxidobenzylidene)ethylenediamine- 1κ^4^O,N,N',O'][μ-N-(2-oxidobenzylidene)-N'-(2-oxidoethyl)ethylenediamine- 1κO:2κ^4^O,N,N',O']dicopper(II) perchlorate methanol solvate","","- C23 H33 Cl Cu2 N4 O9 -","- C23 H33 Cl Cu2 N4 O9 -","- C92 H132 Cl4 Cu8 N16 O36 -","4","1","CI6661","Guang-Jun Xu; Li Feng; Shi-Ping Yan; Dai-Zheng Liao; Zong-Hui Jiang; Peng Cheng","A new Schiff base‒copper(II) complex: [<i>N</i>-(2-hydroxyethyl)-<i>N</i>'-(2-oxidobenzylidene)ethylenediamine-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'][μ-<i>N</i>-(2-oxidobenzylidene)-<i>N</i>'-(2-oxidoethyl)ethylenediamine-1κ<i>O</i>:2κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']dicopper(II) perchlorate methanol solvate","Acta Crystallographica Section E","2005","61","11","m2390","m2392","10.1107/S1600536805033593","","","0.71073","MoKα","","0.0792","0.0455","","","0.1061","0.1255","","","","","","1.101","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2207181","12.4196","0.0011","12.1995","0.0011","17.5992","0.0015","90","","107.198","0.002","90","","2547.3","0.4","292","2","292","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-Ethyl 5-amino-1-[4-chlorophenyl-3-(6-chloro-3-pyridylmethylamino)-5,5-dimethyl-2-oxo- 1,3,2-dioxaphosphinan-1-yl]pyrazole-4-carboxylate","","- C23 H26 Cl2 N5 O5 P -","- C23 H26 Cl2 N5 O5 P -","- C92 H104 Cl8 N20 O20 P4 -","4","1","CI6662","Zai-Gang Luo; De-Qing Shi; Xiang-Gao Meng","<i>cis</i>-Ethyl 5-amino-1-[4-(4-chlorophenyl)-5,5-dimethyl-2-oxo-1,3,2-dioxaphosphinan-1-yl]-3-(6-chloro-3-pyridylmethylamino)-1<i>H</i>-pyrazole-4-carboxylate","Acta Crystallographica Section E","2005","61","11","o3679","o3681","10.1107/S1600536805032484","","","0.71073","MoKα","","0.0713","0.0461","","","0.113","0.1268","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207182","5.9561","0.0013","12.043","0.005","16.512","0.006","90","","90","","90","","1184.4","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Dimethyl naphthalene-1,8-dicarboxylate","","- C14 H12 O4 -","- C14 H12 O4 -","- C56 H48 O16 -","4","1","CI6664","Lin-Hai Jing; Da-Bin Qin; Long He; Shao-Jin Gu; Huan-Xia Zhang; Gang Lei","Dimethyl naphthalene-1,8-dicarboxylate","Acta Crystallographica Section E","2005","61","11","o3595","o3596","10.1107/S160053680503148X","","","0.71073","MoKα","","0.1304","0.0509","","","0.1224","0.1651","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207183","12.655","0.003","16.582","0.003","11.5","0.003","90","","107.708","0.006","90","","2298.9","0.9","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","9-(4-Chlorophenyl)-3,3,6,6-tetramethyl-1,8-dioxo-1,2,3,4,5,6,7,8,9,10- decahydroacridine-10-acetic acid","","- C25 H28 Cl N O4 -","- C25 H28 Cl N O4 -","- C100 H112 Cl4 N4 O16 -","4","1","CI6665","Shuj-Jiang Tu; Qian Wang; Jin-Peng Zhang; Xiao-Tong Zhu; Jia-Ning Xu","9-(4-Chlorophenyl)-3,3,6,6-tetramethyl-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridine-10-acetic acid","Acta Crystallographica Section E","2005","61","11","o3743","o3745","10.1107/S1600536805032903","","","0.7107","MoKα","","0.1319","0.077","","","0.1508","0.1746","","","","","","1.124","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207184","13.305","0.002","10.365","0.002","8.8087","0.0017","90","","90.949","0.004","90","","1214.6","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Iriflophenone","(4-Hydroxyphenyl)(2,4,6-trihydroxyphenyl)methanone monohydrate","","- C13 H12 O6 -","- C13 H12 O6 -","- C52 H48 O24 -","4","1","CI6666","M. Iqbal Choudhary; Suad Naheed; Shazia Anjum; Shama Nasim; Atta-ur-Rahman; Hoong-Kun Fun","(4-Hydroxyphenyl)(2,4,6-trihydroxyphenyl)methanone monohydrate","Acta Crystallographica Section E","2005","61","11","o3584","o3586","10.1107/S160053680503165X","","","0.71073","MoKα","","0.1406","0.0669","","","0.1005","0.1247","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207185","7.3381","0.0015","22.166","0.004","9.654","0.0019","90","","99.75","0.03","90","","1547.6","0.5","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ-methoxo-bis{[diacetyl monoxime (4-methoxybenzoyl)hydrazonato-κ^3^O,N,N']oxovanadium(V)}","","- C26 H32 N6 O10 V2 -","- C26 H32 N6 O10 V2 -","- C52 H64 N12 O20 V4 -","2","0.5","CI6668","Deng, Zhao-Peng; Gao, Shan; Huo, Li-Hua; Zhao, Hui","Di-μ-methoxo-bis{[diacetyl monooxime (4-methoxybenzoyl)hydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>']oxovanadium(V)}","Acta Crystallographica Section E","2005","61","11","m2214","m2216","10.1107/S160053680503120X","","","0.71073","MoKα","","0.0555","0.0411","","","0.1094","0.1171","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207186","7.3517","0.0001","7.3268","0.0001","21.1186","0.0004","90","","97.61","0.001","90","","1127.52","0.03","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,3-dihydroxy-2-methylanthra-9,10-quinone","","- C15 H10 O4 -","- C15 H10 O4 -","- C60 H40 O16 -","4","1","CI6670","Shea-Lin Ng; Ibrahim Abdul Razak; Hoong-Kun Fun; Sompong Boonsri; Suchada Chantrapromma; Uma Prawat","1,3-Dihydroxy-2-methyl-9,10-anthraquinone","Acta Crystallographica Section E","2005","61","11","o3656","o3658","10.1107/S1600536805031697","","","0.71073","MoKα","","0.0595","0.0455","","","0.1345","0.1477","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207187","4.6661","0.0012","15.11","0.004","23.314","0.006","90","","90","","90","","1643.7","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N'-(2-Hydroxybenzylidene)-2-(quinolin-8-yloxy)acetohydrazide monohydrate","","- C18 H17 N3 O4 -","- C18 H17 N3 O4 -","- C72 H68 N12 O16 -","4","1","CI6671","Shu-Sheng Zhang; Yong-Hong Wen; Mao-Jie Li; Xue-Mei Li","<i>N</i>'-(2-Hydroxybenzylidene)-2-(quinolin-8-yloxy)acetohydrazide monohydrate","Acta Crystallographica Section E","2005","61","11","o3682","o3683","10.1107/S1600536805032356","","","0.71073","MoKα","","0.0971","0.0625","","","0.1274","0.1425","","","","","","1.122","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207188","7.4026","0.0002","18.4985","0.0004","11.4109","0.0002","90","","109.466","0.001","90","","1473.26","0.06","100","0.1","100","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","3,5,7-trimethoxy-flavone","3,5,7-trimethoxy-2-phenyl-4H-1-benzopyran-4-one","","- C18 H16 O5 -","- C18 H16 O5 -","- C72 H64 O20 -","4","1","CI6672","Jeannie Bee-Jan Teh; Hoong-Kun Fun; Ibrahim Abdul Razak; Nawong Boonnak; Suchada Chantrapromma; Chatchanok Karalai","3,5,7-Trimethoxy-2-phenyl-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section E","2005","61","11","o3653","o3655","10.1107/S1600536805031971","","","0.71073","MoKα","","0.0493","0.0419","","","0.1063","0.1113","","","","","","1.058","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207189","8.1429","0.0001","14.8202","0.0002","10.4493","0.0001","90","","128.771","0.001","90","","983.16","0.02","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","DMAP perchlorate salt","4-(N,N-Dimethylamino)pyridinium perchlorate","","- C7 H11 Cl N2 O4 -","- C7 H11 Cl N2 O4 -","- C28 H44 Cl4 N8 O16 -","4","1","CI6674","Rosli Mohd Mustaqim; Shamsher Ali; Ibrahim Abdul Razak; Hoong-Kun Fun; Shyamaprosad Goswami; A. Adak","4-(<i>N</i>,<i>N</i>-Dimethylamino)pyridinium perchlorate","Acta Crystallographica Section E","2005","61","11","o3733","o3734","10.1107/S1600536805032605","","","0.71073","MoKα","","0.0595","0.0497","","","0.1636","0.1735","","","","","","1.072","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207190","16.9406","0.0004","3.8619","0.0001","21.7968","0.0004","90","","106.52","0.01","90","","1367.15","0.09","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5-hydroxy-7,4'-dimethoxyflavone","5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one","","- C17 H14 O5 -","- C17 H14 O5 -","- C68 H56 O20 -","4","1","CI6676","Jeannie Bee Jan Teh; Hoong-Kun Fun; Abdul Razak Ibrahim; Suchada Chantrapromma; Nawong Boonnak; Chatchanok Karalai","5-Hydroxy-7-methoxy-2-(4-methoxyphenyl)-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section E","2005","61","11","o3715","o3717","10.1107/S1600536805032551","","","0.71073","MoKα","","0.0755","0.0462","","","0.1111","0.128","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207191","8.222","0.004","19.541","0.008","9.956","0.003","90","","114.31","0.03","90","","1457.8","1.1","293","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(imidazol-1-ylmethyl)naphthalene","","- C18 H16 N4 -","- C18 H16 N4 -","- C72 H64 N16 -","4","1","CI6679","Lin-Hai Jing; Da-Bin Qin; Huan-Xia Zhang; Shao-Jin Gu; Gang Lei; Zhi-Hua Mao","1,4-Bis(imidazol-1-ylmethyl)naphthalene","Acta Crystallographica Section E","2005","61","11","o3923","o3924","10.1107/S1600536805034549","","","0.71073","MoKα","","0.1489","0.0443","","","0.0878","0.1076","","","","","","0.916","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207192","13.4036","0.0003","18.8997","0.0005","7.1512","0.0002","90","","99.675","0.001","90","","1785.8","0.08","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","5,7-dimethoxyflavone chloroform solvate","5,7-dimethoxy-2-phenyl-4H-1-benzopyran-4-one chloroform solvate","","- C18 H15 Cl3 O4 -","- C18 H15 Cl3 O4 -","- C72 H60 Cl12 O16 -","4","1","CI6680","Jeannie Bee-Jan Teh; Hoong-Kun Fun; Ibrahim Abdul Razak; Suchada Chantrapromma; Nawong Boonnak; Chatchanok Karalai","5,7-Dimethoxy-2-phenyl-4<i>H</i>-1-benzopyran-4-one chloroform solvate","Acta Crystallographica Section E","2005","61","11","o3927","o3929","10.1107/S1600536805034707","","","0.71073","MoKα","","0.0449","0.0412","","","0.0969","0.1017","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207193","7.728","0.001","10.127","0.001","20.237","0.002","90","","90","","90","","1583.8","0.3","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Dichloro{2,4-dichloro-6-[2-(dimethylamino)ethyliminomethyl]phenolato}zinc(II)","","- C11 H14 Cl4 N2 O Zn -","- C11 H14 Cl4 N2 O Zn -","- C44 H56 Cl16 N8 O4 Zn4 -","4","1","CI6681","You, Zhong-Lu","Dichloro{2,4-dichloro-6-[2-(dimethylamino)ethyliminomethyl]phenolato}zinc(II)","Acta Crystallographica Section E","2005","61","11","m2416","m2418","10.1107/S1600536805034744","","","0.71073","MoKα","","0.0621","0.0513","","","0.0937","0.0977","","","","","","1.136","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207194","3.9591","0.0011","20.939","0.005","16.209","0.004","90","","99.844","0.007","90","","1323.9","0.6","297","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Bonducellin","2,3-dihydro-7-hydroxy-3-[(4-methoxyphenyl)methylene]-4H-1-benzopyran-4-one","","- C17 H14 O4 -","- C17 H14 O4 -","- C68 H56 O16 -","4","1","CI6686","Sompong Boonsri; Suchada Chantrapromma; Hoong-Kun Fun; Chatchanok Karalai; Akkharawit Kanjana-opas; Shazia Anjum","2,3-Dihydro-7-hydroxy-3-[(4-methoxyphenyl)methylene]-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section E","2005","61","11","o3930","o3932","10.1107/S1600536805034823","","","0.71073","MoKα","","0.0603","0.0438","","","0.0959","0.1063","","","","","","1.082","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207195","7.4425","0.0017","13.989","0.003","18.936","0.004","90","","105.739","0.008","90","","1897.6","0.7","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 Br Cl N3 O2 Zn -","- C17 H17 Br Cl N3 O2 Zn -","- C68 H68 Br4 Cl4 N12 O8 Zn4 -","4","1","CV6576","Xiao-Hang Qiu; Xiao-Lan Tong","{2-[2-(1<i>H</i>-Benzimidazol-2-yl)ethyliminomethyl]-4-bromophenolato}chlorozinc(II) methanol solvate","Acta Crystallographica Section E","2005","61","11","m2302","m2304","10.1107/S160053680503254X","","","0.71073","MoKα","","0.089","0.038","","","0.078","0.096","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207196","22.297","0.006","17.257","0.005","23.801","0.007","90","","116.551","0.004","90","","8192","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis{2-[3-(2-pyridyl)pyrazol-1-ylmethyl]pyridine}nickel(II) bis(perchlorate) chloroform disolvate","","- C30 H26 Cl8 N8 Ni O8 -","- C30 H26 Cl8 N8 Ni O8 -","- C240 H208 Cl64 N64 Ni8 O64 -","8","1","CV6583","Song, Rui-Feng; Li, Jian-Rong; Zou, Ru-Qiang","Bis{2-[3-(2-pyridyl)pyrazol-1-ylmethyl]pyridine}nickel(II) bis(perchlorate) chloroform disolvate","Acta Crystallographica Section E","2005","61","11","m2305","m2307","10.1107/S1600536805032046","","","0.71073","MoKα","","0.1258","0.0599","","","0.1354","0.1657","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2207197","5.739","0.004","10.766","0.0017","22.112","0.005","90","","100.73","0.04","90","","1342.3","1","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methyl-2-nitropropyl 3-(3,4-dihydroxyphenyl)prop-2-enoate","","- C13 H15 N O6 -","- C13 H15 N O6 -","- C52 H60 N4 O24 -","4","1","CV6584","Chun-Nian Xia; Wei-Xiao Hu; Wei Zhou","2-Methyl-2-nitropropyl 3-(3,4-dihydroxyphenyl)prop-2-enoate","Acta Crystallographica Section E","2005","61","11","o3757","o3758","10.1107/S1600536805033192","","","0.71073","MoKα","","0.1054","0.0428","","","0.1087","0.1347","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207198","7.688","0.002","10.163","0.002","10.797","0.002","94.08","0.03","101.01","0.03","100.46","0.03","809.4","0.3","295","2","295","3","","","","","","","","5","P -1","-P 1","2","","catena-Poly[tetraaquamanganese(II)-μ-4,4'-bipyridine] catena-poly[diaquamanganate(II)-di-μ-4-carboxyphenoxyacetato] dihydrate","","- C28 H36 Mn2 N2 O18 -","- C28 H36 Mn2 N2 O18 -","- C28 H36 Mn2 N2 O18 -","1","0.5","CV6586","Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","<i>catena</i>-Poly[tetraaquamanganese(II)-μ-4,4'-bipyridine] <i>catena</i>-poly[[diaquamanganate(II)-di-μ-4-carboxyphenoxyacetato] dihydrate]","Acta Crystallographica Section E","2005","61","11","m2270","m2272","10.1107/S1600536805031910","","","0.71073","MoKα","","0.082","0.052","","","0.119","0.136","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207199","15.302","0.008","8.604","0.005","14.872","0.008","90","","90.25","0.01","90","","1958","1.9","298","2","298","2","","","","","","","","6","C 1 c 1","C -2yc","9","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-(phenylacetamido)-1H-pyrazole- 3-carbonitrile","","- C19 H11 Cl2 F3 N4 O -","- C19 H11 Cl2 F3 N4 O -","- C76 H44 Cl8 F12 N16 O4 -","4","1","CV6589","Zhang, Xiao-Hong; Chen, Jie-Zhi; Zhong, Ping; Xiao, Hong-Ping; Hu, Mao-Lin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-(phenylacetamido)-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","11","o3676","o3678","10.1107/S1600536805032514","","","0.71073","MoKα","","0.0585","0.0547","","","0.1494","0.1526","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207200","6.8033","0.0006","11.1687","0.001","12.6787","0.0011","99.684","0.001","98.109","0.001","102.614","0.001","910.76","0.14","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Poly[[aqua(1,10-phenanthroline)lead(II)]-μ~3~-3-sulfonatobenzoato]","","- C19 H14 N2 O6 Pb S -","- C19 H14 N2 O6 Pb S -","- C38 H28 N4 O12 Pb2 S2 -","2","1","CV6590","Ma, Ai-Qing; Zhu, Long-Guan; Cai, Guo-Qiang","Poly[[aqua(1,10-phenanthroline)lead(II)]-μ~3~-3-sulfonatobenzoato]","Acta Crystallographica Section E","2005","61","11","m2264","m2266","10.1107/S1600536805031995","","","0.71073","MoKα","","0.029","0.027","","","0.069","0.07","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207201","10.4207","0.0018","10.976","0.002","28.962","0.004","90","","90","","90","","3312.6","0.9","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Hexaaquacadmium(II) bis{4-[2-(4-hydroxyphenyl)-2-propyl]phenolate} dihydrate","","- C30 H46 Cd O12 -","- C30 H46 Cd O12 -","- C120 H184 Cd4 O48 -","4","0.5","CV6591","Ai-Yun Fu; Da-Qi Wang; Yong-Ling Sun","Hexaaquacadmium(II) bis{4-[2-(4-hydroxyphenyl)-2-propyl]phenolate} dihydrate","Acta Crystallographica Section E","2005","61","11","m2353","m2354","10.1107/S1600536805033167","","","0.71073","MoKα","","0.0962","0.0488","","","0.1136","0.1436","","","","","","1.003","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207202","9.432","0.002","9.55","0.002","12.711","0.003","83.986","0.004","84.986","0.003","78.772","0.004","1114.2","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","(E)-4-[4-(Benzyloxy)-3-methoxybenzylideneamino]-1,5-dimethyl-2-phenyl-1H- pyrazol-3(2H)-one","","- C26 H25 N3 O3 -","- C26 H25 N3 O3 -","- C52 H50 N6 O6 -","2","1","CV6593","Shi Jun","(<i>E</i>)-4-[4-(Benzyloxy)-3-methoxybenzylideneamino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","11","o3893","o3894","10.1107/S1600536805034537","","","0.71073","MoKα","","0.0682","0.0414","","","0.1107","0.1306","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207203","6.148","0.003","36.651","0.015","7.938","0.003","90","","93.551","0.007","90","","1785.2","1.3","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-1-[4-(Benzyloxy)benzylidene]-2-(4-nitrophenyl)hydrazine","","- C20 H17 N3 O3 -","- C20 H17 N3 O3 -","- C80 H68 N12 O12 -","4","1","CV6594","Shi Jun","(<i>E</i>)-1-[4-(Benzyloxy)benzylidene]-2-(4-nitrophenyl)hydrazine","Acta Crystallographica Section E","2005","61","11","o3895","o3896","10.1107/S1600536805034525","","","0.71073","MoKα","","0.1254","0.0496","","","0.1041","0.1274","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207204","6.73","0.002","22.302","0.003","7.4309","0.0009","90","","113.827","0.001","90","","1020.3","0.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","sodium calcium niobate oxide arsenate","","- As2 Ca1.5 Na Nb2 O12 -","- As2 Ca1.5 Na Nb2 O12 -","- As8 Ca6 Na4 Nb8 O48 -","4","0.5","DN6243","Ben Amor, Rym; Zid, Mohamed Faouzi","NaCa~1.5~(NbO)~2~O~2~(AsO~4~)~2~","Acta Crystallographica, Section E","2005","61","11","i228","i230","10.1107/S1600536805031429","","","0.71073","MoKα","","0.0245","0.0194","","","0.05","0.0514","","","","","","1.101","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2207205","12.586","0.0014","10.3777","0.0012","8.0771","0.0009","90","","102.095","0.002","90","","1031.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(1H-Imidazol-1-yl)1-phenylpropan-1-one","","- C12 H12 N2 O -","- C12 H12 N2 O -","- C48 H48 N8 O4 -","4","1","DN6254","Xue-Mei Li; Jun Wan; Shu-Sheng Zhang; Ping-Kai Ouyang","3-(1<i>H</i>-Imidazol-1-yl)-1-phenylpropan-1-one","Acta Crystallographica Section E","2005","61","11","o3632","o3633","10.1107/S1600536805031399","","","0.71073","MoKα","","0.0511","0.045","","","0.1164","0.1217","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207206","5.2398","0.001","17.978","0.003","14.476","0.003","90","","94.064","0.003","90","","1360.2","0.4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4,5-Dihydro-3-p-tolyl-1H-pyrazol-1-yl)-2-(1,2,4-triazol-1-yl)ethanone","","- C14 H15 N5 O -","- C14 H15 N5 O -","- C56 H60 N20 O4 -","4","1","DN6256","Ling-Zhong Xu; Yong-Wei Huang; Ya-Xun Yang; Pu-Yong Zhang; Kai Li","1-(4,5-Dihydro-3-<i>p</i>-tolyl-1<i>H</i>-pyrazol-1-yl)-2-(1,2,4-triazol-1-yl)ethanone","Acta Crystallographica Section E","2005","61","11","o3587","o3588","10.1107/S1600536805031594","","","0.71073","MoKα","","0.0921","0.0433","","","0.0999","0.1209","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207207","13.7023","0.0004","6.3493","0.0002","15.6206","0.0005","90","","101.721","0.001","90","","1330.66","0.07","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(4S,5S,10S,13R,14R,17R)-8α,9α-Epoxy-4α,14α-dimethyl-5α-cholestan-3-one","","- C29 H48 O2 -","- C29 H48 O2 -","- C58 H96 O4 -","2","1","DN6257","Mazoir, N; Giorgi, M.; Benharref, A.","(4<i>S</i>,5<i>S</i>,10<i>S</i>,13<i>R</i>,14<i>R</i>,17<i>R</i>)-8α,9α-Epoxy-4α,14α-dimethyl-5α-cholestan-3-one","Acta Crystallographica Section E","2005","61","11","o3709","o3711","10.1107/S1600536805032460","","","0.71073","MoKα","","0.0914","0.0711","","","0.156","0.1716","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207208","22.2713","0.0012","11.9162","0.0006","17.2698","0.0009","90","","90","","90","","4583.2","0.4","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","3,3,6,6-Tetramethyl-9-(2-oxo-1,2-dihydroquinolin-3-yl)- 1,2,3,4,5,6,7,8-octahydro-9H-xanthene-1,8-dione","","- C26 H27 N O4 -","- C26 H27 N O4 -","- C208 H216 N8 O32 -","8","1","DN6258","S. Selvanayagam; Jasmin Paul; D. Velmurugan; K. Ravikumar; R. Rathna Durga","3,3,6,6-Tetramethyl-9-(2-oxo-1,2-dihydroquinolin-3-yl)-1,2,3,4,5,6,7,8-octahydro-9<i>H</i>-xanthene-1,8-dione","Acta Crystallographica Section E","2005","61","11","o3701","o3703","10.1107/S1600536805032320","","","0.71073","MoKα","","0.0699","0.0496","","","0.1299","0.1446","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207209","4.1749","0.0012","18.874","0.005","19.335","0.006","90","","90.618","0.005","90","","1523.5","0.8","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Methoxyphenyl 4-bromo-7-methoxy-1,3-benzodioxole-5-carboxylate","","- C16 H13 Br O6 -","- C16 H13 Br O6 -","- C64 H52 Br4 O24 -","4","1","DN6259","Zheng, Lei; Zheng, Xiu-Fang; Zhang, Dan; Chang, Jun-Biao","4-Methoxyphenyl 4-bromo-7-methoxy-1,3-benzodioxole-5-carboxylate","Acta Crystallographica Section E","2005","61","11","o3786","o3787","10.1107/S1600536805033362","","","0.71073","MoKα","","0.0707","0.0461","","","0.1125","0.1241","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207210","4.466","0.005","9.248","0.005","17.078","0.005","95","0.005","94.336","0.005","102.054","0.005","684","0.9","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(Z)-Ethyl 4-chloro-2-[2-(2-chlorophenyl)hydrazono]-3-oxobutanoate","","- C12 H12 Cl2 N2 O3 -","- C12 H12 Cl2 N2 O3 -","- C24 H24 Cl4 N4 O6 -","2","1","DN6260","Alpaslan, Gökhan; Özdamar, Özgür; Odabaşoğlu, Mustafa; Ersanlı, Cem Cüneyt; Erdönmez, Ahmet; Ocak Ískeleli, Nazan","(<i>Z</i>)-Ethyl 4-chloro-2-[2-(2-chlorophenyl)hydrazono]-3-oxobutanoate","Acta Crystallographica Section E","2005","61","11","o3648","o3650","10.1107/S1600536805032022","","","0.71069","MoKα","","0.1041","0.0457","","","0.1052","0.1282","","","","","","0.907","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207211","8.772","0.0018","9.738","0.0019","11.306","0.002","86.02","0.03","74.08","0.03","69.26","0.03","868.1","0.4","295","","295","","","","","","","","","5","P -1","-P 1","2","","3-[(2-Chlorophenyl)amino]-1,3-diphenylprop-2-en-1-one","","- C21 H16 Cl N O -","- C21 H16 Cl N O -","- C42 H32 Cl2 N2 O2 -","2","1","DN6261","Yao-Cheng Shi; Su-Hua Zhang","3-[(2-Chlorophenyl)amino]-1,3-diphenylprop-2-en-1-one","Acta Crystallographica Section E","2005","61","11","o3748","o3749","10.1107/S1600536805032836","","","0.71073","MoKα","","0.0783","0.0529","","","0.1496","0.1859","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207212","9.6605","0.0003","21.2825","0.001","22.8491","0.0011","90","","90","","90","","4697.8","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(S)-(-)-N,α-dimethylbenzylammonium dioxo[7,15,23-tri-tert-butyl-3,11,19-trioxatetracyclo[19.3.1.1^5,9^.1^13,17^] heptacosa-1(25),5,7,9(27),13,15,17(26),21,23-nonaene-25,26,27-triolato]uranium trichloromethane solvate","","- C46 H60 Cl3 N O8 U -","- C46 H60 Cl3 N O8 U -","- C184 H240 Cl12 N4 O32 U4 -","4","1","DN6262","Masci, Bernardo; Thuéry, Pierre","The chloroform-solvated uranyl complex of <i>p</i>-<i>tert</i>-butylhexahomotrioxacalix[3]arene with the chiral counter-ion (<i>S</i>)-(‒)-<i>N</i>,α-dimethylbenzylammonium","Acta Crystallographica Section E","2005","61","11","m2278","m2280","10.1107/S1600536805031867","","","0.71073","MoKα","","0.0389","0.0328","","","0.0632","0.0652","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207213","9.1684","0.0016","11.489","0.002","13.889","0.002","90","","93.688","0.003","90","","1460","0.4","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Hydroxy-4-methoxybenzaldehyde isonicotinoylhydrazone monohydrate","","- C14 H15 N3 O4 -","- C14 H15 N3 O4 -","- C56 H60 N12 O16 -","4","1","DN6263","Liu, Hui-Min; Zhang, Wen-Qin","3-Hydroxy-4-methoxybenzaldehyde isonicotinoylhydrazone monohydrate","Acta Crystallographica Section E","2005","61","11","o3775","o3777","10.1107/S1600536805033374","","","0.71073","MoKα","","0.0712","0.0386","","","0.0905","0.1069","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207214","15.5453","0.0012","17.5491","0.0014","18.1924","0.0012","90","","108.262","0.008","90","","4713","0.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-pivalamidato-bis[dicarbonyl(triphenylphosphine)ruthenium(II)](Ru—Ru)","","- C50 H50 N2 O6 P2 Ru2 -","- C50 H50 N2 O6 P2 Ru2 -","- C200 H200 N8 O24 P8 Ru8 -","4","1","DN6267","Auzias, Mathieu; Therrien, Bruno; Süss-Fink, Georg","Di-μ-pivalamidato-bis[dicarbonyl(triphenylphosphine)ruthenium(II)](Ru—Ru)","Acta Crystallographica Section E","2005","61","11","m2426","m2427","10.1107/S1600536805034768","","","0.71073","MoKα","","0.0694","0.0342","","","0.0635","0.0683","","","","","","0.828","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207215","12.94","0.002","8.143","0.001","20.114","0.002","90","","90","","90","","2119.4","0.5","300","2","300","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Diethyl 2,6-dimethyl-4-[5-(4-nitrophenyl)-2-furyl]-1,4-dihydropyridine-3,5- dicarboxylate","","- C23 H24 N2 O7 -","- C23 H24 N2 O7 -","- C92 H96 N8 O28 -","4","1","ER6024","Vrábel, Viktor; Fronc, Marek; Svoboda, Ingrid; Marchalín, Štefan; Baumlová, Barbora","Diethyl 2,6-dimethyl-4-[5-(4-nitrophenyl)-2-furyl]-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2005","61","11","o3592","o3594","10.1107/S1600536805031430","","","0.71073","MoKα","","0.0831","0.0636","","","0.1697","0.1862","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207216","7.515","0.003","13.59","0.005","13.172","0.005","90","","94.689","0.007","90","","1340.7","0.9","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Hydroxy-4-methoxybenzaldehyde (pyridine-2-carbonyl)hydrazone","","- C14 H13 N3 O3 -","- C14 H13 N3 O3 -","- C56 H52 N12 O12 -","4","1","ER6030","Wang, Hui; Liu, Hui-Min; Zhang, Wen-Qin","3-Hydroxy-4-methoxybenzaldehyde (pyridine-2-carbonyl)hydrazone","Acta Crystallographica Section E","2005","61","11","o3808","o3809","10.1107/S160053680503357X","","","0.71073","MoKα","","0.0561","0.0393","","","0.0947","0.1069","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207217","9.0753","0.0016","20.924","0.004","11.518","0.002","90","","108.639","0.003","90","","2072.5","0.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-[4-(N,N-Diethylamino)benzylidene]-4-phenyl- 5-(1H-1,2,4-triazol-1-yl)thiazol-2-amine","","- C22 H22 N6 S -","- C22 H22 N6 S -","- C88 H88 N24 S4 -","4","1","FL6189","Zhou, Xin; Shao, Ling; Jin, Zhong; Liu, Jian-Bing; Fang, Jian-Xin","<i>N</i>-[4-(<i>N</i>,<i>N</i>-Diethylamino)benzylidene]-4-phenyl-5-(1<i>H</i>-1,2,4-triazol-1-yl)thiazol-2-amine","Acta Crystallographica Section E","2005","61","11","o3765","o3766","10.1107/S1600536805032733","","","0.71073","MoKα","","0.0998","0.0448","","","0.0956","0.1151","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207218","10.6903","0.0002","10.7487","0.0003","14.9344","0.0004","80.926","0.001","78.379","0.001","68.302","0.001","1555.24","0.07","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","{1,1'-Bis[bis(5-methyl-2-furyl)phosphino]ferrocene- κ^2^P,P'}dichloroplatinum(II) dichloromethane hemisolvate","","- C30.5 H29 Cl3 Fe O4 P2 Pt -","- C30.5 H29 Cl3 Fe O4 P2 Pt -","- C61 H58 Cl6 Fe2 O8 P4 Pt2 -","2","1","FL6190","Fihri, Aziz; Boudon, Julien; Hierso, Jean-Cyrille; Amardeil, Régine; Meunier, Philippe; Richard, Philippe","{1,1'-Bis[bis(5-methyl-2-furyl)phosphino]ferrocene-κ^2^<i>P</i>,<i>P</i>'}dichloroplatinum(II) dichloromethane hemisolvate","Acta Crystallographica Section E","2005","61","11","m2267","m2269","10.1107/S1600536805032034","","","0.71073","MoKα","","0.0415","0.0332","","","0.0733","0.0769","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207219","4.112","0.0006","5.7936","0.0008","14.931","0.002","90","","97.301","0.011","90","","352.82","0.09","110","","110","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","p-Bromoiodobenzene","","- C6 H4 Br I -","- C6 H4 Br I -","- C12 H8 Br2 I2 -","2","0.5","FL6191","Hiremath, Rupa; Sarjeant, Amy A.; Swift, Jennifer A.","Template-directed growth of <i>p</i>-bromoiodobenzene","Acta Crystallographica Section E","2005","61","11","o3822","o3824","10.1107/S1600536805033234","","","0.71073","MoKα","","0.0269","0.0232","","","0.0568","0.059","","","","","","1.111","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207220","5.9278","0.0011","10.234","0.002","11.6013","0.0018","107.311","0.014","100.662","0.014","98.548","0.015","644.6","0.2","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","5-Amino-1-methyl-4H-tetrazolium picrate","","- C8 H8 N8 O7 -","- C8 H8 N8 O7 -","- C16 H16 N16 O14 -","2","1","FL6192","Lyakhov, Alexander S.; Sergei V. Voitekhovich; Ivashkevich, Ludmila S.; Gaponik, Pavel N.","5-Amino-1-methyl-4<i>H</i>-tetrazolium picrate","Acta Crystallographica Section E","2005","61","11","o3645","o3647","10.1107/S1600536805031880","","","0.71073","MoKα","","0.0501","0.0439","","","0.125","0.1335","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207221","4.7858","0.0003","12.401","0.0007","17.5319","0.001","90","","95.679","0.005","90","","1035.39","0.11","296","","296","","","","","","","","","5","P 1 21 1","P 2yb","4","","Methyl 2-oxo-2,3-dihydro-1,3-benzothiazole-3-acetate","","- C10 H9 N O3 S -","- C10 H9 N O3 S -","- C40 H36 N4 O12 S4 -","4","2","FL6193","Mehmet Akkurt; Sema Öztürk Yıldırım; Yamna Baryala; Abdelfettah Zerzouf; Essassi, El-Mokhtar; Orhan Büyükgüngör","Methyl 2-oxo-2,3-dihydro-1,3-benzothiazole-3-acetate","Acta Crystallographica Section E","2005","61","11","o3872","o3873","10.1107/S1600536805034264","","","0.71073","MoKα","","0.0551","0.0403","","","0.1025","0.1094","","","","","","1.03","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207222","7.0098","0.0004","11.236","0.0007","11.6818","0.0007","98.227","0.001","98.147","0.001","102.232","0.001","875.75","0.09","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Poly[aqua(2,2'-bipyridine)(μ~3~-3-sulfonatobenzoato)lead(II)]","","- C17 H14 N2 O6 Pb S -","- C17 H14 N2 O6 Pb S -","- C34 H28 N4 O12 Pb2 S2 -","2","1","FL6194","Zhu, Long-Guan; Xiao, Hong-Ping","Poly[aqua(2,2'-bipyridine)(μ~3~-3-sulfonatobenzoato)lead(II)]","Acta Crystallographica Section E","2005","61","11","m2283","m2285","10.1107/S1600536805032289","","","0.71073","MoKα","","0.034","0.032","","","0.077","0.078","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207223","11.5149","0.0014","8.6821","0.001","14.1549","0.0017","90","","108.2","0.002","90","","1344.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethene-1,1,2,2-tetrayltetramethylene tetrathiocyanate","","- C10 H8 N4 S4 -","- C10 H8 N4 S4 -","- C40 H32 N16 S16 -","4","1","GH6023","Ustabaş, Reşat; Sancak, Kemal; Er, Mustafa; Ünver, Yasemin; Çoruh, Ufuk; Vázquez-López, Ezequiel M.; Yavuz, Metin","Ethene-1,1,2,2-tetrayltetramethylene tetrathiocyanate","Acta Crystallographica Section E","2005","61","11","o3529","o3531","10.1107/S1600536805030709","","","0.71073","MoKα","","0.0549","0.0418","","","0.1122","0.1174","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207224","9.484","0.004","10.796","0.004","18.716","0.008","102.378","0.007","93.416","0.007","113.011","0.008","1700.8","1.2","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Tris[N-(3-chlorophenyl)pyridine-2-carboxamidato-κ^2^N,N']cobalt(III) monohydrate","","- C36 H26 Cl3 Co N6 O4 -","- C36 H26 Cl3 Co N6 O4 -","- C72 H52 Cl6 Co2 N12 O8 -","2","1","GH6029","Yang, Qi Yun; Yang, Da Wu; Qi, Jian Ying; Zhou, Zhong Yuan; Chan, Albert S. C.","Tris[<i>N</i>-(3-chlorophenyl)pyridine-2-carboxamidato-κ^2^<i>N</i>,<i>N</i>']cobalt(III) monohydrate","Acta Crystallographica Section E","2005","61","11","m2362","m2364","10.1107/S1600536805030953","","","0.71073","MoKα","","0.1618","0.0747","","","0.1663","0.2086","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207225","14.4202","0.0014","7.1619","0.0007","18.5166","0.0018","90","","90","","90","","1912.3","0.3","93","2","93","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","12-Methoxy-15-(4-morpholino)podocarpa-8,11,13-trien-15-one","(6-methoxy-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthren-1- yl)morpholin-4-yl-methanone","","- C22 H31 N O3 -","- C22 H31 N O3 -","- C88 H124 N4 O12 -","4","1","GH6030","Bakare, Oladapo; John, Nicole; Butcher, Ray J.; Zalkow, Leon H.","12-Methoxy-15-(4-morpholino)podocarpa-8,11,13-trien-15-one","Acta Crystallographica Section E","2005","61","11","o3791","o3793","10.1107/S1600536805033386","","","0.71073","MoKα","","0.0506","0.0419","","","0.1057","0.1111","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207226","7.481","0.006","8.2693","0.0012","9.859","0.003","90","","108.76","0.06","90","","577.5","0.5","120","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","calcium octaborate tetrahydroxide","","- B8 Ca H4 O15 -","- B8 Ca H4 O15 -","- B16 Ca2 H8 O30 -","2","1","HB6258","Wiggin, Seth B.; Weller, Mark T.","Redetermination of CaB~8~O~11~(OH)~4~ at low temperature","Acta Crystallographica, Section E","2005","61","11","i243","i245","10.1107/S1600536805029296","","","0.71073","MoKα","","","0.034","","","","0.0752","","","","","","1.054","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207227","12.952","0.005","27.564","0.011","15.147","0.006","90","","104.499","0.006","90","","5235","4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(benzimidazole)bis(4-hydroxybenzoato)cobalt(II) 0.25-hydrate","","- C28 H22.5 Co N4 O6.25 -","- C28 H22.5 Co N4 O6.25 -","- C224 H180 Co8 N32 O50 -","8","1","HB6264","Yan Zheng; Tian-Tian Pan; Duan-Jun Xu","Bis(benzimidazole)bis(4-hydroxybenzoato)cobalt(II) 0.25-hydrate","Acta Crystallographica Section E","2005","61","11","m2294","m2296","10.1107/S1600536805032472","","","0.71073","MoKα","","0.085","0.042","","","0.091","0.115","","","","","","1.003","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2207228","9.863","0.005","6.458","0.003","13.007","0.007","90","","111.199","0.008","90","","772.4","0.7","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","Diaquabis(D-valinato-κ^2^N,O)nickel(II)","diaquabis(2-amino-3-methylbutyrato-κ^2^N,O)nickel(II)","","- C10 H24 N2 Ni O6 -","- C10 H24 N2 Ni O6 -","- C20 H48 N4 Ni2 O12 -","2","0.5","HB6267","Bian, He-Dong; Zhang, Xiu-Qing; Yang, Xiao-E; Yu, Qing; Liang, Hong","Diaquabis(<small>D</small>-valinato-κ^2^<i>N</i>,<i>O</i>)nickel(II)","Acta Crystallographica Section E","2005","61","11","m2237","m2239","10.1107/S1600536805031405","","","0.71073","MoKα","","0.0646","0.0521","","","0.1173","0.1411","","","","","","1.104","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2207229","9.9119","0.001","5.2232","0.0005","10.3877","0.001","90","","95.807","0.002","90","","535.03","0.09","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","bis(2,4-pentanedionato)palladium(II)","","- C10 H14 O4 Pd -","- C10 H14 O4 Pd -","- C20 H28 O8 Pd2 -","2","0.5","HB6271","Hamid, Mazhar; Zeller, Matthias; Hunter, Allen D.; Mazhar, Muhammad; Tahir, Asif Ali","Redetermination of bis(2,4-pentanedionato)palladium(II)","Acta Crystallographica Section E","2005","61","11","m2181","m2183","10.1107/S1600536805030692","","","0.71073","MoKα","","0.0256","0.0242","","","0.0659","0.0675","","","","","","1.096","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207230","8.0109","0.0016","8.7198","0.0017","28.718","0.006","90","","90","","90","","2006.1","0.7","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-(1-phenylethyl)-1-ferrocenylbenzylamine","α-Ferrocenyl-N-(1-phenylethyl)benzylamine","","- C25 H25 Fe N -","- C25 H25 Fe N -","- C100 H100 Fe4 N4 -","4","1","HB6275","Yin, Zhi-Gang; Qian, Heng-Yu","α-Ferrocenyl-<i>N</i>-(1-phenylethyl)benzylamine","Acta Crystallographica Section E","2005","61","11","m2351","m2352","10.1107/S1600536805033039","","","0.71073","MoKα","","0.0864","0.0582","","","0.1088","0.1131","","","","","","0.994","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207231","10.552","0.002","10.622","0.002","14.881","0.003","92.088","0.004","104.987","0.003","118.429","0.003","1391.7","0.5","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Piperazinium fac-tris(salicylato-κ^2^O,O')titanate(IV) dimethylformamide solvate","","- C28 H31 N3 O10 Ti -","- C28 H31 N3 O10 Ti -","- C56 H62 N6 O20 Ti2 -","2","1","HB6276","Jia-Lin Ren; Yun-Long Fu; Zhi-Wei Xu","Piperazinium <i>fac</i>-tris(salicylato-κ^2^<i>O</i>,<i>O</i>')titanate(IV) dimethylformamide solvate","Acta Crystallographica Section E","2005","61","11","m2228","m2229","10.1107/S1600536805031417","","","0.71073","MoKα","","0.0813","0.0569","","","0.1428","0.1765","","","","","","1.065","","","","has coordinates,has Fobs","194583","2020-10-21","18:00:00",""
"2207232","13.0136","0.0002","14.6979","0.0002","15.8864","0.0002","100.982","0.0009","112.315","0.0008","98.9674","0.0008","2671.05","0.07","200","","200","","","","","","","","","6","P -1","-P 1","2","","Bis(μ~3~-4-bromophenylimido)tris(tricarbonylruthenium)(2 Ru—Ru)","","- C21 H8 Br2 N2 O9 Ru3 -","- C21 H8 Br2 N2 O9 Ru3 -","- C84 H32 Br8 N8 O36 Ru12 -","4","2","HB6277","Anthony C. Willis; Waleed K. Mahdi; Mark G. Humphrey","Bis(μ~3~-4-bromophenylimido)tris(tricarbonylruthenium)(2 <i>Ru{—</i>Ru})","Acta Crystallographica Section E","2005","61","11","m2335","m2337","10.1107/S1600536805032885","","","0.71073","MoKα","","0.0397","0.0251","","0.0345","0.0299","0.0299","","","","","","1.0652","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207233","14.877","0.003","7.872","0.002","16.527","0.003","90","","112.04","0.03","90","","1794.1","0.8","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(9-hydroxyfluorene-9-carboxylato-κ^2^O,O')bis(3-hydroxypyridine- κN)copper(II) methanol disolvate","","- C40 H36 Cu N2 O10 -","- C40 H36 Cu N2 O10 -","- C80 H72 Cu2 N4 O20 -","2","0.5","HB6278","Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","Bis(9-hydroxyfluorene-9-carboxylato-κ^2^<i>O</i>,<i>O</i>')bis(3-hydroxypyridine-κ<i>N</i>)copper(II) methanol disolvate","Acta Crystallographica Section E","2005","61","11","m2192","m2193","10.1107/S1600536805031156","","","0.71073","MoKα","","0.037","0.033","","","0.099","0.101","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207234","9.354","0.002","14.876","0.003","10.231","0.002","90","","109.58","0.03","90","","1341.3","0.5","295","2","295","3","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[bis[(pyridine-κN)zinc(II)](Zn—Zn)-μ~4~-carboxylatophenoxyacetato]","","- C28 H22 N2 O10 Zn2 -","- C28 H22 N2 O10 Zn2 -","- C56 H44 N4 O20 Zn4 -","2","0.5","HB6279","Huo, Li-Hua; Gao, Shan; Ng, Seik Weng","Poly[bis[(pyridine-κ<i>N</i>)zinc(II)](<i>Zn</i>—<i>Zn</i>)-μ~4~-carboxylatophenoxyacetato]","Acta Crystallographica Section E","2005","61","11","m2254","m2255","10.1107/S1600536805031788","","","0.71073","MoKα","","0.043","0.032","","","0.075","0.08","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207235","9.6189","0.0018","10.639","0.002","10.986","0.002","79.523","0.003","64.995","0.003","70.574","0.003","959.8","0.3","293","2","","","","","","","","","","6","P -1","-P 1","2","","Poly[[tris(μ~2~-4,4'-bipyridyl-κ^2^N:N')bis(μ~2~-nitrato-κ^2^O,O') hexa-μ~2~oxo-dioxodimolybdenumtricopper(II)] tetrahydrate]","","- C30 H32 Cu3 Mo2 N8 O18 -","- C30 H24 Cu3 Mo2 N8 O18 -","- C30 H24 Cu3 Mo2 N8 O18 -","1","0.5","HB6280","Kong, Xiang-Jian; Ren, Yan-Ping; Long, La-Sheng; Huang, Rong-Bin; Zhang, Lan-Sun","Poly[[tris(μ~2~-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis(μ~2~-nitrato-κ^2^<i>O</i>,<i>O</i>')hexa-μ~2~-oxo-dioxodimolybdenumtricopper(II)] tetrahydrate]: a polymeric hybrid framework containing Cu^2+^, 4,4-bipyridine, [MoO~4~]^2{-^} and NO~3~^{-^} building units","Acta Crystallographica Section E","2005","61","11","m2346","m2347","10.1107/S160053680503268X","","","0.71073","MoKα","","0.0339","0.0321","","","0.0839","0.0851","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207236","10.47","0.02","18.32","0.02","7.646","0.009","90","","103.92","0.05","90","","1424","4","123.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2,2'-bipyridyl-κ^2^N,N')chloro(glycinato-κ^2^N:O)copper(II) dihydrate","","- C12 H16 Cl Cu N3 O4 -","- C12 H16 Cl Cu N3 O4 -","- C48 H64 Cl4 Cu4 N12 O16 -","4","1","HB6281","Masahiro Yodoshi; Mamiko Odoko; Nobuo Okabe","Redetermination of (2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')chloro(glycinato-κ^2^<i>N</i>:<i>O</i>)copper(II) dihydrate","Acta Crystallographica Section E","2005","61","11","m2299","m2301","10.1107/S1600536805032265","","","0.7107","MoKα","","","0.03","","","","0.086","","","","","","0.943","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207237","9.2011","0.0019","10.933","0.002","31.164","0.006","90","","92.821","0.003","90","","3131.2","1.1","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chlorobis(N,N-di-n-butyldithiocarbamato)phenyltin(IV)","","- C24 H41 Cl N2 S4 Sn -","- C24 H41 Cl N2 S4 Sn -","- C96 H164 Cl4 N8 S16 Sn4 -","4","1","HB6282","Yong-Xin Li; Ru-Fen Zhang; Chun-Lin Ma","Chlorobis(<i>N</i>,<i>N</i>-di-<i>n</i>-butyldithiocarbamato)phenyltin(IV)","Acta Crystallographica Section E","2005","61","11","m2365","m2366","10.1107/S1600536805033635","","","0.71073","MoKα","","0.1341","0.0747","","","0.2064","0.2538","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207238","13.1155","0.0012","8.9953","0.0011","14.0924","0.0012","90","","92.59","0.002","90","","1660.9","0.3","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(2,2'-Diamino-4,4'-bi-1,3-thiazole-κ^2^N,N')bis(glycinato-κ^2^N,O)cobalt(II) dihydrate","","- C10 H18 Co N6 O6 S2 -","- C10 H18 Co N6 O6 S2 -","- C40 H72 Co4 N24 O24 S8 -","4","0.5","HB6283","Jian-Yong Yu; Bing-Xin Liu; Duan-Jun Xu","(2,2'-Diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')bis(glycinato-κ^2^<i>N</i>,<i>O</i>)cobalt(II) dihydrate","Acta Crystallographica Section E","2005","61","11","m2232","m2233","10.1107/S1600536805031612","","","0.71073","MoKα","","0.026","0.024","","","0.065","0.066","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207239","9.228","0.001","13.363","0.002","13.222","0.002","90","","107.783","0.001","90","","1552.6","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(3-hydroxypyridine-2-carboxylato)dimethyltin(IV)","","- C14 H14 N2 O6 Sn -","- C14 H14 N2 O6 Sn -","- C56 H56 N8 O24 Sn4 -","4","0.5","HB6285","Tian, Guang-Ru; Zhang, Ru-Fen; Ma, Chun-Lin; Ng, Seik Weng","Bis(3-hydroxypyridine-2-carboxylato)dimethyltin(IV)","Acta Crystallographica Section E","2005","61","11","m2276","m2277","10.1107/S1600536805032277","","","0.71073","MoKα","","0.041","0.034","","","0.085","0.09","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207240","7.0335","0.0007","10.2471","0.0008","9.484","0.0008","90","","106.83","0.006","90","","654.26","0.1","295","2","295","2","","","","","","","","7","P 1 21 1","P 2yb","4","","catena-Poly[[chloro(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^N,N')cadmium(II)]- μ-glycinato-κ^2^N,O:O']","","- C8 H10 Cd Cl N5 O2 S2 -","- C8 H10 Cd Cl N5 O2 S2 -","- C16 H20 Cd2 Cl2 N10 O4 S4 -","2","1","HB6286","Bing-Xin Liu; Jian-Yong Yu; Duan-Jun Xu","<i>catena</i>-Poly[[chloro(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-glycinato-κ^2^<i>N</i>,<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","11","m2291","m2293","10.1107/S1600536805032071","","","0.71073","MoKα","","0.014","0.014","","","0.033","0.034","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207241","10.148","0.002","9.098","0.0019","15.967","0.003","90","","103.868","0.003","90","","1431.2","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-1-(3-Ethoxy-4-hydroxybenzylidene)-2-(4-nitrophenyl)hydrazine","","- C15 H15 N3 O4 -","- C15 H15 N3 O4 -","- C60 H60 N12 O16 -","4","1","HB6287","Zhen, Xiao-Li; Han, Jian-Rong","(<i>E</i>)-1-(3-Ethoxy-4-hydroxybenzylidene)-2-(4-nitrophenyl)hydrazine","Acta Crystallographica Section E","2005","61","11","o3721","o3722","10.1107/S1600536805032617","","","0.71073","MoKα","","0.0821","0.0402","","","0.091","0.1104","","","","","","0.998","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207242","10.8194","0.0015","9.0434","0.0015","16.998","0.002","90","","96.89","0.012","90","","1651.1","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Tris(L-argininium) hexafluorochromate(III) trihydrate","","- C18 H51 Cr F6 N12 O9 -","- C18 H51 Cr F6 N12 O9 -","- C36 H102 Cr2 F12 N24 O18 -","2","1","HB6288","Ramos Silva, M.; Matos Beja, A.; Paixão, J. A.","Tris(<small>L</small>-argininium) hexafluorochromate(III) trihydrate","Acta Crystallographica Section E","2005","61","11","m2459","m2461","10.1107/S160053680503504X","","","0.71073","MoKα","","0.0386","0.0278","","","0.0721","0.0758","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2207243","7.2391","0.0009","10.658","0.001","5.988","0.0006","90","","90","","90","","462","0.09","295","2","295","2","","","","","","","","3","P b c n","-P 2n 2ab","60","Magnesium ditellurite","magnesium pentaoxoditellurate(IV)","","- Mg O5 Te2 -","- Mg O5 Te2 -","- Mg4 O20 Te8 -","4","0.5","HB6289","Weil, Matthias","Redetermination of MgTe~2~O~5~","Acta Crystallographica, Section E","2005","61","11","i237","i239","10.1107/S1600536805033751","","","0.71073","MoKα","","0.0207","0.0181","","","0.04","0.041","","","","","","1.245","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2207244","14.816","0.003","7.6177","0.0015","19.153","0.004","90","","90.46","0.03","90","","2161.6","0.8","285","2","285","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Decacarbonyl-1κ^3^C,2κ^3^C,3κ^4^C-(μ-pentafluorophenylhydrazine- 1κN:2κN')-triangulo-triosmium","","- C16 H3 F5 N2 O10 Os3 -","- C16 H3 F5 N2 O10 Os3 -","- C64 H12 F20 N8 O40 Os12 -","4","1","HB6290","Sun, Bai-Wang; Zhang, Mei-Su; Yang, Guo-Ying; Siau, Gek Ang; How, Ghee Ang","Decacarbonyl-1κ^3^<i>C</i>,2κ^3^<i>C</i>,3κ^4^<i>C</i>-(μ-pentafluorophenylhydrazine-1κ<i>N</i>:2κ<i>N</i>')-<i>triangulo</i>-triosmium: a hydrazino-edge-bridged triangular triosmium cluster","Acta Crystallographica Section E","2005","61","11","m2419","m2420","10.1107/S1600536805034471","","","0.71073","MoKα","","0.0494","0.0403","","","0.1002","0.1121","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207245","9.414","0.002","9.943","0.002","11.332","0.003","94.829","0.003","98.144","0.003","117.247","0.002","920","0.4","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","μ-(furan-2-carbaldehyde azine)-1κ^2^O,N:2κ^2^N',O'-bis[(furan-2-carbaldehyde azine-κ^2^N,O)silver(I)] bis(hexafluorophosphate)","","- C30 H24 Ag2 F12 N6 O6 P2 -","- C30 H24 Ag2 F12 N6 O6 P2 -","- C30 H24 Ag2 F12 N6 O6 P2 -","1","0.5","HB6291","Wang, Le; Dong, Yu-Bin; Ma, Jian-Ping; Huang, Ru-Qi","μ-(Furan-2-carbaldehyde azine)-1κ^2^<i>O</i>,<i>N</i>:2κ^2^<i>N</i>',<i>O</i>'-bis[(furan-2-carbaldehyde azine-κ^2^<i>N</i>,<i>O</i>)silver(I)] bis(hexafluorophosphate): an unusual complex containing two metal atoms and three ligands","Acta Crystallographica Section E","2005","61","11","m2369","m2370","10.1107/S1600536805033611","","","0.71073","MoKα","","0.0514","0.0441","","","0.1066","0.1112","","","","","","1.053","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207246","13.8023","0.0016","19.731","0.003","25.597","0.003","75.823","0.009","74.676","0.01","69.907","0.008","6221.8","1.5","150","","150","","","","","","","","","7","P -1","-P 1","2","","mer-trichloro(dimethyl sulfoxide-κS)(-1,10-phenanthroline)ruthenium(III) chloroform solvate","","- C15 H15 Cl6 N2 O Ru S -","- C15 H15 Cl6 N2 O Ru S -","- C180 H180 Cl72 N24 O12 Ru12 S12 -","12","6","HB6296","Spek, Anthony L.; Tooke, Duncan M.; Garza-Ortiz, Ariadna; Reedijk, Jan","Non-merohedrally twinned <i>mer</i>-trichloro(dimethyl sulfoxide-κ<i>S</i>)(1,10-phenanthroline)ruthenium(III) chloroform solvate, with <i>Z</i>' = 6","Acta Crystallographica Section E","2005","61","11","m2428","m2430","10.1107/S1600536805034756","","","0.71073","MoKα","","0.0786","0.0463","","","0.1136","0.134","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207247","23.543","0.001","8.7177","0.001","18.6177","0.0014","90","","128.484","0.01","90","","2991.1","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Cyclohexylaminium vicrate","Cyclohexylammonium picrate","","- C12 H16 N4 O7 -","- C12 H16 N4 O7 -","- C96 H128 N32 O56 -","8","1","HG6239","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Krishnan SethuSankar; Kandasamy Sivakumar","Cyclohexylammonium picrate","Acta Crystallographica Section E","2005","61","11","o3605","o3607","10.1107/S1600536805031375","","","0.71073","MoKα","","0.1239","0.0624","","","0.1452","0.1763","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207248","11.585","0.002","6.242","0.001","12.313","0.002","90","","99.73","0.01","90","","877.6","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","Neridienone A","12β-hydroxypregna-4,6,16-triene-3,20-dienone","","- C21 H26 O3 -","- C21 H26 O3 -","- C42 H52 O6 -","2","1","HG6249","Kumar, Rishi; Sagar, Ram; Shaw, Arun K.; Maulik, Prakas R.","Neridienone A, a pregnane from the roots of <i>Nerium oleander</i>","Acta Crystallographica Section E","2005","61","11","o3905","o3907","10.1107/S1600536805034446","","","0.71073","MoKα","","0.0667","0.0435","","","0.0878","0.0969","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207249","7.4671","0.0017","11.547","0.003","17.445","0.004","90","","90","","90","","1504.2","0.6","291","2","291","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","L-1-(p-Tolylsulfonyl)proline ethyl ester","","- C14 H19 N O4 S -","- C14 H19 N O4 S -","- C56 H76 N4 O16 S4 -","4","1","HG6251","Chen, Yong-Jiang; Xu, Gang; Cui, Yu-Bo; Huang, Wei; Gou, Shao-Hua","1-(<i>p</i>-Tolylsulfonyl)-<small>L</small>-proline ethyl ester","Acta Crystallographica Section E","2005","61","11","o3571","o3573","10.1107/S1600536805031636","","","0.71073","MoKα","","0.0752","0.0477","","","0.0812","0.088","","","","","","0.907","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207250","9.571","0.004","11.794","0.004","11.345","0.005","90","","95.89","0.03","90","","1273.9","0.9","298.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,4-Dichloro-6-(piperidin-1-ylmethyl)phenol","","- C12 H15 Cl2 N O -","- C12 H15 Cl2 N O -","- C48 H60 Cl8 N4 O4 -","4","1","HG6252","Kubono, Koji; Oshima, Syunichi; Hirayama, Naoki; Yokoi, Kunihiko","2,4-Dichloro-6-(piperidin-1-ylmethyl)phenol","Acta Crystallographica Section E","2005","61","11","o3706","o3708","10.1107/S1600536805032290","","","0.71069","MoKα","","","0.0394","","","","0.1327","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207251","15.539","0.0002","17.8363","0.0003","11.6349","0.0003","90","","108.658","0.0007","90","","3055.23","0.1","295","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 3-(methylamino)-2-(4-methylphenyl)furan-4,5-dicarboxylate","","- C16 H17 N O5 -","- C16 H17 N O5 -","- C128 H136 N8 O40 -","8","2","HG6253","Yunhua Cheng; Cheng Ma","Dimethyl 3-(methylamino)-2-(4-methylphenyl)furan-4,5-dicarboxylate","Acta Crystallographica Section E","2005","61","11","o3688","o3690","10.1107/S1600536805032307","","","0.71069","MoKα","","","0.0529","","","","0.1586","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207252","10.257","0.002","11.856","0.002","12.892","0.003","90","","90","","90","","1567.8","0.5","297","","297","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Phenyl-3-[(1-phenylethyl)amino]but-2-en-1-one","","- C18 H19 N O -","- C18 H19 N O -","- C72 H76 N4 O4 -","4","1","HG6254","Yao-Cheng Shi; Chun-Xia Sui; Hua-Mei Yang","1-Phenyl-3-[(1-phenylethyl)amino]but-2-en-1-one","Acta Crystallographica Section E","2005","61","11","o3574","o3575","10.1107/S1600536805031648","","","0.71073","MoKα","","0.1432","0.0566","","","0.1696","0.212","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207253","7.666","0.004","11.9817","0.0019","12.426","0.003","65.747","0.015","80.79","0.05","72.25","0.03","990.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Hexaacetamidecadmium Triiodide Adduct with Two Iodine Molecules","","- C12 H30 Cd I10 N6 O6 -","- C12 H30 Cd I10 N6 O6 -","- C12 H30 Cd I10 N6 O6 -","1","0.5","HG6255","Elena V. Savinkina; Ilya A. Zamilatskov; Yana F. Al Ansari; Dmitry V. Albov; Aslan Yu. Tsivadze","A woven structure of hexaacetamidecadmium(II) polyiodide","Acta Crystallographica Section E","2005","61","11","m2371","m2373","10.1107/S1600536805032897","","","0.71073","Mokα","","0.1139","0.048","","","0.069","0.0829","","","","","","0.867","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207254","9.3233","0.0008","4.9446","0.0005","10.2051","0.001","90","","91.388","0.005","90","","470.32","0.08","160","2","160","2","","","","","","","","5","P 1 21 1","P 2yb","4","","5-Phenoxymethyl-1,3,4-oxadiazole-2(3H)-thione","","- C9 H8 N2 O2 S -","- C9 H8 N2 O2 S -","- C18 H16 N4 O4 S2 -","2","1","HG6256","Thamotharan, S.; Parthasarathi, V.; Anandha Babu, G.; Hunnur, Raveendra K.; Badami, Bharati; Linden, Anthony","5-Phenoxymethyl-1,3,4-oxadiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","11","o3746","o3747","10.1107/S1600536805033027","","","0.71073","MoKα","","0.0623","0.0465","","","0.0977","0.1046","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207255","9.016","0.003","8.752","0.003","20.664","0.008","90","","100.614","0.014","90","","1602.7","1","296","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 N O -","- C21 H17 N O -","- C84 H68 N4 O4 -","4","1","HG6261","Luo, Cheng-Cai; Zhang, Hua-Xing; Wu, Tian-Xing","(3<i>S</i>*,4<i>S</i>*)-1,3,4-Triphenylazetidin-2-one","Acta Crystallographica Section E","2005","61","11","o3956","o3957","10.1107/S1600536805035063","","","0.71075","MoKα","","","0.0364","","","","0.0773","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207256","16.629","0.002","14.9729","0.0019","22.899","0.003","90","","90","","90","","5701.5","1.2","294","2","294","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","4-(4,4-Diphenylbuta-1,3-dienyl)-N,N-bis(4-methylphenyl)aniline","","- C36 H31 N -","- C36 H31 N -","- C288 H248 N8 -","8","1","HK6041","Wu, An-Shu; Li, Xiang-Gao; He, Li-Li; Wang, Shi-Rong","4-(4,4-Diphenylbuta-1,3-dienyl)-<i>N</i>,<i>N</i>-bis(4-methylphenyl)aniline","Acta Crystallographica Section E","2005","61","11","o3699","o3700","10.1107/S1600536805032423","","","0.71073","MoKα","","0.1406","0.0504","","","","0.1431","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207257","11.6941","0.0008","7.5492","0.0005","16.7683","0.0012","90","","94.169","0.001","90","","1476.41","0.18","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E,E)-4-Hydroxy-3-methoxybenzaldehyde azine","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C64 H64 N8 O16 -","4","1","HK6042","Qu, Yang; Sun, Xian-Ming","(<i>E</i>,<i>E</i>)-4-Hydroxy-3-methoxybenzaldehyde azine","Acta Crystallographica Section E","2005","61","11","o3828","o3830","10.1107/S1600536805032435","","","0.71073","MoKα","","0.0453","0.0417","","","0.1141","0.1172","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207258","7.934","0.003","10.607","0.004","11.752","0.004","80.89","0.005","75.5","0.006","72.55","0.006","909.7","0.6","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","1,3-diphenyl-1H-pyrazol-5-yl 4-chlorobenzoate","","- C22 H15 Cl N2 O2 -","- C22 H15 Cl N2 O2 -","- C44 H30 Cl2 N4 O4 -","2","1","HK6045","Li, Jiang-Sheng; Duan, Xue-Min; Huang, Peng-Mian; Zeng, Tao; Fan, Mei-Lian","1,3-Diphenyl-1<i>H</i>-pyrazol-5-yl 4-chlorobenzoate","Acta Crystallographica Section E","2005","61","11","o3862","o3863","10.1107/S1600536805033982","","","0.71073","MoKα","","0.0713","0.0409","","","0.0935","0.1123","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207259","10.95","0.002","5.8163","0.0012","30.968","0.006","90","","91.01","0.004","90","","1972","0.7","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-(4-Methoxybenzoyl)-6-(4-methoxyphenyl)-3-phenyl-3,4-dihydro-2H- 1,3-oxazine-2,4-dione","","- C25 H19 N O6 -","- C25 H19 N O6 -","- C100 H76 N4 O24 -","4","1","HK6046","Adams, Harry; Hawxwell, Samuel M.; Mustafa Saçmaci; Şevket Hakan Üngoren; Yunus Akçamur; Recep Sahingoz","5-(4-Methoxybenzoyl)-6-(4-methoxyphenyl)-3-phenyl-3,4-dihydro-2<i>H</i>-1,3-oxazine-2,4-dione","Acta Crystallographica Section E","2005","61","11","o3910","o3911","10.1107/S1600536805034719","","","0.71073","MoKα","","0.1089","0.0553","","","0.1247","0.1535","","","","","","0.978","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207260","10.1797","0.0012","12.5347","0.0014","13.6855","0.0016","107.999","0.002","99.985","0.002","90.504","0.002","1632","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H35 N3 O5 -","- C41 H35 N3 O5 -","- C82 H70 N6 O10 -","2","1","HK6047","Adams, Harry; Hawxwell, Samuel M.; Mustafa Saçmaci; Şevket Hakan Üngoren; Yunus Akçamur; Recep Şahi̇ngöz","4,7a-Bis(4-methoxyphenyl)-1,3,7-tris(4-methylphenyl)-2,3,5,6,7,7a-hexahydro-1<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidine-2,5,6-trione","Acta Crystallographica Section E","2005","61","11","o3953","o3955","10.1107/S1600536805035191","","","0.71073","MoKα","","0.1143","0.0504","","","0.1051","0.129","","","","","","0.981","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207261","7.5419","0.0016","7.7652","0.0016","12.703","0.003","95.485","0.003","93.302","0.003","118.389","0.003","647","0.2","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","Chloro(1-isopropylidene-4-methyl-3-thiosemicarbazidato- κ^2^N^3^,S)dimethyltin(IV)","","- C7 H16 Cl N3 S Sn -","- C7 H16 Cl N3 S Sn -","- C14 H32 Cl2 N6 S2 Sn2 -","2","1","HK6049","Sweise, Abdulrazeq T.; Farina, Yang; Bohari M. Yamin","Chloro(1-isopropylidene-4-methyl-3-thiosemicarbazidato-κ^2^<i>N</i>^3^,<i>S</i>)dimethyltin(IV)","Acta Crystallographica Section E","2005","61","11","m2421","m2423","10.1107/S1600536805034136","","","0.71073","MoKα","","0.025","0.023","","","0.061","0.062","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207262","8.152","0.0017","8.4524","0.0018","13.496","0.003","76.932","0.003","80.645","0.004","61.528","0.003","794.7","0.3","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H18 O6 -","- C18 H18 O6 -","- C36 H36 O12 -","2","1","HK6051","Han, Jian-Rong; Zhen, Xiao-Li","3-[2-(5-Formyl-2-methoxyphenoxy)ethoxy]-4-methoxybenzaldehyde","Acta Crystallographica Section E","2005","61","11","o3946","o3947","10.1107/S1600536805035117","","","0.71073","MoKα","","0.0524","0.0364","","","0.0914","0.1042","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207263","7.136","0.003","10.515","0.004","10.517","0.004","110.553","0.004","91.344","0.005","102.424","0.005","717.4","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Poly[piperazinium(2+) [hexaaquabis(μ~3~-benzene-1,3,5- tricarboxylato)dinickel(II)] dihydrate]","","- C22 H34 N2 Ni2 O20 -","- C22 H34 N2 Ni2 O20 -","- C22 H34 N2 Ni2 O20 -","1","0.5","IS6125","Han, Jin-Yu; Wei, Wen-Ying","Poly[piperazinium(2+) [hexaaquabis(μ~3~-benzene-1,3,5-tricarboxylato)dinickel(II)] dihydrate]","Acta Crystallographica Section E","2005","61","11","m2242","m2243","10.1107/S160053680503182X","","","0.71073","MoKα","","0.0401","0.0302","","","0.0778","0.0843","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207264","11.39","0.003","9.705","0.003","13.072","0.004","90","","106.532","0.004","90","","1385.2","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-Methylphenyl)-N-[3-(2-nitrophenyl)prop-2-enylidene]amine","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C64 H56 N8 O8 -","4","1","IS6128","Xiao-Yan Yang; Ying Li; Xue-Mei Li; Shu-Sheng Zhang","<i>N</i>-(2-Methylphenyl)-<i>N</i>-[3-(2-nitrophenyl)prop-2-enylidene]amine","Acta Crystallographica Section E","2005","61","11","o3634","o3635","10.1107/S1600536805031491","","","0.71073","MoKα","","0.0552","0.0447","","","0.1207","0.13","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207265","14.9935","0.0011","10.1824","0.0007","16.9848","0.0012","90","","98.434","0.002","90","","2565","0.3","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dicyclohexylammonium 1-(2-hydroxy-1-naphthyl)-2-naphtholate","","- C32 H37 N O2 -","- C32 H37 N O2 -","- C128 H148 N4 O8 -","4","1","IS6129","Ji-Xin Yuan; Li Li; Xin-Yuan Song; Zhi-Min Jin","Dicyclohexylammonium 1-(2-hydroxy-1-naphthyl)-2-naphtholate","Acta Crystallographica Section E","2005","61","11","o3712","o3714","10.1107/S1600536805032447","","","0.71073","MoKα","","0.1416","0.0986","","","0.1595","0.1757","","","","","","1.211","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207266","7.485","0.003","8.509","0.004","16.377","0.007","82.938","0.006","78.218","0.006","83.095","0.006","1008.5","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-{[(4-(4-Methylphenylsulfonamido)benzoyl]methylidene}- 3,4-dihydroquinoxalin-2(1H)-one","","- C23 H19 N3 O4 S -","- C23 H19 N3 O4 S -","- C46 H38 N6 O8 S2 -","2","1","IS6130","Yi-Sheng Xu; Cheng-Chu Zeng; Xue-Mei Li; Ru-Gang Zhong","3-{[4-(4-Methylphenylsulfonamido)benzoyl]methylidene}-3,4-dihydroquinoxalin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","11","o3802","o3804","10.1107/S1600536805033301","","","0.71073","MoKα","","0.0689","0.0422","","","0.1149","0.1267","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207267","6.334","0.0016","12.384","0.003","21.911","0.006","90","","90","","90","","1718.7","0.8","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-Hydroxy-17-oxoestra-3,5-dien-3-yl acetate","","- C20 H26 O3 -","- C20 H26 O3 -","- C80 H104 O12 -","4","1","IS6131","Chun-Nian Xia; Wei-Xiao Hu; Wei Zhou","3-Hydroxy-17-oxoestra-3,5-dien-3-yl acetate","Acta Crystallographica Section E","2005","61","11","o3754","o3756","10.1107/S1600536805032812","","","0.71073","MoKα","","0.1359","0.0499","","","0.1632","0.2294","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207268","7.1783","0.0018","8.501","0.002","14.108","0.003","78.294","0.003","76.293","0.003","83.317","0.004","816.9","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Dibromobis(4-methoxypyridine N-oxide-κO)zinc(II)","","- C12 H14 Br2 N2 O4 Zn -","- C12 H14 Br2 N2 O4 Zn -","- C24 H28 Br4 N4 O8 Zn2 -","2","1","IS6132","Shi, Jing Min; Zhang, Feng Xia; Wu, Chang Ju; Liu, Lian Dong","Dibromobis(4-methoxypyridine <i>N</i>-oxide-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2005","61","11","m2262","m2263","10.1107/S1600536805031922","","","0.71073","MoKα","","0.059","0.0405","","","0.0951","0.1022","","","","","","0.991","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207269","11.76","0.0016","9.5328","0.0013","15.3997","0.0016","90","","118.103","0.008","90","","1522.9","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(dimethylammonium) aquadioxalatocuprate(II) monohydrate","","- C8 H20 Cu N2 O10 -","- C8 H20 Cu N2 O10 -","- C32 H80 Cu4 N8 O40 -","4","1","IS6133","Xin-Hua Li","Bis(dimethylammonium) aquadioxalatocuprate(II) monohydrate","Acta Crystallographica Section E","2005","61","11","m2327","m2328","10.1107/S1600536805032721","","","0.71073","MoKα","","0.028","0.025","","","0.0716","0.0734","","","","","","1.063","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207270","10.3419","0.0019","10.892","0.002","11.592","0.002","90","","102.982","0.003","90","","1272.4","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-2'-chloro-5-methylbenzophenone","","- C14 H12 Cl N O -","- C14 H12 Cl N O -","- C56 H48 Cl4 N4 O4 -","4","1","IS6135","Zhi-Yong Xing; Hui-Min Liu; Li Wu; Wen-Qin Zhang","2-Amino-2'-chloro-5-methylbenzophenone","Acta Crystallographica Section E","2005","61","11","o3796","o3797","10.1107/S1600536805033313","","","0.71073","MoKα","","0.0722","0.0447","","","0.1071","0.1238","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207271","11.493","0.007","9.591","0.005","10.456","0.004","90","","94.211","0.019","90","","1149.4","1","296","1","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Amino-4-phenylselenazolium bromide monohydrate","","- C9 H11 Br N2 O Se -","- C9 H11 Br N2 O Se -","- C36 H44 Br4 N8 O4 Se4 -","4","1","IS6136","Xiu-Rong Hu; You-Chu Zhang; Jian-Ming Gu","2-Amino-4-phenylselenazolium bromide monohydrate","Acta Crystallographica Section E","2005","61","11","o3881","o3882","10.1107/S1600536805033945","","","0.71075","MoKα","","","0.0301","","","","0.0767","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207272","7.0788","0.0013","18.66","0.003","8.6256","0.0016","90","","96.649","0.009","90","","1131.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-Bipyridine‒2-nitrobenzonic acid (1/2)","","- C24 H18 N4 O8 -","- C24 H18 N4 O8 -","- C48 H36 N8 O16 -","2","0.5","IS6137","Yu-Mei Dai; Jin-Feng Huang; Hui-Ying Shen","4,4'-Bipyridine‒2-nitrobenzonic acid (1/2)","Acta Crystallographica Section E","2005","61","11","o3919","o3920","10.1107/S1600536805034513","","","0.71073","MoKα","","","0.0744","","","0.1436","0.1563","","","","","","1.186","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207273","7.5209","0.001","19.221","0.003","18.971","0.003","90","","96.265","0.002","90","","2726.1","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-N-Benzoyl-N'-(3-hydroxy-4-methoxybenzylidene)hydrazine","","- C15 H14 N2 O3 -","- C15 H14 N2 O3 -","- C120 H112 N16 O24 -","8","2","IS6140","Shi, Jun","(<i>E</i>)-<i>N</i>-Benzoyl-<i>N</i>'-(3-hydroxy-4-methoxybenzylidene)hydrazine","Acta Crystallographica Section E","2005","61","11","o3917","o3918","10.1107/S1600536805034653","","","0.71073","MoKα","","0.0808","0.0445","","","0.1016","0.1205","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207274","11.289","0.002","8.638","0.0017","14.193","0.003","90","","113.42","0.03","90","","1270","0.5","288","2","288","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5-Benzylbenzene-1,2,4-tricarbonitrile","","- C16 H9 N3 -","- C16 H9 N3 -","- C64 H36 N12 -","4","1","JH6020","Yan-Guang Wang; Hui-Ying An; Zhi-Feng Lu; Lin Wu; Jian-Hua Xu","5-Benzylbenzene-1,2,4-tricarbonitrile","Acta Crystallographica Section E","2005","61","11","o3543","o3544","10.1107/S1600536805031260","","","0.71073","MoKα","","0.0927","0.0518","","","0.1132","0.1244","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207275","14.692","0.004","7.805","0.002","22.048","0.006","90","","108.551","0.004","90","","2396.9","1.1","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-[2-(4-Formyl-2-methoxyphenoxy)ethoxy]-3-methoxybenzaldehyde","","- C18 H18 O6 -","- C18 H18 O6 -","- C108 H108 O36 -","6","1.5","KP6051","Diao, Chun-Hua; Guo, Min-Jie; Yu, Ming; Chen, Xin; Jing, Zuo-Liang; Deng, Qi-Liang","4-[2-(4-Formyl-2-methoxyphenoxy)ethoxy]-3-methoxybenzaldehyde","Acta Crystallographica Section E","2005","61","11","o3741","o3742","10.1107/S1600536805032861","","","0.71073","MoKα","","0.0944","0.0624","","","0.1587","0.1912","","","","","","1.078","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207276","26.2","0.005","14.719","0.003","9.5537","0.0019","90","","96.12","0.03","90","","3663.3","1.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","caesignost","pentaaquadisodium bis(triphenylcyanoborate)","","- C19 H20 B N Na O2.5 -","- C19 H20 B N Na O2.5 -","- C152 H160 B8 N8 Na8 O20 -","8","1","KP6054","Alexander Y. Nazarenko; Victor Nemykin","Pentaaquadisodium bis(triphenylcyanoborate) (caesignost)","Acta Crystallographica Section E","2005","61","11","m2317","m2319","10.1107/S1600536805032241","","","0.71073","MoKα","","0.0703","0.0478","","","0.1274","0.1403","","","","","","1.019","","","","has coordinates,has Fobs","197922","2020-10-21","18:00:00",""
"2207277","4.9175","0.0009","12.524","0.002","20.551","0.004","90","","90","","90","","1265.7","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-[(4-Bromophenylimino)methyl]-6-methoxyphenol","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C56 H48 Br4 N4 O8 -","4","1","KP6060","Zheng, Chun-Sheng; Yang, Nan; Li, Mei; Jing, Zuo-Liang","2-[(4-Bromophenyl)iminomethyl]-6-methoxyphenol","Acta Crystallographica Section E","2005","61","11","o3613","o3614","10.1107/S1600536805031144","","","0.71073","MoKα","","0.0326","0.0278","","","0.0678","0.0698","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207278","12.032","0.0007","17.077","0.0008","17.259","0.0011","90","","103.04","0.005","90","","3454.8","0.3","291","1","293","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetra-μ-benzoato-κ^8^O:O'-bis[(dimethyl sulfoxide-κO)copper(II)]","","- C32 H32 Cu2 O10 S2 -","- C32 H32 Cu2 O10 S2 -","- C128 H128 Cu8 O40 S8 -","4","1","KP6062","Nenad Judas̆","New polymorph of tetra-μ-benzoato-κ^8^O:O'-bis[(dimethyl sulfoxide-κO)copper(II)]","Acta Crystallographica, Section E","2005","61","11","m2217","m2219","10.1107/S1600536805031302","","","0.71073","MoKα","","","0.0459","","","","0.1336","","","","","","1.026","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2207279","9.588","0.002","7.8313","0.0017","13.721","0.003","90","","91.311","0.004","90","","1030","0.4","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-[6-(4-Formyl-2-methoxyphenoxy)hexyloxy]-3-methoxybenzaldehyde","","- C22 H26 O6 -","- C22 H26 O6 -","- C44 H52 O12 -","2","0.5","KP6063","Diao, Chun-Hua; Guo, Min-Jie; Yu, Ming; Chen, Xin; Jing, Zuo-Liang","4-[6-(4-Formyl-2-methoxyphenoxy)hexyloxy]-3-methoxybenzaldehyde","Acta Crystallographica Section E","2005","61","11","o3670","o3671","10.1107/S1600536805032253","","","0.71073","MoKα","","0.0925","0.0501","","","0.1445","0.1784","","","","","","1.011","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207280","4.8573","0.0009","8.5362","0.0016","25.368","0.005","90","","95.336","0.003","90","","1047.3","0.3","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-Ethoxy-4-[4-(4-formyl-2-ethoxyphenoxy)butoxy]benzaldehyde","","- C22 H26 O6 -","- C22 H26 O6 -","- C44 H52 O12 -","2","0.5","KP6065","Han, Jian-Rong; Zhen, Xiao-Li","3-Ethoxy-4-[4-(2-ethoxy-4-formylphenoxy)butoxy]benzaldehyde","Acta Crystallographica Section E","2005","61","11","o3844","o3845","10.1107/S1600536805034045","","","0.71073","MoKα","","0.0612","0.0415","","","0.1067","0.1175","","","","","","1.057","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207281","10.133","0.0002","10.369","0.0002","22.404","0.0006","76.969","0.0013","88.381","0.0014","88.366","0.0015","2291.84","0.09","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Bis[(5RS,11RS)-2,8-dimethyl-5,10-methano-5,6,11,12- tetrahydrodibenzo[b,f][1,5]diazocine-5-ium dihydrogen phosphate] tris(phosphoric acid) methanol solvate","","- C35 H55 N4 O21 P5 -","- C35 H55 N4 O21 P5 -","- C70 H110 N8 O42 P10 -","2","1","KP6067","Matulková, Irena; Teubner, Karel; Němec, Ivan; Rohovec, Jan; Mička, Zdeněk","Bis[(5<i>RS</i>,11<i>RS</i>)-2,8-dimethyl-5,10-methano-5,6,11,12-tetrahydrodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine-5-ium dihydrogen phosphate] tris(phosphoric acid) methanol solvate","Acta Crystallographica Section E","2005","61","11","o3941","o3943","10.1107/S1600536805034781","","","0.71073","MoKα","","0.1022","0.0495","","","","0.1297","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207282","16.5325","0.0008","16.0283","0.0011","7.8717","0.0004","90","","94.896","0.004","90","","2078.3","0.2","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-carboxylato-5-hydroxy-4-(4-methoxybenzoyl)-3-(4-methoxyphenyl)-1,1-dimethyl- 4,5-dihydro-1H-pyrazol-1-ium monohydrate","","- C21 H24 N2 O7 -","- C21 H24 N2 O7 -","- C84 H96 N8 O28 -","4","1","LH6478","Demir, Sibel; Dinçer, Muharrem; Yıldırım, İsmail; Kayademir, Aslıhan","5-Carboxylato-5-hydroxy-4-(4-methoxybenzoyl)-3-(4-methoxyphenyl)-1,1-dimethyl-4,5-dihydro-1<i>H</i>-pyrazol-1-ium monohydrate","Acta Crystallographica Section E","2005","61","11","o3540","o3542","10.1107/S1600536805031053","","","0.71073","MoKα","","0.074","0.047","","","0.1203","0.1303","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207283","8.474","0.001","13.451","0.0015","10.159","0.003","90","","109.09","0.017","90","","1094.3","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethyl 1,4-dihydro-1,2,4,5-tetrazine-3,6-dicarboxylate","","- C8 H12 N4 O4 -","- C8 H12 N4 O4 -","- C32 H48 N16 O16 -","4","1","LH6491","Guo-Wu Rao; Wei-Xiao Hu","Diethyl 1,4-dihydro-1,2,4,5-tetrazine-3,6-dicarboxylate","Acta Crystallographica Section E","2005","61","11","o3664","o3665","10.1107/S1600536805030485","","","0.71073","MoKα","","0.098","0.0496","","","0.1389","0.1692","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207284","25.118","0.005","7.3522","0.0009","10.083","0.0017","90","","101.664","0.011","90","","1823.6","0.5","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,6-Dihydrobenzo[h]quinazoline","","- C12 H10 N2 -","- C12 H10 N2 -","- C96 H80 N16 -","8","2","LH6497","Ingebrigtsen, Truls; Lejon, Tore; Hansen, Lars Kr.","5,6-Dihydrobenzo[<i>h</i>]quinazoline","Acta Crystallographica Section E","2005","61","11","o3659","o3660","10.1107/S160053680503206X","","","0.71069","MoKα","","0.126","0.0701","","","0.2184","0.2453","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207285","7.8728","0.0005","14.1856","0.0002","14.8321","0.0004","63.729","0.008","88.073","0.01","81.464","0.01","1467.95","0.15","295.15","","295.15","","","","","","","","","6","P -1","-P 1","2","","Tetraaquabis(4,4-bipyridine)copper(II) diperchlorate bipyridine tetrasolvate","","- C60 H56 Cl2 Cu N12 O12 -","- C60 H56 Cl2 Cu N12 O12 -","- C60 H56 Cl2 Cu N12 O12 -","1","0.5","LH6498","Huan-Li Dong; Li Xu; Qing-Yan Liu; Rui-Li Sang","Tetraaquabis(4,4-bipyridine)copper(II) bis(perchlorate) bipyridine tetrasolvate","Acta Crystallographica Section E","2005","61","11","m2340","m2342","10.1107/S1600536805032873","","","0.71073","MoKα","","0.0525","0.0425","","","0.1041","0.1112","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207286","7.879","0.002","8.825","0.002","14.927","0.003","99.94","0.03","101.43","0.03","109.04","0.03","929.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,6-Dimethyl-2-[4-(4-nitrophenyl)piperazin-1- ylmethyl]isothiazolo[5,4-b]pyridin-3(2H)-one","","- C19 H21 N5 O3 S -","- C19 H21 N5 O3 S -","- C38 H42 N10 O6 S2 -","2","1","LH6501","Karczmarzyk Zbigniew; Malinka Wiesław","4,6-Dimethyl-2-[4-(4-nitrophenyl)piperazin-1-ylmethyl]isothiazolo[5,4-<i>b</i>]pyridin-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","11","o3559","o3561","10.1107/S160053680503117X","","","1.54178","CuKα","","0.0433","0.0419","","","0.132","0.1345","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207287","28.983","0.002","6.0809","0.0005","16.559","0.001","90","","95.397","0.002","90","","2905.5","0.4","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1H-Indole-3-carbaldehyde 2-nitrophenylhydrazone hemihydrate","","- C16 H13 N4 O3.5 -","- C16 H13 N4 O3.5 -","- C128 H104 N32 O28 -","8","1","LH6504","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng","1<i>H</i>-Indole-3-carbaldehyde 2-nitrobenzoylhydrazone hemihydrate","Acta Crystallographica Section E","2005","61","11","o3651","o3652","10.1107/S1600536805030266","","","0.71073","MoKα","","0.113","0.051","","","0.135","0.174","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207288","9.912","0.008","15.954","0.013","16.685","0.013","90","","94.655","0.011","90","","2630","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(3,5-dicarboxybenzoato-κ^2^O,O')(1,10-phenanthroline)cobalt(II)","","- C30 H18 Co N2 O12 -","- C30 H18 Co N2 O12 -","- C120 H72 Co4 N8 O48 -","4","0.5","LH6510","Han, Jin-Yu; Wei, Wen-Ying; Dou, Xiao; Chang, He-Ying","Bis(3,5-dicarboxybenzoato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline)cobalt(II)","Acta Crystallographica Section E","2005","61","11","m2281","m2282","10.1107/S1600536805032058","","","0.71073","MoKα","","0.059","0.0373","","","0.0978","0.1083","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207289","6.4389","0.0009","9.5462","0.0013","11.0415","0.0015","94.803","0.002","103.666","0.002","96.213","0.002","651.39","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,5-Di-4-pyridyl-1,3,4-oxadiazle‒succinic acid (2/1)","","- C28 H22 N8 O6 -","- C28 H22 N8 O6 -","- C28 H22 N8 O6 -","1","0.5","LH6512","Yong-Tao Wang; Gui-Mei Tang; Da-Wei Qin","2,5-Di-4-pyridyl-1,3,4-oxadiazole‒succinic acid (2/1)","Acta Crystallographica Section E","2005","61","11","o3623","o3624","10.1107/S1600536805031764","","","0.71073","MoKα","","0.0412","0.0374","","","0.1036","0.1079","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207290","6.7913","0.0011","11.7863","0.0018","13.799","0.002","75.463","0.002","81.619","0.003","77.108","0.003","1037.5","0.3","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","N'-tert-Butyl-4-chloro-N'-(4-oxo-4H-chromen-3-ylcarbonyl)benzohydrazide 0.65-hydrate","","- C21 H20.3 Cl N2 O4.65 -","- C21 H20.3 Cl N2 O4.65 -","- C42 H40.6 Cl2 N4 O9.3 -","2","1","LH6513","Pei-Liang Zhao; Wei Huang; Zhong-Zhen Zhou; Guang-Fu Yang","<i>N</i>'-<i>tert</i>-Butyl-4-chloro-<i>N</i>'-(4-oxo-4<i>H</i>-chromen-3-ylcarbonyl)benzohydrazide 0.65-hydrate","Acta Crystallographica Section E","2005","61","11","o3738","o3740","10.1107/S1600536805033118","","","0.71073","MoKα","","0.0647","0.0554","","","0.1699","0.1816","","","","","","1.06","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2207291","16.777","0.004","7.4464","0.0015","23.192","0.005","90","","90","","90","","2897.3","1.1","296","1","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1-[2-(4-Carboxyphenoxy)ethyl]piperidinium chloride","","- C14 H20 Cl N O3 -","- C14 H20 Cl N O3 -","- C112 H160 Cl8 N8 O24 -","8","1","LH6514","Yong-Jiang Wang; Wen Pei","1-[2-(4-Carboxyphenoxy)ethyl]piperidinium chloride","Acta Crystallographica Section E","2005","61","11","o3813","o3814","10.1107/S1600536805033520","","","0.71075","MoKα","","","0.0323","","","","0.0727","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207292","6.236","0.002","13.263","0.004","8.667","0.003","90","","110.74","0.005","90","","670.4","0.4","294","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","","N-(1-Cyano-1-methylbutyl)-1,2,3-benzothiadiazole-7-carboxamide","","- C13 H14 N4 O S -","- C13 H14 N4 O S -","- C26 H28 N8 O2 S2 -","2","1","LH6515","Ying-Wei Ai; Feng-Li Liu; Zhi-Jin Fan; Hai-Bin Song; Kai-Sheng Nie","<i>N</i>-(1-Cyano-1-methylbutyl)-1,2,3-benzothiadiazole-7-carboxamide","Acta Crystallographica Section E","2005","61","11","o3891","o3892","10.1107/S1600536805034379","","","0.71073","MoKα","","0.0487","0.0403","","","0.1001","0.1066","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207293","8.1297","0.0005","19.2452","0.0015","7.4113","0.0004","90","","115.321","0.004","90","","1048.15","0.12","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-bis(3-nitrobenzylidene)octane-1,8-diamine","","- C22 H26 N4 O4 -","- C22 H26 N4 O4 -","- C44 H52 N8 O8 -","2","0.5","LH6516","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","Sheets of π-stacked centrosymmetric molecules in <i>N</i>,<i>N</i>'-bis(3-nitrobenzylidene)octane-1,8-diamine","Acta Crystallographica Section E","2005","61","11","o3551","o3553","10.1107/S1600536805031065","","","0.71073","MoKα","","0.1339","0.0575","","","0.1279","0.1582","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207294","11.481","0.002","9.2619","0.0019","15.723","0.003","90","","90","","90","","1671.9","0.6","193","2","193","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(3-Iodophenyl)[2-(3-iodophenylimino)-1-methylpropylidene]amine","","- C16 H14 I2 N2 -","- C16 H14 I2 N2 -","- C64 H56 I8 N8 -","4","0.5","LH6517","Cho, Hyeon Mo; Moore, Jeffrey S.; Wilson, Scott R.","(3-Iodophenyl)[2-(3-iodophenylimino)-1-methylpropylidene]amine","Acta Crystallographica Section E","2005","61","11","o3767","o3768","10.1107/S1600536805033052","","","0.71073","MoKα","","0.0451","0.0261","","","0.0628","0.068","","","","","","0.992","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207295","10.576","0.002","11.049","0.002","12.907","0.003","90","","90","","90","","1508.2","0.5","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N,N-Dicyclohexyl-2-iodoacetamide","","- C14 H24 I N O -","- C14 H24 I N O -","- C56 H96 I4 N4 O4 -","4","1","LH6518","Cho, Hyeon Mo; Moore, Jeffrey S.; Wilson, Scott R.","<i>N</i>,<i>N</i>-Dicyclohexyl-2-iodoacetamide","Acta Crystallographica Section E","2005","61","11","o3769","o3770","10.1107/S1600536805033064","","","0.71073","MoKα","","0.0299","0.0227","","","0.0473","0.0492","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207296","10.5351","0.0003","11.4008","0.0003","11.8287","0.0004","80.458","0.002","78.076","0.002","89.318","0.002","1370.47","0.07","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","{1-Methyl-2-[3-(trimethylsilylethynyl)phenylimino]propylidene}[3- (trimethylsilylethynyl)phenyl]amine","","- C26 H32 N2 Si2 -","- C26 H32 N2 Si2 -","- C52 H64 N4 Si4 -","2","1","LH6519","Cho, Hyeon Mo; Moore, Jeffrey S.; Wilson, Scott R.","{1-Methyl-2-[3-(trimethylsilylethynyl)phenylimino]propylidene}[3-(trimethylsilylethynyl)phenyl]amine","Acta Crystallographica Section E","2005","61","11","o3771","o3772","10.1107/S1600536805033088","","","0.71073","MoKα","","0.0733","0.0555","","","0.1506","0.1659","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207297","16.262","0.004","4.7074","0.0011","18.708","0.004","90","","98.829","0.004","90","","1415.2","0.6","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N'-Bis(3-iodophenyl)ethylenediimine","","- C14 H10 I2 N2 -","- C14 H10 I2 N2 -","- C56 H40 I8 N8 -","4","0.5","LH6520","Cho, Hyeon Mo; Moore, Jeffrey S.; Wilson, Scott R.","<i>N</i>,<i>N</i>'-Bis(3-iodophenyl)ethylenediimine","Acta Crystallographica Section E","2005","61","11","o3773","o3774","10.1107/S1600536805033076","","","0.71073","MoKα","","0.0242","0.0212","","","0.0546","0.056","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207298","3.8142","0.0002","23.6852","0.0008","12.5319","0.0005","90","","97.216","0.0016","90","","1123.17","0.08","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(E)-3-(4-Chlorophenyl)-2-(2-thienyl)acrylonitrile","","- C13 H8 Cl N S -","- C13 H8 Cl N S -","- C52 H32 Cl4 N4 S4 -","4","1","LH6521","Cobo, Debora; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","(<i>E</i>)-3-(4-Chlorophenyl)-2-(2-thienyl)acrylonitrile: chains built from C—H···N hydrogen bonds","Acta Crystallographica Section E","2005","61","11","o3639","o3641","10.1107/S1600536805031752","","","0.71073","MoKα","","0.0514","0.0394","","","0.0885","0.094","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207299","15.665","0.005","5.47","0.002","17.147","0.007","90","","108.233","0.009","90","","1395.5","0.9","105","2","105","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-alanyl-L-2-aminobutyric acid","2-(L-alanylamino)-L-butyric acid","","- C7 H14 N2 O3 -","- C7 H14 N2 O3 -","- C42 H84 N12 O18 -","6","3","LH6522","Görbitz, Carl Henrik","2-(<small>L</small>-Alanylamino)-<small>L</small>-butyric acid","Acta Crystallographica Section E","2005","61","11","o3735","o3737","10.1107/S1600536805032630","","","0.71073","MoKα","","0.1407","0.066","","","0.1219","0.1452","","","","","","1.089","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207300","9.9942","0.0009","10.3822","0.0009","15.8183","0.0014","90","","90","","90","","1641.3","0.3","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,2,3,4-Tetra-O-acetyl-α-L-fucopyranose","","- C14 H20 O9 -","- C14 H20 O9 -","- C56 H80 O36 -","4","1","LH6523","Alhassan, Abdul-Basit; Norris, Peter; Zeller, Matthias","1,2,3,4-Tetra-<i>O</i>-acetyl-α-<small>L</small>-fucopyranose","Acta Crystallographica Section E","2005","61","11","o3668","o3669","10.1107/S1600536805032228","","","0.71073","MoKα","","0.034","0.0332","","","0.0848","0.0853","","","","","","1.05","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207301","98.48","0.02","4.9381","0.0003","7.1826","0.0008","90","","92.57","0.012","90","","3489.4","0.8","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Elaidic acid","trans-9-octadecenoic acid","","- C18 H34 O2 -","- C18 H34 O2 -","- C144 H272 O16 -","8","1","LH6524","Low, John Nicolson; Scrimgeour, Charlie; Horton, Peter","Elaidic acid (<i>trans</i>-9-octadecenoic acid)","Acta Crystallographica Section E","2005","61","11","o3730","o3732","10.1107/S1600536805033040","","","0.71073","MoKα","","0.2316","0.1024","","","0.2108","0.2558","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207302","10.0335","0.001","11.8829","0.0012","14.396","0.0015","77.925","0.001","74.887","0.001","79.37","0.001","1604.9","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(1,10-phenanthroline)(3-sulfonatobenzoato)cadmium(II) tetrahydrate","","- C31 H30 Cd N4 O10 S -","- C31 H30 Cd N4 O10 S -","- C62 H60 Cd2 N8 O20 S2 -","2","1","LH6525","Chen, Jian-Mei; Zhu, Long-Guan; Cai, Guo-Qiang","Aquabis(1,10-phenanthroline)(3-sulfonatobenzoato)cadmium(II) tetrahydrate","Acta Crystallographica Section E","2005","61","11","m2324","m2326","10.1107/S1600536805033106","","","0.71073","MoKα","","0.042","0.037","","","0.087","0.089","","","","","","1.061","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207303","9.6052","0.0007","12.8416","0.001","9.0921","0.0007","90","","114.388","0.002","90","","1021.41","0.14","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-3-(4-nitrophenylaminocarbonyl)propen-2-oic acid","","- C10 H8 N2 O5 -","- C10 H8 N2 O5 -","- C40 H32 N8 O20 -","4","1","LH6526","Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher","A hydrogen-bonded chain of rings in (<i>E</i>)-3-(4-nitrophenylaminocarbonyl)prop-2-enoic acid","Acta Crystallographica Section E","2005","61","11","o3849","o3851","10.1107/S160053680503374X","","","0.71073","MoKα","","0.1095","0.0464","","","0.1014","0.1164","","","","","","0.871","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207304","16.978","0.006","7.355","0.003","18.812","0.007","90","","108.867","0.005","90","","2222.9","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Triaqua(pyridine-2,5-dicarboxylato-κ^2^N,O^2^)[4,4,5,5-tetramethyl- 2-(4-pyridyl)imidazoline-1-oxyl-κN^2^]zinc(II)","","- C19 H25 N4 O8 Zn -","- C19 H25 N4 O8 Zn -","- C76 H100 N16 O32 Zn4 -","4","1","LH6529","Dong-Zhao Gao; Zong-Hui Jiang; Dai-Zheng Liao","Triaqua(pyridine-2,5-dicarboxylato-κ^2^<i>N</i>,<i>O</i>^2^)[4,4,5,5-tetramethyl-2-(4-pyridyl)imidazoline-1-oxyl-κ<i>N</i>^2^]zinc(II)","Acta Crystallographica Section E","2005","61","11","m2446","m2448","10.1107/S1600536805034835","","","0.71073","MoKα","","0.0376","0.0283","","","0.0735","0.0771","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207305","7.5216","0.0005","8.3323","0.0005","12.2228","0.0007","88.287","0.001","89.114","0.001","68.041","0.001","710.13","0.08","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Diaquadibenzimidazolebis(5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidine- 1-acetato)cadmium(II)","","- C26 H24 Cd F2 N8 O10 -","- C26 H24 Cd F2 N8 O10 -","- C26 H24 Cd F2 N8 O10 -","1","0.5","LH6530","Mao-Lin Hu; Xiao-Qing Cai; Zhi-Min Jin","Diaquadibenzimidazolebis(5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-1-acetato)cadmium(II)","Acta Crystallographica Section E","2005","61","11","m2411","m2413","10.1107/S1600536805034380","","","0.71073","MoKα","","0.0255","0.0251","","","0.0669","0.0673","","","","","","1.203","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207306","6.1236","0.0009","13.816","0.0018","21.026","0.003","90","","90","","90","","1778.9","0.4","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","8-acetyl-7-hydroxy-3-isopropenyl-10-methylperhydrophenanthren-1-one","","- C20 H30 O3 -","- C20 H30 O3 -","- C80 H120 O12 -","4","1","LH6535","Kooijman, Huub; Sarabèr, Florence C. E.; Groot, Aede de; Spek, Anthony L.","(3<i>R</i>,5<i>S</i>,6<i>S</i>,8<i>R</i>,10<i>S</i>)-8-Acetyl-7-hydroxy-3-isopropenyl-10-methylperhydrophenanthren-1-one","Acta Crystallographica Section E","2005","61","11","o3921","o3922","10.1107/S1600536805034586","","","0.71073","MoKα","","0.0974","0.0463","","","0.0852","0.0988","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207307","19.628","0.0004","13.1216","0.0003","15.2962","0.0004","90","","109.641","0.0014","90","","3710.34","0.15","295","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dimethyl 3-(benzylamino)-2-(4-fluorophenyl)furan-4,5-dicarboxylate","","- C21 H18 F N O5 -","- C21 H18 F N O5 -","- C168 H144 F8 N8 O40 -","8","1","NC6046","Cheng Ma; Yewei Yang","Dimethyl 3-(benzylamino)-2-(4-fluorophenyl)furan-4,5-dicarboxylate","Acta Crystallographica Section E","2005","61","11","o3548","o3550","10.1107/S1600536805031077","","","0.71069","MoKα","","","0.0394","","","","0.1215","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207308","12.652","0.0009","12.876","0.0009","14.2907","0.0011","85.069","0.006","83.287","0.006","61.629","0.005","2033.2","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","μ-1,2-Ethanediylbis(diphenylphosphine)-κ^2^P:P'-bis{acetato[1,2- ethanediylbis(diphenylphosphine)-κ^2^P,P']copper(I)} diethyl ether disolvate","","- C90 H98 Cu2 O6 P6 -","- C90 H98 Cu2 O6 P6 -","- C90 H98 Cu2 O6 P6 -","1","0.5","NC6048","Morawitz, Thorsten; Lerner, Hans-Wolfram; Bru Roig, Miriam; Bolte, Michael","μ-1,2-Ethanediylbis(diphenylphosphine)-κ^2^<i>P</i>:<i>P</i>'-bis{acetato[1,2-ethanediylbis(diphenylphosphine)-κ^2^<i>P</i>,<i>P</i>']copper(I)} diethyl ether disolvate","Acta Crystallographica Section E","2005","61","11","m2201","m2203","10.1107/S1600536805031089","","","0.71073","MoKα","","0.1244","0.1186","","","0.2879","0.2911","","","","","","1.133","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207309","10.858","0.002","11.803","0.002","15.378","0.003","97.688","0.003","104.337","0.004","104.019","0.004","1812.8","0.6","193","2","193","2","","","","","","","","5","P -1","-P 1","2","N,N-isopropyl-2,4-pentanediiminato tert-butylcyclopentadienyl ytterbium chloride","(η^5^-tert-Butylcyclopentadienyl)chloro[N,N-(2,6-diisopropylphenyl)pentane-2,4- diiminato]ytterbium(III)","","- C38 H54 Cl N2 Yb -","- C38 H54 Cl N2 Yb -","- C76 H108 Cl2 N4 Yb2 -","2","1","NG6203","Zhang, Yong; Yao, Ying-Ming; Shen, Qi","(η^5^-<i>tert</i>-Butylcyclopentadienyl)chloro[<i>N</i>,<i>N</i>-(2,6-diisopropylphenyl)pentane-2,4-diiminato]ytterbium(III)","Acta Crystallographica Section E","2005","61","11","m2251","m2253","10.1107/S1600536805030965","","","0.7107","MoKα","","0.0268","0.0247","","","0.0575","0.0588","","","","","","1.091","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207310","9.587","0.005","12.569","0.007","13.95","0.007","90","","105.311","0.006","90","","1621.3","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-{[N-Methyl-N-(4-methylphenyl)amino]methyl}ferrocene","","- C19 H21 Fe N -","- C19 H21 Fe N -","- C76 H84 Fe4 N4 -","4","1","NG6206","Hong-Xing Wang; Ying-Jie Li; Hong-Fei Wu; Hui-Chao Zhou; Feng-Ying Geng; Ren-Qing Gao","1-{[<i>N</i>-Methyl-<i>N</i>-(4-methylphenyl)amino]methyl}ferrocene","Acta Crystallographica Section E","2005","61","11","m2322","m2323","10.1107/S1600536805032794","","","0.71073","MoKα","","0.0334","0.028","","","0.0778","0.0807","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207311","7.7274","0.0009","8.0856","0.001","12.1577","0.0015","84.323","0.002","77.986","0.002","69.051","0.001","693.62","0.15","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Poly[2-aminopyridinium [aquacuprate(II)-μ~4~-5-sulfonatosalicylato]]","","- C12 H12 Cu N2 O7 S -","- C12 H12 Cu N2 O7 S -","- C24 H24 Cu2 N4 O14 S2 -","2","1","NG6210","Fan, Sai-Rong; Zhu, Long-Guan","Poly[2-aminopyridinium [aquacuprate(II)-μ~4~-5-sulfonatosalicylato]]","Acta Crystallographica Section E","2005","61","11","m2187","m2189","10.1107/S1600536805030977","","","0.71073","MoKα","","0.037","0.034","","","0.076","0.078","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207312","8.6047","0.0009","10.5469","0.0011","11.7021","0.0013","79.123","0.001","84.585","0.001","67.5","0.001","963.25","0.18","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Diaqua(1,10-phenanthroline)(3-sulfonatobenzoato)copper(II) monohydrate","","- C19 H18 Cu N2 O8 S -","- C19 H18 Cu N2 O8 S -","- C38 H36 Cu2 N4 O16 S2 -","2","1","NG6211","Cai, Lei; Zhu, Long-Guan","Diaqua(1,10-phenanthroline)(3-sulfonatobenzoato)copper(II) monohydrate","Acta Crystallographica Section E","2005","61","11","m2184","m2186","10.1107/S1600536805030989","","","0.71073","MoKα","","0.038","0.033","","","0.086","0.09","","","","","","0.924","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2207313","11.32","0.002","10.122","0.002","17.69","0.004","90","","108.28","0.03","90","","1924.6","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-poly[[[bis(1H-imidazole)zinc(II)]-μ-3-carboxylatophenoxyacetato] trihydrate]","","- C15 H20 N4 O8 Zn -","- C15 H20 N4 O8 Zn -","- C60 H80 N16 O32 Zn4 -","4","1","NG6219","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Zhao, Jing-Gui","A one-dimensional helical chain polymer: <i>catena</i>-poly[[[bis(1<i>H</i>-imidazole)zinc(II)]-μ-3-carboxylatophenoxyacetato] trihydrate]","Acta Crystallographica Section E","2005","61","11","m2286","m2288","10.1107/S1600536805032204","","","0.71073","MoKα","","0.0523","0.0412","","","0.1036","0.1096","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207314","13.5492","0.0002","8.2515","0.0001","19.2229","0.0003","90","","96.521","0.001","90","","2135.24","0.05","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-(2-Benzoylpyridine-κ^2^N,O)dichloro[2-(pyridine-2-carbonyl)phenyl- κ^2^C^1^,N]rhodium(III)","","- C24 H17 Cl2 N2 O2 Rh -","- C24 H17 Cl2 N2 O2 Rh -","- C96 H68 Cl8 N8 O8 Rh4 -","4","1","NG6227","Mei Ching Tseng; Shao Pin Wang; Yu Cheng Yu; Shi Yuan Sheu; Wen Liang Huang","<i>trans</i>-(2-Benzoylpyridine-κ^2^<i>N</i>,<i>O</i>)dichloro[2-(pyridine-2-carbonyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]rhodium(III)","Acta Crystallographica Section E","2005","61","11","m2452","m2453","10.1107/S1600536805034926","","","0.71073","MoKα","","0.038","0.0304","","","0.078","0.09","","","","","","1.128","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207315","7.1447","0.0011","8.2159","0.0012","10.5031","0.0019","79.558","0.01","81.561","0.013","83.701","0.012","597.56","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","butane-1,4-diammonium tetrathiomolybdate(VI)","butane-1,4-diammonium tetrathiomolybdate(VI)","","- C4 H14 Mo N2 S4 -","- C4 H14 Mo N2 S4 -","- C8 H28 Mo2 N4 S8 -","2","1","NG6228","Srinivasan, Bikshandarkoil R.; Näther, Christian; Bensch, Wolfgang","Butane-1,4-diammonium tetrathiomolybdate(VI)","Acta Crystallographica Section E","2005","61","11","m2454","m2456","10.1107/S1600536805034938","","","0.71073","MoKα","","0.0414","0.0265","","","0.07","0.0736","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207316","17.492","0.003","9.805","0.002","9.634","0.002","90","","90","","90","","1652.3","0.6","298","2","298","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","4-(4-Chlorophenyl)-1,7,7-trimethyl-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione","","- C18 H20 Cl N O2 -","- C18 H20 Cl N O2 -","- C72 H80 Cl4 N4 O8 -","4","1","OB6488","Shujiang Tu; Xiaotong Zhu; Jinpeng Zhang; Jianing Xu; Qian Wang","4-(4-Chlorophenyl)-1,7,7-trimethyl-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione","Acta Crystallographica Section E","2005","61","11","o3536","o3537","10.1107/S1600536805008573","","","0.71073","MoKα","","0.0992","0.0591","","","0.1491","0.1785","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207317","12.1055","0.0014","12.1055","0.0014","26.939","0.005","90","","90","","120","","3418.8","0.8","173.1","","","","","","","","","","","5","P 65","P 65","170","","tert-Butoxycarbonyl-L-leucyl-L-alanine trichloroethyl ester","","- C16 H27 Cl3 N2 O5 -","- C16 H27 Cl3 N2 O5 -","- C96 H162 Cl18 N12 O30 -","6","1","OB6564","Oku, Hiroyuki; Endo, Teruya; Yamada, Keiichi; Katakai, Ryoichi","<i>tert</i>-Butoxycarbonyl-<small>L</small>-leucyl-<small>L</small>-alanine trichloroethyl ester (Boc-<small>L</small>-Leu-<small>L</small>-Ala-OTce)","Acta Crystallographica Section E","2005","61","11","o3864","o3866","10.1107/S160053680502636X","","","1.5418","CuKα","","","0.0428","","","","0.0789","","","","","","1.057","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207318","11.311","0.009","11.693","0.007","19.417","0.012","90","","90","","90","","2568","3","173.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-tert-Butoxycarbonyl-O-benzyl-L-threonyl-L-proline trichloroethyl ester","","- C23 H31 Cl3 N2 O6 -","- C23 H31 Cl3 N2 O6 -","- C92 H124 Cl12 N8 O24 -","4","1","OB6568","Oku, Hiroyuki; Kuriyama, Keisuke; Omi, Kazuto; Yamada, Keiichi; Katakai, Ryoichi","<i>O</i>-Benzyl-<i>N</i>-<i>tert</i>-butoxycarbonyl-<small>L</small>-threonyl-<small>L</small>-proline trichloroethyl ester [Boc-<small>L</small>-Thr(Bzl)-<small>L</small>-Pro-OTce]","Acta Crystallographica Section E","2005","61","11","o3867","o3869","10.1107/S1600536805026383","","","1.5418","CuKα","","","0.0628","","","","0.1449","","","","","","0.968","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207319","32.673","0.004","11.7393","0.0016","23.932","0.003","90","","90","","90","","9179","2","93.1","","","","","","","","","","","5","C m c 21","C 2c -2","36","","Diaquabis(3,5-di-tert-butyl-2-hydroxybenzoato-κO^1^) zinc(II) dimethylacetamide trisolvate","","- C42 H73 N3 O11 Zn -","- C42 H70 N3 O11 Zn -","- C336 H560 N24 O88 Zn8 -","8","1","OB6576","Makino, Takashi; Mizuguchi, Jin","Diaquabis(3,5-di-<i>tert</i>-butyl-2-hydroxybenzoato-κ<i>O</i>^1^)zinc(II) dimethylacetamide trisolvate","Acta Crystallographica Section E","2005","61","11","m2220","m2222","10.1107/S1600536805029119","","","1.54187","CuKα","","0.0627","0.0537","","","0.1449","0.1488","","","","","","0.955","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207320","9.7191","0.0014","6.9405","0.0008","35.456","0.004","90","","94.635","0.011","90","","2383.9","0.5","93.1","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Triaquabis(3,5-di-<i>tert</i>-butyl-2-hydroxybenzoato-κ<i>O</i>^1^)zinc(II) dimethylacetamide trisolvate","","- C42 H75 N3 O12 Zn -","- C42 H67 N3 O12 Zn -","- C84 H134 N6 O24 Zn2 -","2","0.5","OB6583","Makino, Takashi; Mizuguchi, Jin","Triaquabis(3,5-di-<i>tert</i>-butyl-2-hydroxybenzoato-κ<i>O</i>^1^)zinc(II) dimethylacetamide trisolvate","Acta Crystallographica Section E","2005","61","11","m2223","m2225","10.1107/S1600536805029156","","","1.54187","CuKα","","","0.0953","","","","0.2726","","","","","","1.005","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207321","5.341","0.002","9.887","0.001","11.754","0.003","85.212","0.009","85.47","0.01","88.939","0.006","616.5","0.3","296.1","","","","","","","","","","","7","P -1","-P 1","2","","Methyl 5-chloro-2-(trifluoromethylsulfonamido)benzoate","","- C9 H7 Cl F3 N O4 S -","- C9 H7 Cl F3 N O4 S -","- C18 H14 Cl2 F6 N2 O8 S2 -","2","1","OB6590","Kimura, Masaharu; Hourai, Shinji","Methyl 5-chloro-2-{[(trifluoromethyl)sulfonyl]amino}benzoate","Acta Crystallographica Section E","2005","61","11","o3944","o3945","10.1107/S1600536805034902","","","1.5418","CuKα","","","0.105","","","","0.284","","","","","","1.062","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207322","7.9763","0.0014","13.666","0.003","26.241","0.005","93.706","0.003","98.37","0.003","105.294","0.003","2713.7","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis[4-(n-octyloxy)phenyl]diazene oxide","","- C28 H42 N2 O3 -","- C28 H42 N2 O3 -","- C112 H168 N8 O12 -","4","2","OB6591","Das, Purak; Neogi, Debatra Narayan; Upreti, Shailesh; Mandal, Pradip Kumar; Bandyopadhyay, Pinaki","Bis[4-(<i>n</i>-octyloxy)phenyl]diazene oxide","Acta Crystallographica Section E","2005","61","11","o3602","o3604","10.1107/S1600536805031363","","","0.71073","MoKα","","0.1104","0.0709","","","0.1757","0.2003","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207323","37.3866","0.0004","13.9391","0.0002","15.3229","0.0002","90","","105.906","0.001","90","","7679.57","0.17","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","(acetonitrile)[4-(4-bromophenyl)-2,6-di-2-pyridyl-1,3,5-triazine](1,3-di-2- pyridyl-2,3-dihydro-1H-imidazolyl)ruthenium(II) bis(hexafluorophosphate","","- C35 H26.5 Br F12 N10.5 P2 Ru -","- C35 H26.5 Br F12 N10.5 P2 Ru -","- C280 H212 Br8 F96 N84 P16 Ru8 -","8","1","OM6263","Medlycott, Elaine A.; Schaper, Frank; Hanan, Garry S.","A hybrid bidentate and tridentate ruthenium(II) complex incorporating triazine and polypyridine carbene ligands","Acta Crystallographica Section E","2005","61","11","m2311","m2313","10.1107/S1600536805032216","","","1.54178","CuKα","","0.0332","0.0331","","","0.0877","0.0878","","","","","","1","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2207324","30.821","0.006","14.136","0.003","15.571","0.003","90","","90","","90","","6784","2","150","2","150","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","(2,2'-Bipyridyl)dicarbonylbis(triethoxyphosphine-κP)rhenium(I) hexafluorophosphate","","- C24 H38 F6 N2 O8 P3 Re -","- C24 H38 F6 N2 O8 P3 Re -","- C192 H304 F48 N16 O64 P24 Re8 -","8","2","OM6264","Blake, Alexander J.; George, Michael W.; Kuimova, Marina K.; Williams, Colleen A.; Wilson, Claire","(2,2'-Bipyridyl)dicarbonylbis(triethoxyphosphine-κ<i>P</i>)rhenium(I) hexafluorophosphate","Acta Crystallographica Section E","2005","61","11","m2196","m2197","10.1107/S1600536805030643","","","0.71073","MoKα","","0.0387","0.0329","","","0.0711","0.0735","","","","","","1.15","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207325","13.0386","0.0007","9.0976","0.0005","11.695","0.0007","90","","112.329","0.002","90","","1283.24","0.13","473","2","473","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{2,6-Bis[(dimethylamino)methyl]phenyl-κ^2^N,C^1^,N'}chloronickel(II)","","- C12 H19 Cl N2 Ni -","- C12 H19 Cl N2 Ni -","- C48 H76 Cl4 N8 Ni4 -","4","1","OM6265","Castonguay, Annie; Charbonneau, Fabien; Beauchamp, André L.; Zargarian, Davit","{2,6-Bis[(dimethylamino)methyl]phenyl-κ^2^<i>N</i>,<i>C</i>^1^,<i>N</i>'}chloronickel(II)","Acta Crystallographica Section E","2005","61","11","m2240","m2241","10.1107/S1600536805031624","","","1.54178","CuKα","","0.0346","0.0337","","","0.0914","0.0925","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207326","7.5714","0.0015","10.696","0.002","13.047","0.003","81.98","0.03","85.04","0.03","78.4","0.03","1023","0.4","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","[hydrogen N-(phosphonomethyl)iminodiacetato](1,10-phenanthroline)copper(II) trihydrate","","- C17 H22 Cu N3 O10 P -","- C17 H22 Cu N3 O10 P -","- C34 H44 Cu2 N6 O20 P2 -","2","1","RN6059","Almeida Paz, Filipe A.; Shi, Fa-Nian; Trindade, Tito; Klinowski, Jacek; Rocha, João","[Hydrogen <i>N</i>-(phosphonomethyl)iminodiacetato](1,10-phenanthroline)copper(II) trihydrate: a low-temperature redetermination","Acta Crystallographica Section E","2005","61","11","m2247","m2250","10.1107/S1600536805031806","","","0.71073","MoKα","","0.0481","0.0376","","","0.0836","0.0894","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207327","7.2976","0.0011","24.999","0.002","9.2074","0.0014","90","","104.272","0.013","90","","1627.9","0.4","291","0.3","291","0.3","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(Achexim-S,N,N')-chloro-platinium(II)","[2-Acetylpyridine 1,1-(hexane-1,6-diyl)thiosemicarbazone-κ^3^N,N',S]chloroplatinum(II)","","- C14 H19 Cl N4 Pt S -","- C14 H19 Cl N4 Pt S -","- C56 H76 Cl4 N16 Pt4 S4 -","4","1","RN6064","Kruszynski, Rafal; Bartczak, Tadeusz J.","[2-Acetylpyridine 1,1-(hexane-1,6-diyl)thiosemicarbazone-κ^3^<i>N</i>,<i>N</i>',<i>S</i>]chloroplatinum(II)","Acta Crystallographica Section E","2005","61","11","m2376","m2378","10.1107/S1600536805033398","","","0.71073","MoKα","","0.0563","0.047","","","0.0822","0.0857","","","","","","1.213","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207328","11.2407","0.0018","5.0994","0.0008","13.412","0.002","90","","103.499","0.003","90","","747.5","0.2","292","2","292","2","","","","","","","","7","P 1 21 1","P 2yb","4","","[R-(R*,S*)]-2,2-Dichloro-N-[1-(fluoromethyl)-2-hydroxy-2-[4- (methylsulfonyl)phenyl]ethylacetamide","","- C12 H13 Cl2 F N O4 S -","- C12 H13 Cl2 F N O4 S -","- C24 H26 Cl4 F2 N2 O8 S2 -","2","1","RN6067","Jing Cheng; Neng-Xue Wang; Guang-Fu Yang","2,2-Dichloro-<i>N</i>-{[1-(fluoromethyl)-2-hydroxy-2-[4-(methylsulfonyl)phenyl]ethyl}acetamide","Acta Crystallographica Section E","2005","61","11","o3628","o3629","10.1107/S1600536805031831","","","0.71073","MoKα","","0.067","0.0531","","","0.1336","0.1549","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2207329","13.045","0.003","16.394","0.003","12.233","0.002","90","","110.85","0.03","90","","2444.8","1","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-furan-2-selenolato-bis[(furan-2-selenolato)(triphenylphosphine)palladium]","","- C52 H42 O4 P2 Pd2 Se4 -","- C52 H42 O4 P2 Pd2 Se4 -","- C104 H84 O8 P4 Pd4 Se8 -","2","0.5","RZ6122","Wagner, Andreas; Hannu-Kuure, Milja S.; Oilunkaniemi, Raija; Laitinen, Risto S.","Di-μ-furan-2-selenolato-bis[(furan-2-selenolato)(triphenylphosphine)palladium(II)]","Acta Crystallographica Section E","2005","61","11","m2198","m2200","10.1107/S1600536805031247","","","0.71073","MoKα","","0.0538","0.0416","","","0.0945","0.1018","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207330","11.446","0.002","12.166","0.002","12.584","0.002","92.881","0.003","112.681","0.003","99.595","0.003","1581.5","0.5","97","2","97","2","","","","","","","","5","P -1","-P 1","2","","2-Methyl-N,N'-bis[2-(methylsulfanyl)ethyl]-2-(2-pyridyl)-N,N'-ditosylpropane- 1,3-diamine","","- C29 H39 N3 O4 S4 -","- C29 H39 N3 O4 S4 -","- C58 H78 N6 O8 S8 -","2","1","RZ6124","Michels, Janel T.; O'Malley, Briana G.; Klein, Eric L.; Yang, Lei; Grohmann, Andreas; Houser, Robert P.","2-Methyl-<i>N</i>,<i>N</i>'-bis[2-(methylsulfanyl)ethyl]-2-(2-pyridyl)-<i>N</i>,<i>N</i>'-ditosylpropane-1,3-diamine","Acta Crystallographica Section E","2005","61","11","o3834","o3836","10.1107/S1600536805033726","","","0.71073","MoKα","","0.0453","0.0437","","","0.1204","0.1219","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207331","8.6537","0.0018","8.8624","0.0018","10.474","0.002","81.713","0.003","74.134","0.003","84.719","0.003","763.4","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","N-Phenyl-N'-(1,3-thiazol-2-yl)-1,2,3-benzothiadiazole-7-carboxamidine","","- C16 H11 N5 S2 -","- C16 H11 N5 S2 -","- C32 H22 N10 S4 -","2","1","RZ6126","Li-Li Bao; Zhi-Jin Fan; Hai-Bin Song; Nie Kaisheng","<i>N</i>-Phenyl-<i>N</i>'-(1,3-thiazol-2-yl)-1,2,3-benzothiadiazole-7-carboxamidine","Acta Crystallographica Section E","2005","61","11","o3817","o3818","10.1107/S1600536805033210","","","0.71073","MoKα","","0.05","0.0358","","","0.0918","0.1033","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207332","16.699","0.004","14.981","0.005","15.205","0.003","90","","115.74","0.03","90","","3426.4","1.8","293","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorobis[2-chloro-5-(chloromethyl)pyridine]copper(II)","","- C24 H20 Cl12 Cu2 N4 -","- C24 H20 Cl12 Cu2 N4 -","- C96 H80 Cl48 Cu8 N16 -","4","0.5","RZ6127","Fangfang Jian; Lan Zhang; Hailian Xiao; Liyun Zhang","Dichlorobis[2-chloro-5-(chloromethyl)pyridine]copper(II)","Acta Crystallographica Section E","2005","61","11","m2388","m2389","10.1107/S1600536805033660","","","0.71073","MoKα","","0.0711","0.0527","","","0.154","0.1688","","","","","","1.047","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207333","8.082","0.003","5.0983","0.0016","16.034","0.005","90","","98.424","0.005","90","","653.5","0.4","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-N-(1-Benzyl-2-hydroxyethyl)benzamide","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C32 H34 N2 O4 -","2","1","RZ6129","Cai, Yi-Min; Fang, Hua; Jin, Yi; Zeng, Qing-Le; Zhao, Yu-Fen","(<i>S</i>)-<i>N</i>-(1-Benzyl-2-hydroxyethyl)benzamide","Acta Crystallographica Section E","2005","61","11","o3912","o3913","10.1107/S160053680503477X","","","0.71073","MoKα","","0.0356","0.0343","","","0.0878","0.0889","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207334","16.654","0.003","10.646","0.002","7.2599","0.0014","90","","90","","90","","1287.2","0.4","295","2","295","2","","","","","","","","5","P c a 21","P 2c -2ac","29","An analogue of Iminostilbene or Carbamazepine","5-Chlorocarbonyl-10,11-dihydro-5H-dibenz[b,f]azepine","","- C15 H12 Cl N O -","- C15 H12 Cl N O -","- C60 H48 Cl4 N4 O4 -","4","1","SG6033","Vijay, T.; Anilkumar, H. G.; Yathirajan, H. S.; Narasimhamurthy, T.; Rathore, R. S.","5-Chlorocarbonyl-10,11-dihydro-5<i>H</i>-dibenz[<i>b</i>,<i>f</i>]azepine","Acta Crystallographica Section E","2005","61","11","o3718","o3720","10.1107/S1600536805030746","","","0.71073","MoKα","","0.0887","0.0629","","","0.1105","0.1191","","","","","","1.125","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207335","12.5718","0.0006","19.5538","0.001","13.3217","0.0007","90","","110.547","0.001","90","","3066.5","0.3","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","rhodium cod thiolate dimer","Bis[μ-2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzenethiolato]bis[(η^4^-3,5- cyclooctadiene)rhodium(I)]","","- C30 H24 F14 Rh2 S2 -","- C30 H24 F14 Rh2 S2 -","- C120 H96 F56 Rh8 S8 -","4","1","SG6034","Jones, William D.; Garcia, Juventino; Torrens, Hugo","Bis[μ-2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzenethiolato]bis[(η^4^-3,5-cyclooctadiene)rhodium(I)]","Acta Crystallographica Section E","2005","61","11","m2204","m2206","10.1107/S1600536805031235","","","0.71073","MoKα","","0.0263","0.022","","","0.0505","0.0519","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207336","29.14","0.006","7.646","0.002","14.511","0.003","90","","102.19","0.03","90","","3160.2","1.3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","2-Chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene","","- C15 H11 Cl F3 N O4 -","- C15 H11 Cl F3 N O4 -","- C120 H88 Cl8 F24 N8 O32 -","8","1","SG6035","Gao, Shan; Ng, Seik Weng","2-Chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene","Acta Crystallographica Section E","2005","61","11","o3761","o3762","10.1107/S1600536805032757","","","0.71073","MoKα","","0.07","0.05","","","0.147","0.157","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207337","17.056","0.003","9.074","0.002","13.544","0.003","90","","101.88","0.03","90","","2051.3","0.8","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis-2,4-(2-chloro-4-trifluromethylphenoxy)-1-nitrobenzene","","- C20 H9 Cl2 F6 N O4 -","- C20 H9 Cl2 F6 N O4 -","- C80 H36 Cl8 F24 N4 O16 -","4","1","SG6036","Gao, Shan; Ng, Seik Weng","2,4-Bis[2-chloro-4-(trifluoromethyl)phenoxy]-1-nitrobenzene","Acta Crystallographica Section E","2005","61","11","o3763","o3764","10.1107/S1600536805032769","","","0.71073","MoKα","","0.068","0.051","","","0.153","0.164","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207338","7.0989","0.0014","7.9539","0.0016","12.162","0.002","90.79","0.03","105.76","0.03","99.65","0.03","650.3","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","tanshinone I","1,6-Dimethylphenanthro[1,2-b]furan-10,11-dione","","- C18 H12 O3 -","- C18 H12 O3 -","- C36 H24 O6 -","2","1","SJ6122","Zhang, Lei; Wang, Jing-Kang; Qu, Yi; Nie, Qiang","1,6-Dimethylphenanthro[1,2-<i>b</i>]furan-10,11-dione","Acta Crystallographica Section E","2005","61","11","o3582","o3583","10.1107/S1600536805031600","","","0.71073","MoKα","","0.0612","0.0455","","","0.1394","0.1568","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207339","10.485","0.0009","7.823","0.0004","16.297","0.0013","90","","116.949","0.002","90","","1191.59","0.15","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3-Chlorophenyl)(2-hydroxy-5-methylphenyl)methanone","","- C14 H11 Cl O2 -","- C14 H11 Cl O2 -","- C56 H44 Cl4 O8 -","4","1","SJ6131","Khanum, S. A.; Mahendra, M.; Shashikanth, S.; Doreswamy, B. H.; Sridhar, M. A.; Shashidhara Prasad, J.","(3-Chlorophenyl)(2-hydroxy-5-methylphenyl)methanone","Acta Crystallographica Section E","2005","61","11","o3615","o3617","10.1107/S1600536805031776","","","0.71073","MoKα","","0.0584","0.0494","","","0.133","0.1507","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207340","8.123","0.002","16.65","0.002","16.658","0.002","90","","95.35","0.02","90","","2243.1","0.7","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H36 Cl4 N6 Pt2 -","- C54 H36 Cl4 N6 Pt2 -","- C108 H72 Cl8 N12 Pt4 -","2","0.5","SJ6132","Okabe, Nobuo; Muranishi, Yasunori","(2,2'-Biquinoline-κ^2^<i>N</i>,<i>N</i>')dichloroplatinum(II)‒2,2'-biquinoline (2/1)","Acta Crystallographica Section E","2005","61","11","m2332","m2334","10.1107/S1600536805032745","","","0.7107","MoKα","","","0.0384","","","","0.097","","","","","","0.957","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207341","9.5694","0.0013","14.3386","0.0019","10.7533","0.0015","90","","109.07","0.002","90","","1394.5","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Diethanolbis[1-phenyl-3-methyl-4-acetyl-1H-pyrazol-5(4H)-onato- κ^2^O,O']cobalt(II)","","- C28 H34 Co N4 O6 -","- C28 H34 Co N4 O6 -","- C56 H68 Co2 N8 O12 -","2","0.5","SJ6133","Shi, Jing Min; Zhang, Feng Xia; Wu, Chang Ju; Liu, Lian Dong","<i>trans</i>-Bis[4-acetyl-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5(4<i>H</i>)-onato-κ^2^<i>O</i>,<i>O</i>']diethanolcobalt(II)","Acta Crystallographica Section E","2005","61","11","m2320","m2321","10.1107/S1600536805032678","","","0.71073","MoKα","","0.0413","0.0377","","","0.0959","0.0982","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207342","26.745","0.007","12.52","0.003","22.82","0.006","90","","118.454","0.004","90","","6718","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[14,25-dichloro-2,11-diphenyl-tetracyclo[20.4.0.0^4,9^.0^12,17^]hexacosa-2,10,12,14,16,22,24,26-octaene-19,20-dionato(2-)]nickel(II) dichloromethane sesquisolvate","","- C35.5 H29 Cl5 N4 Ni O2 -","- C35.5 H29 Cl5 N4 Ni O2 -","- C284 H232 Cl40 N32 Ni8 O16 -","8","1","SJ6134","Rui-Hong Zhang; Guang-Ming Yang","A new nickel(II) complex [Ni<i>L</i>]·1.5CH~2~Cl~2~, where H~2~<i>L</i> is 14,25-dichloro-2,11-diphenyl-tetracyclo[20.4.0.0^4,9^.0^12,17^]hexacosa- 2,10,12,14,16,22,24,26-octaene-19,20-dione","Acta Crystallographica Section E","2005","61","11","m2434","m2435","10.1107/S1600536805034628","","","0.71073","MoKα","","0.0777","0.0454","","","0.1082","0.1262","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207343","8.371","0.003","12.462","0.004","12.719","0.004","63.6","0.004","81.88","0.005","85.524","0.005","1176.4","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Trichloro[μ-2,2,N-tris(2-pyridylmethylamino)acetamido]dizinc(II)","","- C20 H20 Cl3 N5 O Zn2 -","- C20 H20 Cl3 N5 O Zn2 -","- C40 H40 Cl6 N10 O2 Zn4 -","2","1","SJ6135","Dong-Zhao Gao; Shou-Rong Zhu; Hua-Kuan Lin","Trichloro[μ-2,2,<i>N</i>-tris(2-pyridylmethylamino)acetamido]dizinc(II)","Acta Crystallographica Section E","2005","61","11","m2359","m2361","10.1107/S1600536805033349","","","0.71073","MoKα","","0.051","0.0325","","","0.0682","0.0757","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207344","9.0013","0.0013","10.5217","0.0015","17.152","0.003","90","","102.038","0.003","90","","1588.7","0.4","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 2-(5,7-dimethyl-1,2,4-triazolo[1,5-a]pyrimidin-2-yloxy)benzoate","","- C16 H16 N4 O3 -","- C16 H16 N4 O3 -","- C64 H64 N16 O12 -","4","1","SJ6136","Qiong Chen; Yuan-Xiang Li; Xiao-Wei Hu; Guang-Fu Yang","Ethyl 2-(5,7-dimethyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-2-yloxy)benzoate","Acta Crystallographica Section E","2005","61","11","o3842","o3843","10.1107/S1600536805033763","","","0.71073","MoKα","","0.0845","0.0508","","","0.1147","0.128","","","","","","0.914","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207345","15.9928","0.0007","13.4357","0.0006","10.7799","0.0004","90","","92.111","0.002","90","","2314.75","0.17","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(1,8-Dinitro-3,6,10,13,16,19-hexaazabicyclo[6.6.6]icosane)cobalt(III) tribromide","","- C14 H30 Br3 Co N8 O4 -","- C14 H30 Br3 Co N8 O4 -","- C56 H120 Br12 Co4 N32 O16 -","4","0.5","SJ6138","Mortensen, Louise K.; Bond, Andrew D.; McKenzie, Christine J.","(1,8-Dinitro-3,6,10,13,16,19-hexaazabicyclo[6.6.6]icosane)cobalt(III) tribromide","Acta Crystallographica Section E","2005","61","11","m2402","m2404","10.1107/S1600536805034094","","","0.71073","MoKα","","0.0356","0.0282","","","0.0699","0.0726","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207346","9.3246","0.0018","15.134","0.003","11.655","0.002","90","","107.787","0.003","90","","1566.1","0.5","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(4-Pyridylamino)pyridinium isophthalate","","- C18 H15 N3 O4 -","- C18 H15 N3 O4 -","- C72 H60 N12 O16 -","4","1","SJ6139","Amoore, Jarrod J. M.; Kepert, Cameron J.","4-(4-Pyridylamino)pyridinium isophthalate","Acta Crystallographica Section E","2005","61","11","o3937","o3938","10.1107/S160053680503463X","","","0.71073","MoKα","","0.0436","0.0367","","","0.0936","0.1006","","","","","","1.034","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207347","9.2094","0.0007","10.6365","0.0008","12.6853","0.001","109.775","0.001","111.109","0.001","91.252","0.002","1076.14","0.14","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(dimethylammonium) di-μ-pyrazole-3,5-dicarboxylato(3-)-bis[aquacopper(II)] monohydrate","","- C14 H24 Cu2 N6 O11 -","- C14 H24 Cu2 N6 O11 -","- C28 H48 Cu4 N12 O22 -","2","1","SJ6140","Xin-Hua Li","Bis(dimethylammonium) di-μ-pyrazole-3,5-dicarboxylato(3‒)-bis[aquacopper(II)] monohydrate","Acta Crystallographica Section E","2005","61","11","m2405","m2407","10.1107/S1600536805034410","","","0.71073","MoKα","","0.0511","0.0458","","","0.1054","0.109","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207348","11.0418","0.0017","8.0714","0.0012","41.313","0.007","90","","90","","90","","3681.9","1","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(E)-N'-(4-Benzyloxy-3-methoxybenzylidene)isonicotinohydrazide","","- C21 H19 N3 O3 -","- C21 H19 N3 O3 -","- C168 H152 N24 O24 -","8","1","SJ6142","Shi, Jun","(<i>E</i>)-<i>N</i>'-(4-Benzyloxy-3-methoxybenzylidene)isonicotinohydrazide","Acta Crystallographica Section E","2005","61","11","o3933","o3934","10.1107/S1600536805034872","","","0.71073","MoKα","","0.092","0.0469","","","0.1008","0.1183","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207349","11.516","0.003","15.44","0.004","7.977","0.002","90","","109.548","0.005","90","","1336.6","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-N'-(3-Hydroxy-4-methoxybenzylidene)isonicotinohydrazide","","- C14 H13 N3 O3 -","- C14 H13 N3 O3 -","- C56 H52 N12 O12 -","4","1","SJ6143","Shi Jun","(<i>E</i>)<i>-N</i>'-(3-Hydroxy-4-methoxybenzylidene)isonicotinohydrazide","Acta Crystallographica Section E","2005","61","11","o3935","o3936","10.1107/S1600536805034884","","","0.71073","MoKα","","0.1392","0.0442","","","0.0673","0.0846","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207350","17.932","0.004","7.4244","0.0015","15.067","0.003","90","","90","","90","","2005.9","0.7","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","catena-Poly[[triaquanickel(II)]-μ-5-hydroxyisophthalato]","","- C8 H10 Ni O8 -","- C8 H10 Ni O8 -","- C64 H80 Ni8 O64 -","8","1","SU6208","Sun, Xue-Hua","<i>catena</i>-Poly[[triaquanickel(II)]-μ-5-hydroxyisophthalato]","Acta Crystallographica Section E","2005","61","11","m2256","m2258","10.1107/S1600536805023962","","","0.71073","MoKα","","0.0354","0.0266","","","0.0682","0.0728","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207351","7.9421","0.0003","7.9421","","29.028","0.001","90","","90","","90","","1831","0.09","295","2","295","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","Validoxylamine hydrochloride dihydrate","(+)-(Z)-(1S,2S,3S,4R,1'S,2'S,3'S,4'R,5'R)-2,3,4-Trihydroxy-5-(hydroxymethyl)- N-[2',3',4'-trihydroxy-5'-(hydroxymethyl)cyclohex-1'-yl]cyclohex-5-en-1-aminium chloride dihydrate","","- C14 H30 Cl N O10 -","- C14 H30 Cl N O10 -","- C56 H120 Cl4 N4 O40 -","4","0.5","SU6225","Chang, Hong-Jie; Feng, Xiao-Long; Zhu, Jia-Rong; Ng, Seik Weng","(+)-(<i>Z</i>)-(1<i>S</i>,2<i>S</i>,3<i>S</i>,4<i>R</i>,1'<i>S</i>,2'<i>S</i>,3'<i>S</i>,4'<i>R</i>,5'<i>R</i>)-2,3,4-Trihydroxy-5-(hydroxymethyl)-<i>N</i>-[2',3',4'-trihydroxy-5'-(hydroxymethyl)cyclohex-1'-yl]cyclohex-5-en-1-aminium chloride dihydrate","Acta Crystallographica Section E","2005","61","11","o3839","o3841","10.1107/S1600536805033891","","","0.71073","MoKα","","0.0401","0.0379","","","0.092","0.0934","","","","","","1.095","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207352","7.439","0.001","11.215","0.001","16.541","0.001","90","","93.96","0.01","90","","1376.7","0.2","299","2","299","2","","","","","","","","4","P 1 c 1","P -2yc","7","","N-Benzyl-8-nitroquinolin-2-amine","","- C16 H13 N3 O2 -","- C16 H13 N3 O2 -","- C64 H52 N12 O8 -","4","2","SU6227","da Silva, Luiz Everson; Joussef, Antonio C.; Foro, Sabine; Schmidt, Boris","<i>N</i>-Benzyl-8-nitroquinolin-2-amine","Acta Crystallographica Section E","2005","61","11","o3837","o3838","10.1107/S1600536805033908","","","1.5418","CuKα","","0.053","0.0459","","","0.1132","0.1185","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207353","10.051","0.001","11.329","0.001","11.703","0.001","62.88","0.01","77.54","0.01","82.38","0.01","1157.2","0.2","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","4-tert-Butyl-2,6-bis[(imidazolium-1-yl)methyl]phenol tetrachlorozinc(II)","","- C18 H24 Cl4 N4 O Zn -","- C18 H24 Cl4 N4 O Zn -","- C36 H48 Cl8 N8 O2 Zn2 -","2","1","SU6232","Xu, Gang; Cui, Yu-Bo; Huang, Wei; Gou, Shao-Hua","4-<i>tert</i>-Butyl-2,6-bis[(imidazolium-1-yl)methyl]phenol tetrachlorozincate(II)","Acta Crystallographica Section E","2005","61","11","m2443","m2445","10.1107/S1600536805034963","","","0.71073","MoKα","","0.0835","0.0571","","","0.1073","0.1161","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207354","8.2343","0.0014","10.3445","0.0018","12.047","0.002","90","","96.884","0.003","90","","1018.8","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(Dibromomethyl)chromen-4-one","","- C10 H6 Br2 O2 -","- C10 H6 Br2 O2 -","- C40 H24 Br8 O8 -","4","1","SU6237","Huang, Wei; Zhao, Pei-Liang; Xie, Chang; Zhou, Zhong-Zhen; Yang, Guang-Fu","2-(Dibromomethyl)-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2005","61","11","o3948","o3949","10.1107/S1600536805035166","","","0.71073","MoKα","","0.0437","0.0348","","","0.1017","0.1057","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207355","29.938","0.0006","8.806","0.0002","19.6782","0.0004","90","","116.252","0.001","90","","4652.75","0.17","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[sesqui(μ~4~-biphenyl-4,4'-dicarboxylato- κ^4^O:O':O'':O''')(diethylformamide-κO)gadolinium]","","- C26 H23 Gd N O7 -","- C26 H23 Gd N O7 -","- C208 H184 Gd8 N8 O56 -","8","1","TK6263","Poulsen, Rasmus D.; Overgaard, Jacob; Chevallier, Marie-Agnes; Clausen, Henrik F.; Iversen, Bo B.","Poly[sesqui(μ~4~-biphenyl-4,4'-dicarboxylato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')(diethylformamide-κ<i>O</i>)gadolinium]","Acta Crystallographica Section E","2005","61","11","m2308","m2310","10.1107/S1600536805032162","","","0.71073","MoKα","","0.051","0.028","","","0.054","0.057","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207356","7.385","0.0003","9.7359","0.0003","13.7218","0.0005","69.347","0.002","87.209","0.002","67.945","0.002","851.63","0.06","123","2","123","2","","","","","","","","5","P -1","-P 1","2","(C6H3Cl2NO2)4.(C4H8N2)'","3,4-dichloro-1-nitrobenzene‒1,4-dioxane (4/1)","","- C7 H5 Cl2 N O2.5 -","- C7 H5 Cl2 N O2.5 -","- C28 H20 Cl8 N4 O10 -","4","2","TK6265","Sarah A. Barnett; Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","3,4-Dichloro-1-nitrobenzene‒1,4-dioxane (4/1)","Acta Crystallographica Section E","2005","61","11","o3666","o3667","10.1107/S1600536805030680","","","0.71073","MoKα","","0.05","0.033","","","0.073","0.081","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207357","7.224","0.002","19.712","0.006","12.177","0.005","90","","105.272","0.014","90","","1672.8","1","296","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-[4-(Dimethylamino)phenyl]-1-phenylsulfonylbut-3-en-2-one","","- C18 H19 N O3 S -","- C18 H19 N O3 S -","- C72 H76 N4 O12 S4 -","4","1","TK6266","Wen Pei; Yongjiang Wang; Li Sun; Xiaobo Xiong","4-[4-(Dimethylamino)phenyl]-1-(phenylsulfonyl)but-3-en-2-one","Acta Crystallographica Section E","2005","61","11","o3883","o3884","10.1107/S1600536805034422","","","0.71075","MoKα","","","0.051","","","","0.104","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207358","11.96","0.002","10.456","0.002","13.039","0.003","90","","105.09","0.03","90","","1574.4","0.6","288","2","288","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methyl-2-(trimethylsilyloxy)-3,4-dihydro-2H,5H-pyrano[3,2-c][1]benzopyran- 5-one","","- C16 H20 O4 Si -","- C16 H20 O4 Si -","- C64 H80 O16 Si4 -","4","1","TK6268","Da-Quan Peng; Yun Liu; Zhi-Feng Lu; Jian-Hua Xu","2-Methyl-2-(trimethylsilyloxy)-3,4-dihydro-2<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>][1]benzopyran-5-one","Acta Crystallographica Section E","2005","61","11","o3704","o3705","10.1107/S1600536805032186","","","0.71073","MoKα","","0.098","0.053","","","0.139","0.152","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207359","5.3976","0.0006","6.7062","0.0008","12.1098","0.0014","90","","102.807","0.002","90","","427.44","0.09","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","5-fluorouracil‒2,2,2-trifluoroethanol (1/1)","","- C6 H6 F4 N2 O3 -","- C6 H6 F4 N2 O3 -","- C12 H12 F8 N4 O6 -","2","1","TK6270","Hulme, Ashley T.; Tocher, Derek A.","5-Fluorouracil‒2,2,2-trifluoroethanol (1/1)","Acta Crystallographica Section E","2005","61","11","o3661","o3663","10.1107/S1600536805032198","","","0.71073","MoKα","","0.028","0.028","","","0.073","0.074","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207360","5.0135","0.0006","20.636","0.002","6.966","0.001","90","","99.28","0.01","90","","711.26","0.15","299","2","299","2","","","","","","","","5","P 1 21 1","P 2yb","4","","4-Nitro-N-(8-quinolyl)benzenesulfonamide","","- C15 H11 N3 O4 S -","- C15 H11 N3 O4 S -","- C30 H22 N6 O8 S2 -","2","1","TK6271","da Silva, Luiz Everson; Joussef, Antonio Carlos; Foro, Sabine; Schmidt, Boris","4-Nitro-<i>N</i>-(8-quinolyl)benzenesulfonamide","Acta Crystallographica Section E","2005","61","11","o3778","o3779","10.1107/S1600536805032691","","","1.5418","CuKα","","0.055","0.055","","","0.148","0.15","","","","","","1.14","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207361","8.921","0.001","14.303","0.002","18.888","0.003","78","0.01","77.77","0.01","78.25","0.01","2271.6","0.6","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","2,4,6-Triisopropyl-N-(8-quinolyl)benzenesulfonamide","","- C24 H30 N2 O2 S -","- C24 H30 N2 O2 S -","- C96 H120 N8 O8 S4 -","4","2","TK6272","da Silva, Luiz Everson; Joussef, Antonio Carlos; Foro, Sabine; Schmidt, Boris","2,4,6-Triisopropyl-<i>N</i>-(8-quinolyl)benzenesulfonamide","Acta Crystallographica Section E","2005","61","11","o3780","o3781","10.1107/S1600536805032708","","","1.5418","CuKα","","0.149","0.062","","","0.15","0.184","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207362","18.636","0.001","4.9871","0.0007","17.914","0.001","90","","110.628","0.007","90","","1558.2","0.3","299","2","299","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","N-(5,7-Dibromo-8-quinolyl)-4-fluorobenzenesulfonamide","","- C15 H9 Br2 F N2 O2 S -","- C15 H9 Br2 F N2 O2 S -","- C60 H36 Br8 F4 N8 O8 S4 -","4","1","TK6273","da Silva, Luiz Everson; Joussef, Antonio Carlos; Foro, Sabine; Schmidt, Boris","<i>N</i>-(5,7-Dibromo-8-quinolyl)-4-fluorobenzenesulfonamide","Acta Crystallographica Section E","2005","61","11","o3782","o3783","10.1107/S160053680503271X","","","1.5418","CuKα","","0.08","0.055","","","0.165","0.182","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207363","14.1687","0.0019","13.6246","0.0016","14.024","0.002","90","","106.865","0.011","90","","2590.8","0.6","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(N-methylpyridinium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)zincate(II)","","- C18 H16 N2 S10 Zn -","- C18 H16 N2 S10 Zn -","- C72 H64 N8 S40 Zn4 -","4","1","TK6274","Wang, Yan-Ling; Yu, Wen-Tao; Xu, Dong; Wang, Xin-Qiang; Guo, Wen-Feng; Zhang, Guang-Hui","Bis(<i>N</i>-methylpyridinium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)zincate(II)","Acta Crystallographica Section E","2005","61","11","m2408","m2410","10.1107/S1600536805034434","","","0.71073","MoKα","","0.102","0.053","","","0.117","0.138","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207364","6.8978","0.0014","9.953","0.002","14.556","0.003","96.495","0.004","97.418","0.003","109.863","0.003","918.7","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2,3-Bis(1-methyl-1H-imidazol-2-ylsulfanylmethyl)quinoxaline","","- C18 H18 N6 S2 -","- C18 H18 N6 S2 -","- C36 H36 N12 S4 -","2","1","TK6275","Ning-Ning Pan; Wei Wang; Bing Zhao","2,3-Bis(1-methyl-1<i>H</i>-imidazol-2-ylsulfanylmethyl)quinoxaline","Acta Crystallographica Section E","2005","61","11","o3939","o3940","10.1107/S1600536805033404","","","0.71073","MoKα","","0.062","0.04","","","0.107","0.122","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207365","9.267","0.003","9.824","0.003","20.477","0.006","90","","102.144","0.004","90","","1822.5","1","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 N O S Sn -","- C18 H19 N O S Sn -","- C72 H76 N4 O4 S4 Sn4 -","4","1","TK6279","Ji-Kun Li; Ru-Fen Zhang; Chun-Lin Ma","4,5-Diphenyl-2-(trimethylstannylsulfanyl)-1,3-oxazole","Acta Crystallographica Section E","2005","61","11","m2457","m2458","10.1107/S1600536805035002","","","0.71073","MoKα","","0.042","0.032","","","0.086","0.097","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207366","12.885","0.008","7.012","0.004","17.109","0.01","90","","90.204","0.008","90","","1545.8","1.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[(3-Hydroxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one","","- C18 H17 N3 O2 -","- C18 H17 N3 O2 -","- C72 H68 N12 O8 -","4","1","WK6060","Jing, Zuo-Liang; Fan, Zhi; Yu, Ming; Chen, Xin; Diao, Chun-Hua; Deng, Qi-Liang","4-[(3-Hydroxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","11","o3532","o3533","10.1107/S1600536805030990","","","0.71073","MoKα","","0.066","0.0489","","","0.1206","0.1288","","","","","","1.047","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207367","7.393","0.002","8.983","0.003","12.823","0.004","77.51","0.004","82.756","0.003","79.45","0.003","814.1","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","4-[(4-Hydroxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one monohydrate","","- C18 H19 N3 O3 -","- C18 H19 N3 O3 -","- C36 H38 N6 O6 -","2","1","WK6061","Jing, Zuo-Liang; Fan, Zhi; Yu, Ming; Chen, Xin; Deng, Qi-Liang","4-[(4-Hydroxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one monohydrate","Acta Crystallographica Section E","2005","61","11","o3534","o3535","10.1107/S1600536805031004","","","0.71073","MoKα","","0.0447","0.038","","","0.0976","0.1033","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207368","19.4419","0.0003","19.4419","0.0003","6.5498","0.0001","90","","90","","120","","2144.06","0.06","120","2","120","2","","","","","","","","5","P 63/m","-P 6c","176","","8-Methyl-5-oxo-5,6-dihydrodipyrido[1,2-a:3',2'-e]pyrimidin-11-ium chloride trihydrate","","- C12 H16 Cl N3 O4 -","- C12 H16 Cl N3 O4 -","- C72 H96 Cl6 N18 O24 -","6","0.5","WK6062","Howie, R. Alan; de Lima Ferreira, Marcelle de; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M.S.V.; Wardell, James L.","8-Methyl-5-oxo-5,6-dihydrodipyrido[1,2-<i>a</i>:3',2'-<i>e</i>]pyrimidin-11-ium chloride trihydrate 120 K","Acta Crystallographica Section E","2005","61","11","o3579","o3581","10.1107/S1600536805031521","","","0.71073","MoKα","","0.0365","0.0319","","","0.0872","0.0904","","","","","","1.148","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2207369","6.8814","0.0013","11.627","0.002","20.468","0.004","90","","90","","90","","1637.6","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(4-Methoxyphenyl)-2-(quinolin-8-yloxy)acetamide monohydrate","","- C18 H18 N2 O4 -","- C18 H18 N2 O4 -","- C72 H72 N8 O16 -","4","1","WK6063","Yong-Hong Wen; Mao-Jie Li; Shu-Sheng Zhang; Xue-Mei Li","<i>N</i>-(4-Methoxyphenyl)-2-(quinolin-8-yloxy)acetamide monohydrate","Acta Crystallographica Section E","2005","61","11","o3630","o3631","10.1107/S1600536805031557","","","0.71073","MoKα","","0.0363","0.0324","","","0.081","0.0835","","","","","","1.122","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207370","10.4365","0.0014","9.0713","0.0012","14.1861","0.0018","90","","94.107","0.003","90","","1339.6","0.3","273","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-Ethyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole","","- C15 H14 N4 -","- C15 H14 N4 -","- C60 H56 N16 -","4","1","WK6064","Chunyi Liu; Zuoxiang Wang; Anyu Zhou; Lutong Yuan; Yan Lan","3-Ethyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole","Acta Crystallographica Section E","2005","61","11","o3925","o3926","10.1107/S1600536805034173","","","0.71073","MoKα","","0.0937","0.0569","","","0.1156","0.1222","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207371","19.2347","0.0016","13.2563","0.0011","16.7559","0.0015","90","","123.909","0.001","90","","3545.8","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[hexaaquatris(μ~3~-3-carboxypyrazole-5-carboxylato)(3-carboxypyrazole- 5-carboxylato-κO)(μ~2~-pyrazole-3,5-dicarboxylato)dicerium]","","- C25 H26 Ce2 N10 O26 -","- C25 H26 Ce2 N10 O26 -","- C100 H104 Ce8 N40 O104 -","4","0.5","WK6065","Xin-Hua Li","Poly[hexaaquatris(μ~3~-3-carboxypyrazole-5-carboxylato)(3-carboxypyrazole-5-carboxylato-κ<i>O</i>)(μ~2~-pyrazole-3,5-dicarboxylato)dicerium(III)]","Acta Crystallographica Section E","2005","61","11","m2329","m2331","10.1107/S1600536805032824","","","0.71073","MoKα","","0.0336","0.029","","","0.0583","0.0602","","","","","","1.052","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207372","13.147","0.005","10.088","0.005","17.549","0.005","90","","90","","90","","2327.5","1.6","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis(1,10-phenanthroline)dithiocyanatozinc(II)","","- C26 H16 N6 S2 Zn -","- C26 H16 N6 S2 Zn -","- C104 H64 N24 S8 Zn4 -","4","0.5","WK6066","Ying-Ying Liu; Jian-Fang Ma; Jin Yang","Bis(1,10-phenanthroline)dithiocyanatozinc(II)","Acta Crystallographica Section E","2005","61","11","m2367","m2368","10.1107/S1600536805033714","","","0.71069","MoKα","","0.0835","0.038","","","0.0925","0.1004","","","","","","0.92","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207373","8.3","0.002","8.3","0.002","22.469","0.005","90","","90","","120","","1340.5","0.5","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","lithium sodium potassium dichromate tris(phosphate)","Li~2.5~Na~0.34~K~0.16~Cr~2~(PO~4~)~3~","","- Cr2 K0.16 Li2.5 Na0.34 O12 P3 -","- Cr2 K0.155 Li2.499 Na0.345 O12 P3 -","- Cr12 K0.93 Li14.994 Na2.07 O72 P18 -","6","0.333333","WM6082","Kouass, Salah; Boughzala, Habib","NASICON-type Li~2.5~K~0.16~Na~0.34~Cr~2~(PO~4~)~3~","Acta Crystallographica Section E","2005","61","11","i231","i233","10.1107/S1600536805022269","","","0.71073","MoKα","","0.0311","0.0247","","","0.0698","0.0716","","","","","","1.127","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207374","14.528","0.003","14.528","0.003","9.685","0.004","90","","90","","120","","1770.3","0.9","293","2","293","2","","","","","","","","4","R 3 :H","R 3","146","","Tetracesium strontium catena-nonaselenidotristannate(IV)","","- Cs4 Se9 Sn3 Sr -","- Cs4 Se9 Sn3 Sr -","- Cs12 Se27 Sn9 Sr3 -","3","0.333333","WM6093","Tobias van Almsick; William S. Sheldrick","Tetracaesium strontium <i>catena</i>-nonaselenidotristannate(IV)","Acta Crystallographica Section E","2005","61","11","i225","i227","10.1107/S1600536805031090","","","0.71073","MoKα","","0.0367","0.0363","","","0.1012","0.1015","","","","","","1.148","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207375","4.9512","0.0005","4.9512","0.0005","8.7874","0.0013","90","","90","","120","","186.56","0.04","165","0.1","165","0.1","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","Trisodium phosphide","","- Na3 P -","- Na3 P -","- Na6 P2 -","2","0.0833333","WM6094","Yongkwan Dong; Francis J. DiSalvo","Reinvestigation of Na~3~P based on single-crystal data","Acta Crystallographica Section E","2005","61","11","i223","i224","10.1107/S1600536805031168","","","0.71073","MoKα","","0.0603","0.0386","","","0.0786","0.084","","","","","","1.133","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207376","12.2646","0.0004","7.3926","0.0004","12.6354","0.0006","90","","111.095","0.003","90","","1068.84","0.09","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dicesium sulfate-selenate tellurate","","- Cs2 H6 O10 S0.57 Se0.43 Te -","- Cs2 O10 S0.566 Se0.434 Te -","- Cs8 O40 S2.264 Se1.736 Te4 -","4","1","WM6095","Abdelhedi, Mohamed; Dammak, Mohamed; Cousson, Alain; Nierlich, Martine; Abdelwaheb, Kolsi","Cs~2~(SO~4~)~0.57~(SeO~4~)~0.43~·Te(OH)~6~, an adduct between dicaesium sulfate selenate and telluric acid","Acta Crystallographica Section E","2005","61","11","i256","i258","10.1107/S1600536805034574","","","0.71073","MoKα","","0.0377","0.0371","","0.0349","0.0349","0.0349","","","","","","0.9374","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207377","4.7282","0.0001","8.932","0.0002","8.4309","0.0002","90","","90","","90","","356.06","0.01","295","","295","","","","","","","","","4","P b n m","-P 2c 2ab","62","Topaz-OD","Dialuminium orthosilicate dihydroxide","","- Al2 D2 O6 Si -","- Al2 D2 O6 Si -","- Al8 D8 O24 Si4 -","4","0.5","WM6096","Chen, Jianrong; Lager, George A.; Kunz, Martin; Hansen, Thomas C.; Ulmer, Peter","A Rietveld refinement using neutron powder diffraction data of a fully deuterated topaz, Al~2~SiO~4~(OD)~2~","Acta Crystallographica, Section E","2005","61","11","i253","i255","10.1107/S1600536805034811","","neutron","1.37404","neutron","","","","","","","","","","1.32","","","","","","","has coordinates","287555","2023-11-12","10:38:26",""
"2207378","10.4415","0.0008","10.4415","0.0008","8.0464","0.0007","90","","90","","120","","759.73","0.11","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","tetrasamarium(II) oxide hexaiodide","tetrasamarium hexaiodine oxygen","","- I6 O Sm4 -","- I6 O Sm4 -","- I12 O2 Sm8 -","2","0.166667","WM6099","Hammerich, Stefanie; Pantenburg, Ingo; Meyer, Gerd","Tetrasamarium(II) oxide hexaiodide, Sm~4~OI~6~","Acta Crystallographica Section E","2005","61","11","i234","i236","10.1107/S1600536805031934","","","0.71073","MoKα","","0.0447","0.0422","","","0.0977","0.1042","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207379","5.7434","0.0007","12.6002","0.0009","5.7405","0.0007","90","","90","","90","","415.43","0.08","293","2","293","2","","","","","","","","3","C c c a :2","-C 2a 2ac","68","calcium chlorite","calcium chlorate(III)","","- Ca Cl2 O4 -","- Ca Cl2 O4 -","- Ca4 Cl8 O16 -","4","0.25","WM6100","Smolentsev, Anton I.; Naumov, Dmitry Yu.","Calcium chlorite, Ca(ClO~2~)~2~, from X-ray powder diffraction data","Acta Crystallographica Section E","2005","61","11","i246","i248","10.1107/S160053680503415X","","","1.54178","CuKα","","","","","","","","","","1.81","","","","","","","has coordinates","208235","2020-10-21","18:00:00",""
"2207380","5.9799","0.0012","12.7519","0.0016","5.9787","0.0012","90","","90","","90","","455.91","0.14","293","2","293","2","","","","","","","","3","C c c a :2","-C 2a 2ac","68","strontium chlorite","strontium chlorate(III)","","- Cl2 O4 Sr -","- Cl2 O4 Sr -","- Cl8 O16 Sr4 -","4","0.25","WM6101","Smolentsev, Anton I.; Naumov, Dmitry Yu.","Strontium chlorite, Sr(ClO~2~)~2~, from X-ray powder diffraction data","Acta Crystallographica Section E","2005","61","11","i249","i250","10.1107/S1600536805034161","","","1.54178","CuKα","","","","","","","","","","3.03","","","","","","","has coordinates","208235","2020-10-21","18:00:00",""
"2207381","15.156","0.002","5.4692","0.0008","6.5516","0.0013","90","","102.487","0.014","90","","530.22","0.15","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Cadmium bis(hypophosphite)","Cadmium bis[dihydrogenphosphate(I)]","","- Cd H4 O4 P2 -","- Cd H4 O4 P2 -","- Cd4 H16 O16 P8 -","4","0.5","WM6102","Naumov, Dmitry Yu.; Naumova, Marina I.; Kuratieva, Natalia V.","Cadmium bis[dihydrogenphosphate(I)]","Acta Crystallographica Section E","2005","61","11","i251","i252","10.1107/S1600536805034562","","","0.71073","MoKα","","0.0367","0.0316","","","0.0914","0.1014","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207382","10.409","0.002","19.064","0.004","14.895","0.003","90","","94.39","0.03","90","","2947.1","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Hexacaesium nonaselenidotetraantimonate(III) hemihydrate","","- Cs6 H O0.5 Sb4 Se9 -","- Cs6 O0.5 Sb4 Se9 -","- Cs24 O2 Sb16 Se36 -","4","0.5","WM6103","Tobias van Almsick; William S. Sheldrick","Hexacaesium nonaselenidotetraantimonate(III) hemihydrate","Acta Crystallographica Section E","2005","61","11","i240","i242","10.1107/S1600536805033799","","","0.71073","MoKα","","0.1108","0.0667","","","0.1258","0.1348","","","","","","1.184","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207383","10.14","0.0008","14.2835","0.0009","10.4195","0.0007","90","","97.48","0.006","90","","1496.26","0.18","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-thiocytosinium bromide","4-amino-2-thioxo-2,3-dihydropyrimidin-1-ium bromide","","- C4 H6 Br N3 S -","- C4 H6 Br N3 S -","- C32 H48 Br8 N24 S8 -","8","2","WM6104","Sanković, Krešimir; Prugovečki, Biserka; Matković-Čalogović, Dubravka","2-Thiocytosinium bromide","Acta Crystallographica Section E","2005","61","11","o3846","o3848","10.1107/S1600536805033659","","","0.71073","MoKα","","0.0481","0.0318","","","0.0744","0.0821","","","","","","1.106","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207384","13.6103","0.0005","12.5787","0.0006","21.6102","0.0008","90","","94.479","0.003","90","","3688.4","0.3","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(1SR,2SR,3SR,10SR,12RS,13RS,14RS,17SR)-13-Hydroxy-11- oxapentacyclo[8.7.0.0^2,14^.0^4,9^.0^12,17^]heptadeca-4,6,8-trien-3-yl 4-chlorobenzoate","","- C23 H21 Cl O4 -","- C23 H21 Cl O4 -","- C184 H168 Cl8 O32 -","8","1","WN6373","Ustabaş, Reşat; Çoruh, Ufuk; Menzek, Abdullah; Altundaş, Aliye; Yavuz, Metin; Hökelek, Tuncer","(1<i>SR</i>,2<i>SR</i>,3<i>SR</i>,10<i>SR</i>,12<i>RS</i>,13<i>RS</i>,14<i>RS</i>,17<i>SR</i>)-13-Hydroxy-11-oxapentacyclo[8.7.0.0^2,14^.0^4,9^.0^12,17^]heptadeca-4,6,8-trien-3-yl 4-chlorobenzoate","Acta Crystallographica Section E","2005","61","11","o3859","o3861","10.1107/S1600536805030825","","","0.71073","MoKα","","0.0499","0.0439","","","0.1462","0.1569","","","","","","0.714","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207385","9.375","0.0001","14.4845","0.0002","26.439","0.0003","90","","90","","90","","3590.21","0.07","295","1","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-(4,6-Dimethoxypyrimidin-2-ylsulfanyl)-N-phenylbenzamide","","- C19 H17 N3 O3 S -","- C19 H17 N3 O3 S -","- C152 H136 N24 O24 S8 -","8","1","WN6376","Jun Wu; Mei-Feng Chen; Li-Hong Wang; Pei-Zhi Zhang","2-(4,6-Dimethoxypyrimidin-2-ylsulfanyl)-<i>N</i>-phenylbenzamide","Acta Crystallographica Section E","2005","61","11","o3728","o3729","10.1107/S1600536805032940","","","0.7107","MoKα","","","0.033","","","","0.072","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207386","13.1962","0.0019","15.049","0.002","18.124","0.004","90","","90","","90","","3599.2","1.1","294","2","294","2","","","","","","","","5","I b c a","-I 2b 2c","73","","2,2'-[(p-Phenylenedimethylene)dithio]-bis- (1-methyl-1H-imidazol)","","- C16 H20 N4 O S2 -","- C16 H20 N4 O S2 -","- C128 H160 N32 O8 S16 -","8","0.5","WN6379","Ya-Jie Xie","1,1'-Dimethyl-2,2'-[<i>p</i>-phenylenebis(methylenethio)]di-1<i>H</i>-imidazole monohydrate","Acta Crystallographica Section E","2005","61","11","o3538","o3539","10.1107/S1600536805030412","","","0.71073","MoKα","","0.061","0.0359","","","0.0891","0.1096","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207387","8.8417","0.0018","12.081","0.002","14.262","0.003","90","","90","","90","","1523.4","0.5","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-Hydroxypyridinium-1-acetate monohydrate","","- C7 H9 N O4 -","- C7 H9 N O4 -","- C56 H72 N8 O32 -","8","1","WN6386","Zhu-Yan Zhang; Shan Gao; Li-Hua Huo; Jing-Gui Zhao","3-Hydroxypyridinium-1-acetate monohydrate","Acta Crystallographica Section E","2005","61","11","o3554","o3555","10.1107/S1600536805031284","","","0.71073","MoKα","","0.0434","0.0358","","","0.0953","0.0997","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207388","8.9187","0.0012","8.3101","0.0011","25.367","0.003","90","","108.718","0.004","90","","1780.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(1H-Benzotriazol-1-yl)-1-phenyl-2-(1H-1,2,4-triazol-1-yl)ethanone cyclohexane hemisolvate","","- C19 H18 N6 O -","- C19 H18 N6 O -","- C76 H72 N24 O4 -","4","1","WN6387","Jun Wan; Chun-Li Li; Xue-Mei Li; Liang-Zhong Xu; Shu-Sheng Zhang","2-(1<i>H</i>-Benzotriazol-1-yl)-1-phenyl-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanone cyclohexane hemisolvate","Acta Crystallographica Section E","2005","61","11","o3903","o3904","10.1107/S1600536805034343","","","0.71073","MoKα","","0.0592","0.0496","","","0.138","0.1491","","","","","","0.94","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207389","3.7756","0.0002","9.4584","0.0013","24.295","0.004","90","","90.875","0.008","90","","867.5","0.19","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Nitrocinnamic acid","","- C9 H7 N O4 -","- C9 H7 N O4 -","- C36 H28 N4 O16 -","4","1","WN6388","Udaya lakshmi, K.; Thamotharan, S.; Srinivasan, M.; Ramamurthi, K.; Varghese, B.","3-Nitrocinnamic acid","Acta Crystallographica Section E","2005","61","11","o3636","o3638","10.1107/S1600536805031879","","","1.5418","CuKα","","0.0693","0.0462","","","0.1303","0.146","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207390","11.327","0.002","9.227","0.0018","16.397","0.003","90","","97.95","0.03","90","","1697.2","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-dimethyl-2-phenyl-3H,10aH-benzo[de]cyclobut[I] isoquinoline-3,5-dione","","- C22 H17 N O2 -","- C22 H17 N O2 -","- C88 H68 N4 O8 -","4","1","WN6392","Yong-Miao Shen; Zhi-Feng Lu; Yun Liu; Jian-Hua Xu","1,4-Dimethyl-2-phenyl-3<i>H</i>,10a<i>H</i>-4-azacyclobuta[<i>c</i>]phenylene-3,5-dione","Acta Crystallographica Section E","2005","61","11","o3950","o3952","10.1107/S1600536805035014","","","0.71073","MoKα","","0.1235","0.0587","","","0.163","0.1934","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207391","7.528","0.003","25.027","0.01","9.938","0.004","90","","97.293","0.008","90","","1857.2","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-N'-(4-Benzyloxy-3-methoxybenzylidene)benzohydrazide","","- C22 H20 N2 O3 -","- C22 H20 N2 O3 -","- C88 H80 N8 O12 -","4","1","WN6394","He, Yong-Zhi; Liu, Dong-Zhi","(<i>E</i>)-<i>N</i>'-(4-Benzyloxy-3-methoxybenzylidene)benzohydrazide","Acta Crystallographica Section E","2005","61","11","o3855","o3856","10.1107/S1600536805034021","","","0.71073","MoKα","","0.1055","0.0474","","","0.1021","0.1303","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207392","5.9174","0.0001","7.718","0.0001","15.9606","0.0004","81.239","0.002","84.617","0.002","88.716","0.001","717.22","0.02","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","3-(4-Methylphenyl)-1-(2-naphthyl)prop-2-en-1-one","","- C20 H16 O -","- C20 H16 O -","- C40 H32 O2 -","2","1","WN6395","S. Sathiya Moorthi; K. Chinnakali; S. Nanjundan; R. Balaji; Hoong-Kun Fun","3-(4-Methylphenyl)-1-(2-naphthyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","11","o3885","o3887","10.1107/S1600536805034239","","","0.71073","MoKα","","0.1346","0.0622","","","0.1695","0.2123","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207393","7.9088","0.0012","10.7469","0.0016","12.3067","0.0019","86.421","0.003","89.184","0.003","83.715","0.003","1037.7","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-[(4-formylphenyl)hydrazono]naphthalen-2(1H)-one‒2-naphthol (1/1)","","- C27 H20 N2 O3 -","- C27 H20 N2 O3 -","- C54 H40 N4 O6 -","2","1","WW6391","Liu, Xin-Gang; Feng, Ya-Qing; Liang, Zu-Pei; Wang, Wei","1-[(4-Formylphenyl)hydrazono]naphthalen-2(1<i>H</i>)-one‒2-naphthol (1/1)","Acta Crystallographica Section E","2005","61","11","o3857","o3858","10.1107/S1600536805033957","","","0.71073","MoKα","","0.1011","0.0551","","","","0.1912","","","","","","1.015","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207394","16.088","0.003","8.306","0.0017","17.358","0.004","90","","95.79","0.03","90","","2307.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 2-(2-{1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2- (dimethylamino)vinyloxy}phenyl)-3-(dimethylamino)acrylate","","- C24 H25 Cl N4 O4 -","- C24 H25 Cl N4 O4 -","- C96 H100 Cl4 N16 O16 -","4","1","WW6426","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","Methyl 2-(2-{1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-(dimethylamino)vinyloxy}phenyl)-3-(dimethylamino)acrylate","Acta Crystallographica Section E","2005","61","11","o3879","o3880","10.1107/S1600536805034197","","","0.71073","MoKα","","0.1373","0.0601","","","0.1598","0.1962","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207395","21.5659","0.0019","9.0711","0.0008","22.646","0.002","90","","109.746","0.002","90","","4169.7","0.6","292","2","292","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","8-Butylamino-1,2,5-trimethyl-7-p-tolyl-3-thia-4,7,9- triazacyclopenta[a]naphthalen-6(7H)-one","","- C23 H26 N4 O S -","- C23 H26 N4 O S -","- C184 H208 N32 O8 S8 -","8","1","WW6427","Cui, Ze-Ping; Liu, Jian-Chao; He, Hong-Wu","8-Butylamino-1,2,5-trimethyl-7-<i>p</i>-tolyl-3-thia-4,7,9-triazacyclopenta[<i>a</i>]naphthalen-6(7<i>H</i>)-one","Acta Crystallographica Section E","2005","61","11","o3642","o3644","10.1107/S1600536805031193","","","0.71073","MoKα","","0.0718","0.0555","","","0.1481","0.1589","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207396","8.0786","0.0016","30.476","0.006","8.4775","0.0017","90","","117.817","0.003","90","","1846","0.6","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-{2-[2-(4-Formyl-2-methoxyphenoxy)ethoxy]ethoxy}-3-methoxybenzaldehyde","","- C20 H22 O7 -","- C20 H22 O7 -","- C80 H88 O28 -","4","1","WW6428","Qi, Ai-Di; Zhu, Qing-Hua; He, Yong-Zhi; Ren, Xiao-Liang","4-{2-[2-(4-Formyl-2-methoxyphenoxy)ethoxy]ethoxy}-3-methoxybenzaldehyde","Acta Crystallographica Section E","2005","61","11","o3784","o3785","10.1107/S1600536805033283","","","0.71073","MoKα","","0.1066","0.0439","","","0.0934","0.1151","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207397","17.12","0.003","10.271","0.002","13.042","0.003","90","","91.1","0.03","90","","2292.9","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(2,6-Dimethylphenyl)aminocarbonylmethyl]4-{[3-(3-methoxyphenyl)- 1,2,4-oxadiazol-5-yl]methyl}piperazine","","- C24 H29 N5 O3 -","- C24 H29 N5 O3 -","- C96 H116 N20 O12 -","4","1","WW6429","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","1-[(2,6-Dimethylphenyl)aminocarbonylmethyl]-4-{[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperazine","Acta Crystallographica Section E","2005","61","11","o3750","o3751","10.1107/S1600536805032915","","","0.71073","MoKα","","0.157","0.0574","","","0.1365","0.181","","","","","","0.949","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207398","26.753","0.003","5.7309","0.0006","20.185","0.002","90","","110.868","0.002","90","","2891.7","0.5","294","2","294","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","9-(4-Ethynylphenyl)-9H-carbazole","","- C20 H13 N -","- C20 H13 N -","- C160 H104 N8 -","8","1","WW6431","Lin, Hai-Yao; Zhang, Xiao-Bo; Lu, Ping","9-(4-Ethynylphenyl)-9<i>H</i>-carbazole","Acta Crystallographica Section E","2005","61","11","o3597","o3598","10.1107/S1600536805031181","","","0.71073","MoKα","","0.0604","0.0397","","","0.0919","0.0996","","","","","","0.901","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207399","13.5526","0.0006","9.5725","0.0005","14.3309","0.0007","90","","114.072","0.002","90","","1697.49","0.15","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Diazido[N,N-bis(2-pyridylmethyl-κN)glycine-κ^2^N,O]copper(II) monohydrate","","- C14 H17 Cu N9 O3 -","- C14 H14 Cu N9 O3 -","- C56 H56 Cu4 N36 O12 -","4","1","WW6434","Cui, Yun-Cheng; Che, Guang-Bo; Liu, Chun-Bo; Li, Chuan-Bi","Diazido[<i>N</i>,<i>N</i>-bis(2-pyridylmethyl-κ<i>N</i>)glycine-κ^2^<i>N</i>,<i>O</i>]copper(II) monohydrate","Acta Crystallographica Section E","2005","61","11","m2355","m2356","10.1107/S1600536805033350","","","0.71073","MoKα","","0.0276","0.0275","","","0.083","0.0831","","","","","","1.126","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207400","17.3249","0.0008","9.4165","0.0004","18.2202","0.001","90","","104.753","0.0006","90","","2874.4","0.2","295","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dimethyl 2-(4-fluorophenyl)-3-(methylamino)furan-4,5-dicarboxylate","","- C15 H14 F N O5 -","- C15 H14 F N O5 -","- C120 H112 F8 N8 O40 -","8","1","WW6437","Ma, Cheng; Yang, Ye-Wei","Dimethyl 2-(4-fluorophenyl)-3-(methylamino)furan-4,5-dicarboxylate","Acta Crystallographica Section E","2005","61","11","o3798","o3799","10.1107/S1600536805033295","","","0.71069","MoKα","","","0.0489","","","","0.1471","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207401","11.5991","0.0016","17.114","0.002","9.2425","0.0013","90","","96.883","0.002","90","","1821.5","0.4","294","2","294","2","","","","","","","","4","C 1 c 1","C -2yc","9","","(E)-4-(3-Ethoxy-4-hydroxybenzylideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol- 3(2H)-one","","- C20 H21 N3 O3 -","- C20 H21 N3 O3 -","- C80 H84 N12 O12 -","4","1","WW6439","Han, Jian-Rong; Zhen, Xiao-Li","(<i>E</i>)-4-(3-Ethoxy-4-hydroxybenzylideneamino)-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","11","o3815","o3816","10.1107/S160053680503360X","","","0.71073","MoKα","","0.0342","0.0306","","","0.081","0.0851","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207402","13.1701","0.0008","10.4625","0.0006","10.6961","0.0007","90","","90","","90","","1473.84","0.16","295","2","295","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","Bis[1-hydroxy-4,4,5,5-tetramethyl-2-(1,3-thiazol-2-yl)-4,5-dihydro- 1H-imidazole]nitratocobalt(II) nitrate","","- C20 H30 Co N8 O8 S2 -","- C20 H30 Co N8 O8 S2 -","- C40 H60 Co2 N16 O16 S4 -","2","0.5","XU6046","Li-Ya Wang; Jiu-Li Chang; Kai Jiang; Lu-Fang Ma; Yu-Fang Wang","Bis[1-hydroxy-4,4,5,5-tetramethyl-2-(1,3-thiazol-2-yl)-4,5-dihydro-1<i>H</i>-imidazole]nitratocobalt(II) nitrate","Acta Crystallographica Section E","2005","61","11","m2230","m2231","10.1107/S1600536805031508","","","0.71073","MoKα","","0.036","0.028","","","0.073","0.078","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207403","29.869","0.009","7.268","0.002","26.307","0.008","90","","113.126","0.005","90","","5252","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(9,20-dichloro-12,17-diphenyl-2,4,13,16-tetraazatricyclo[16.4.0.0^6,11^]docosa- 6,8,10,12,16,18,20,22-octaene-3,4-dionato)nickel(II) methanol hemisolvate","(9,20-dichloro-12,17-diphenyl-2,4,13,16-tetraazatricyclo[16.4.0.0^6,11^]docosa- 6,8,10,12,16,18,20,22-octaene-3,4-dionato)nickel(II) methanol hemisolvate","","- C30.5 H22 Cl2 N4 Ni O2.5 -","- C30.5 H20 Cl2 N4 Ni O2.5 -","- C244 H160 Cl16 N32 Ni8 O20 -","8","1","XU6050","Yu, Ming; Yang, Guang-Ming","A new nickel(II) complex with a [14]N4 macrocyclic ligand","Acta Crystallographica Section E","2005","61","11","m2436","m2437","10.1107/S1600536805034458","","","0.71073","MoKα","","0.112","0.054","","","0.105","0.137","","","","","","1.101","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207404","16.985","0.006","6.775","0.002","10.141","0.003","90","","111.879","0.004","90","","1082.9","0.6","298","2","298","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Tetraaquabis(isothiocyanato-κN)zinc(II) bis(2-methylpyrazine 1,4-dioxide)","","- C12 H20 N6 O8 S2 Zn -","- C12 H20 N6 O8 S2 Zn -","- C24 H40 N12 O16 S4 Zn2 -","2","0.25","XU6052","Xu, Wen; Shi, Jing-Min; Zhang, Xia","Tetraaquabis(thiocyanato-κ<i>N</i>)zinc(II) bis(2-methylpyrazine 1,4-dioxide)","Acta Crystallographica Section E","2005","61","11","m2194","m2195","10.1107/S1600536805031338","","","0.71073","MoKα","","0.039","0.037","","","0.098","0.099","","","","","","1.123","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207405","11.76","0.009","13.06","0.01","11.243","0.009","90","","114.92","0.01","90","","1566","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaqua(1,10-phenanthroline-κ^2^N,N')cadmium(II)]-μ- fumarato-κ^2^O:O']","","- C16 H14 Cd N2 O6 -","- C16 H14 Cd N2 O6 -","- C64 H56 Cd4 N8 O24 -","4","0.5","XU6053","Sun, Ya-Guang; Gao, En-Jun; Liu, Xia; Wang, Cheng-Shen","<i>catena</i>-Poly[[diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-fumarato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","11","m2190","m2191","10.1107/S1600536805031016","","","0.71073","MoKα","","0.025","0.02","","","0.047","0.048","","","","","","1.04","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207406","13.3872","0.0014","23.187","0.002","23.13","0.002","90","","91.89","0.002","90","","7175.9","1.2","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tris[4-(3-methyl-4-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-ylidene)isobutanolato- κ^2^O,O']bis(triphenylphosphine oxide-κO)europium(III)","","- C78 H75 Eu N6 O8 P2 -","- C78 H75 Eu N6 O8 P2 -","- C312 H300 Eu4 N24 O32 P8 -","4","1","XU6061","Qian-Yong Cao; Li-Qun Huang; Zhong-Wei Wang; Chang-Jian Yang; Xi-Cun Gao","Tris[4-(3-methyl-4-oxo-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazol-4-ylidene)isobutanolato-κ^2^<i>O</i>,<i>O</i>']bis(triphenylphosphine oxide-κ<i>O</i>)europium(III)","Acta Crystallographica Section E","2005","61","11","m2414","m2415","10.1107/S160053680503446X","","","0.71073","MoKα","","0.127","0.048","","","0.085","0.11","","","","","","0.983","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207407","8.157","0.002","12.355","0.003","13.932","0.003","96.7","0.03","100.37","0.03","101.49","0.03","1336.4","0.6","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","μ-3-(Carboxylatomethoxy)phenylsulfanylacetato-κO:O'-bis[aquabis(1,10- phenanthroline-κ^2^N,N')cadmium(II)] dinitrate","","- C58 H44 Cd2 N10 O13 S -","- C58 H44 Cd2 N10 O13 S -","- C58 H44 Cd2 N10 O13 S -","1","0.5","XU6065","Huo, Li-Hua; Gao, Shan; Ng, Seik Weng","μ-3-(Carboxylatomethoxy)phenylsulfanylacetato-κ<i>O</i>:<i>O</i>'-bis[aquabis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)] dinitrate","Acta Crystallographica Section E","2005","61","11","m2357","m2358","10.1107/S1600536805033271","","","0.71073","MoKα","","0.052","0.044","","","0.132","0.14","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207408","16.324","0.003","14.13","0.003","9.614","0.002","90","","104.05","0.03","90","","2151.2","0.8","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaqua(2-chloronicotinato-κ^2^O,O')erbium(III)]-di-μ-2- chloronicotinato-κ^4^O:O']","","- C18 H13 Cl3 Er N3 O8 -","- C18 H13 Cl3 Er N3 O8 -","- C72 H52 Cl12 Er4 N12 O32 -","4","0.5","XU6066","Lu, Zhen-Zhong; Gao, Shan; Ng, Seik Weng","<i>catena</i>-Poly[[diaqua(2-chloronicotinato-κ^2^<i>O</i>,<i>O</i>')erbium(III)]-di-μ-2-chloronicotinato-κ^4^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","11","m2343","m2345","10.1107/S160053680503312X","","","0.71073","MoKα","","0.042","0.039","","","0.088","0.089","","","","","","1.14","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207409","14.291","0.003","17.569","0.004","15.791","0.003","90","","107.95","0.03","90","","3771.8","1.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrakis(μ-phenylacetato-κ^2^O:O')bis[(N,N-dimethylformamide-κO)copper(II)]","","- C38 H42 Cu2 N2 O10 -","- C38 H42 Cu2 N2 O10 -","- C152 H168 Cu8 N8 O40 -","4","1","XU6068","Kong, Li-Li; Huo, Li-Hua; Gao, Shan; Zhao, Jing-Gui","Tetrakis(μ-phenylacetato-κ^2^<i>O</i>:<i>O</i>')bis[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)copper(II)]","Acta Crystallographica Section E","2005","61","11","m2289","m2290","10.1107/S1600536805032150","","","0.71073","MoKα","","0.064","0.043","","","0.103","0.114","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207410","6.8077","0.0014","10.725","0.002","27.313","0.006","90","","96.76","0.03","90","","1980.3","0.7","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[diaqua(1,10-phenanthroline-κ^2^N,N')nickel(II)]- μ-4-carboxylatophenoxyacetato-κ^2^O:O'] monohydrate]","","- C21 H20 N2 Ni O8 -","- C21 H20 N2 Ni O8 -","- C84 H80 N8 Ni4 O32 -","4","1","XU6070","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Zhao, Jing-Gui","<i>catena</i>-Poly[[[diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II)]-μ-4-carboxylatophenoxyacetato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2005","61","11","m2440","m2442","10.1107/S160053680503480X","","","0.71073","MoKα","","0.044","0.033","","","0.079","0.082","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207411","10.4818","0.0017","17.071","0.003","13.46","0.002","90","","92.78","0.003","90","","2405.6","0.7","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N-Benzyl-4-(4,4-diphenylbuta-1,3-dienyl)-N-ethylaniline","","- C31 H29 N -","- C31 H29 N -","- C124 H116 N4 -","4","1","YA6264","Wu, An-Shu; Li, Xiang-Gao; Li, Nan; Wang, Shi-Rong","<i>N</i>-Benzyl-4-(4,4-diphenylbuta-1,3-dienyl)-<i>N</i>-ethylaniline","Acta Crystallographica Section E","2005","61","11","o3691","o3692","10.1107/S1600536805032344","","","0.71073","MoKα","","0.098","0.045","","","","0.128","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207412","15.097","0.008","10.989","0.006","14.291","0.011","90","","90","","90","","2371","3","293","2","293","2","","","","","","","","6","I b a 2","I 2 -2c","45","","Diazidobis(1,10-phenanthroline)cobalt(II) perchlorate","","- C24 H16 Cl Co N10 O4 -","- C24 H16 Cl Co N10 O4 -","- C96 H64 Cl4 Co4 N40 O16 -","4","0.5","AC6190","Xue-Yan Song; Xu-Da Wang; Yun-He Xu; Li-Cun Li","Diazidobis(1,10-phenanthroline)cobalt(III) perchlorate","Acta Crystallographica Section E","2005","61","12","m2649","m2650","10.1107/S1600536805033544","","","0.71073","MoKα","","0.0627","0.0468","","","0.1115","0.1188","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207413","15.9996","0.0007","15.3187","0.0006","16.7417","0.0007","90","","90","","90","","4103.3","0.3","233.5","0.2","233.5","0.2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","catena-Poly[[Aqua[bis(2-pyridylmethyl)amino-6-caproato]zinc(II) perchlorate]","","- C18 H24 Cl N3 O7 Zn -","- C18 H24 Cl N3 O7 Zn -","- C144 H192 Cl8 N24 O56 Zn8 -","8","1","AC6211","Choi, Ki-Young; Ryu, Haiil; Ko, Jaejung; Kang, Sang Ook; Han, Won-Sik; Suh, Il-Hwan","<i>catena</i>-Poly[[[aquazinc(II)]-μ-6-[bis(2-pyridylmethyl)amino]caproato] perchlorate]","Acta Crystallographica Section E","2005","61","12","m2474","m2476","10.1107/S1600536805035026","","","0.71073","MoKα","","0.093","0.0412","","","0.0944","0.1269","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207414","4.7746","0.0008","8.6976","0.0016","21.557","0.004","90","","96.041","0.003","90","","890.2","0.3","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-Ethoxy-4-[2-(4-formyl-2-ethoxyphenoxy)ethoxy]benzaldehyde","","- C20 H22 O6 -","- C20 H22 O6 -","- C40 H44 O12 -","2","0.5","AC6212","Han, Jian-Rong; Zhen, Xiao-Li","3-Ethoxy-4-[2-(2-ethoxy-4-formylphenoxy)ethoxy]benzaldehyde","Acta Crystallographica Section E","2005","61","12","o4073","o4074","10.1107/S1600536805036366","","","0.71073","MoKα","","0.0569","0.0418","","","0.108","0.1206","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207415","6.2297","0.0004","12.2538","0.0008","19.3613","0.0013","90","","90","","90","","1477.99","0.17","93.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C13 H18 I N O2 S -","- C13 H18 I N O2 S -","- C52 H72 I4 N4 O8 S4 -","4","1","AC6213","Kakuda, Hiroko; Shiro, Motoo","(2<i>S</i>)-2-[(1<i>R</i>)-1-Iodoethyl]-1-(4-methylphenylsulfonyl)pyrrolidine","Acta Crystallographica Section E","2005","61","12","o3964","o3965","10.1107/S1600536805035038","","","1.54187","CuKα","","","0.0461","","","","0.081","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207416","7.1062","0.0003","8.5441","0.0005","9.8766","0.0006","86.124","0.003","83.804","0.003","77.29","0.003","580.96","0.06","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","3-Chloro-4-hydroxy-4'-methylbenzophenone","","- C14 H11 Cl O2 -","- C14 H11 Cl O2 -","- C28 H22 Cl2 O4 -","2","1","AC6218","Harrison, William T. A.; Anilkumar, H. G.; Yathirajan, H. S.; Sadashivamurthy, B.; Basaravaju, Y. B.","3-Chloro-4-hydroxy-4'-methylbenzophenone","Acta Crystallographica Section E","2005","61","12","o4146","o4148","10.1107/S1600536805036780","","","0.71073","MoKα","","0.066","0.0414","","","0.1024","0.1149","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207417","7.9797","0.0006","13.5449","0.001","15.3793","0.0009","90","","91.816","0.006","90","","1661.4","0.2","295","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","E)-9,10-Dihydro-9-methyl-9-nitro-10-(trinitromethyl)anthracene","","- C16 H12 N4 O8 -","- C16 H12 N4 O8 -","- C64 H48 N16 O32 -","4","1","AC6219","Arslan, Mustafa; Baker, Ronald J.; Masnovi, John; Asker, Erol","(<i>E</i>)-9,10-Dihydro-9-methyl-9-nitro-10-(trinitromethyl)anthracene","Acta Crystallographica Section E","2005","61","12","o4133","o4135","10.1107/S1600536805036974","","","0.71073","MoKα","","","0.0397","","","","0.1334","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207418","7.092","0.005","8.231","0.005","30.49","0.02","90","","91.725","0.012","90","","1779","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-{[(1E)-(3,5-dibromo-2-hydroxyphenyl)methylene]amino} -1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one","","- C18 H15 Br2 N3 O2 -","- C18 H15 Br2 N3 O2 -","- C72 H60 Br8 N12 O8 -","4","1","AC6220","Ling Huang; Ding-Ben Chen","4-{[(1<i>E</i>)-(3,5-Dibromo-2-hydroxyphenyl)methylene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3<i>H</i>-pyrazol-3-one","Acta Crystallographica Section E","2005","61","12","o4169","o4170","10.1107/S1600536805037165","","","0.71073","MoKα","","0.0421","0.0317","","","0.074","0.0781","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207419","4.408","0.0015","8.877","0.003","10.757","0.003","72.2","0.03","87.67","0.03","88.53","0.03","400.4","0.2","130","2","130","2","","","","","","","","4","P -1","-P 1","2","","Benzimidazole-2-carboxylic acid monohydrate","","- C8 H8 N2 O3 -","- C8 H8 N2 O3 -","- C16 H16 N4 O6 -","2","1","AC6222","Sławomir Krawczyk; Maria Gdaniec; Franciszek Sa̧czewski","1<i>H</i>-Benzimidazole-2-carboxylic acid monohydrate","Acta Crystallographica Section E","2005","61","12","o4185","o4187","10.1107/S1600536805037505","","","0.71073","MoKα","","0.1366","0.0532","","","0.0751","0.0963","","","","","","0.915","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207420","12.032","0.003","15.808","0.004","10.673","0.003","90","","103.66","0.03","90","","1972.6","0.9","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,4,5,6-tetrachloro-1,3-dicyanobenzene-pyrene (1/1)","","- C24 H10 Cl4 N2 -","- C24 H10 Cl4 N2 -","- C96 H40 Cl16 N8 -","4","0.5","AC6223","Britton, Doyle","A 1:1 complex of 2,4,5,6-tetrachloro-1,3-dicyanobenzene with pyrene","Acta Crystallographica Section E","2005","61","12","o4188","o4189","10.1107/S1600536805037499","","","0.71073","MoKα","","0.053","0.04","","","0.107","0.115","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207421","22.247","0.005","31.175","0.006","4.8562","0.001","90","","90","","90","","3368","1.2","294","2","294","2","","","","","","","","3","F d d 2","F 2 -2d","43","","3,3'-Dihydroxy-4,4'-(propane-1,3-diyldioxy)dibenzaldehyde","","- C19 H20 O6 -","- C19 H20 O6 -","- C152 H160 O48 -","8","0.5","AT6046","Fan, Zhi; Diao, Chun-Hua; Guo, Min-Jie; Yu, Ming; Chen, Xin","3,3'-Dihydroxy-4,4'-(propane-1,3-diyldioxy)dibenzaldehyde","Acta Crystallographica Section E","2005","61","12","o4004","o4005","10.1107/S1600536805034665","","","0.71073","MoKα","","0.0439","0.0306","","","0.0661","0.0738","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207422","8.445","0.006","9.076","0.004","9.755","0.004","98.051","0.002","91.905","0.002","97.891","0.002","732.3","0.7","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Benzimidazolium hydrogen nitroterephthalate","","- C15 H11 N3 O6 -","- C15 H11 N3 O6 -","- C30 H22 N6 O12 -","2","1","AT6047","Tian-Tian Pan; Jia-Geng Liu; Duan-Jun Xu","Benzimidazolium hydrogen nitroterephthalate","Acta Crystallographica Section E","2005","61","12","o3996","o3997","10.1107/S1600536805035749","","","0.71073","MoKα","","0.059","0.048","","","0.14","0.146","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207423","9.1614","0.0018","12.101","0.002","10.053","0.002","90","","100.1","0.03","90","","1097.2","0.4","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dihydroxonium 1,5-naphthalenedisulfonate N,N-dimethylformamide disolvate","","- C16 H26 N2 O10 S2 -","- C16 H26 N2 O10 S2 -","- C32 H52 N4 O20 S4 -","2","0.5","AT6050","Deng, Zhao-Peng; Gao, Shan; Huo, Li-Hua; Zhao, Hui","Dihydroxonium 1,5-naphthalenedisulfonate <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","12","o4175","o4176","10.1107/S1600536805037347","","","0.71073","MoKα","","0.0432","0.038","","","0.1074","0.1107","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207424","9.681","0.003","5.8632","0.0017","22.164","0.006","90","","90.826","0.005","90","","1257.9","0.6","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","n-Butyl 3,5-dinitrobenzoate","","- C11 H12 N2 O6 -","- C11 H12 N2 O6 -","- C44 H48 N8 O24 -","4","1","AT6051","Li, Fen-Fang; Xiao Feng-Ping; Jin, Long-Fei; Wu, Yong-Fei","<i>n</i>-Butyl 3,5-dinitrobenzoate","Acta Crystallographica Section E","2005","61","12","o4173","o4174","10.1107/S1600536805037359","","","0.71073","MoKα","","0.0766","0.0572","","","0.1622","0.1769","","","","","","1.079","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207425","6.1629","0.0016","15.935","0.004","16.323","0.004","117.824","0.004","90.749","0.005","99.054","0.005","1393.1","0.6","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","N,N-Dibenzyl-4-(4,4-diphenylbuta-1,3-dienyl)-3-methylaniline","","- C37 H33 N -","- C37 H33 N -","- C74 H66 N2 -","2","1","AT6052","Wu, An-Shu; Li, Xiang-Gao; Xu, De-Shun; Wang, Shi-Rong","<i>N</i>,<i>N</i>-Dibenzyl-4-(4,4-diphenylbuta-1,3-dienyl)-3-methylaniline","Acta Crystallographica Section E","2005","61","12","o4167","o4168","10.1107/S1600536805037360","","","0.71073","MoKα","","0.118","0.054","","","","0.131","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207426","8.339","0.0017","8.681","0.0017","13.268","0.003","71.08","0.03","77.21","0.03","85.31","0.03","886","0.4","288","2","288","2","","","","","","","","6","P -1","-P 1","2","","3a,8c-Dichloro-8b-phenyl-3a,3b,8b,8c-tetrahydro-2-methyl-1H- [1]benzothieno[2',3':3,4]cyclobuta[1,2-c]pyrrole-1,3(2H)-dione","","- C19 H13 Cl2 N O2 S -","- C19 H13 Cl2 N O2 S -","- C38 H26 Cl4 N2 O4 S2 -","2","1","AT6053","Hui-Ying An; Zhi-Feng Lu; Yong-Miao Shen; Shan Lu; Jian-Hua Xu","3a,8c-Dichloro-8b-phenyl-3a,3b,8b,8c-tetrahydro-2-methyl-1<i>H</i>-[1]benzothieno[2',3':3,4]cyclobuta[1,2-<i>c</i>]pyrrole-1,3(2<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","12","o4331","o4332","10.1107/S1600536805038687","","","0.71073","MoKα","","0.0672","0.0498","","","0.1392","0.1598","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207427","12.5131","0.0006","13.2636","0.0006","16.5594","0.0007","90","","90","","90","","2748.3","0.2","296","","296","","","","","","","","","5","P b c n","-P 2n 2ab","60","","(E)-5-[(3-Bromophenyl)diazenyl]-2-hydroxy-3-methoxybenzaldehyde","","- C14 H11 Br N2 O3 -","- C14 H11 Br N2 O3 -","- C112 H88 Br8 N16 O24 -","8","1","AT6054","Şahin, Onur; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-5-[(3-Bromophenyl)diazenyl]-2-hydroxy-3-methoxybenzaldehyde","Acta Crystallographica Section E","2005","61","12","o4276","o4278","10.1107/S1600536805038365","","","0.71073","MoKα","","0.0618","0.0374","","","0.0811","0.0908","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207428","10.7956","0.0008","13.7521","0.0013","8.3078","0.0006","90","","92.274","0.006","90","","1232.42","0.17","296","","296","","","","","","","","","5","C 1 c 1","C -2yc","9","","(E)-5-[(2-Fluorophenyl)diazenyl]-2-hydroxy-3-methoxybenzaldehyde","","- C14 H11 F N2 O3 -","- C14 H11 F N2 O3 -","- C56 H44 F4 N8 O12 -","4","1","AT6055","Şahin, Onur; Albayrak, Çiǧdem; Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-5-[(2-Fluorophenyl)diazenyl]-2-hydroxy-3-methoxybenzaldehyde","Acta Crystallographica Section E","2005","61","12","o4279","o4281","10.1107/S1600536805038377","","","0.71073","MoKα","","0.0389","0.0303","","","0.0815","0.0828","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207429","6.3262","0.0019","9.36","0.003","22.629","0.007","90","","96.924","0.005","90","","1330.2","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Piperidin-1-ylmethyl-2-naphthol","","- C16 H19 N O -","- C16 H19 N O -","- C64 H76 N4 O4 -","4","1","AT6056","Qing-Wei Liu; Ming-Jie Zhang; Xiang-Qian Wang; Peng-Gao Ma","1-(Piperidin-1-ylmethyl)-2-naphthol","Acta Crystallographica Section E","2005","61","12","o4285","o4286","10.1107/S1600536805038389","","","0.71073","MoKα","","0.1449","0.0514","","","0.1199","0.1594","","","","","","0.938","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207430","7.988","0.002","6.6635","0.0016","14.26","0.004","90","","96.354","0.004","90","","754.4","0.3","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-[4-(4-Formylphenoxy)butoxy]benzaldehyde","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","0.5","AT6057","Han, Jian-Rong; Zhen, Xiao-Li","4-[4-(4-Formylphenoxy)butoxy]benzaldehyde","Acta Crystallographica Section E","2005","61","12","o4358","o4359","10.1107/S160053680503905X","","","0.71073","MoKα","","0.0681","0.0392","","","0.1","0.1182","","","","","","1.003","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207431","5.0465","0.0008","20.264","0.003","14.956","0.002","90","","92.938","0.003","90","","1527.4","0.4","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-N'-(3-Ethoxy-4-methoxybenzylidene)benzohydrazide","","- C17 H18 N2 O3 -","- C17 H18 N2 O3 -","- C68 H72 N8 O12 -","4","1","AT6068","Zhen, Xiao-Li; Han, Jian-Rong","(<i>E</i>)-<i>N</i>'-(3-Ethoxy-4-methoxybenzylidene)benzohydrazide","Acta Crystallographica Section E","2005","61","12","o4360","o4361","10.1107/S1600536805039061","","","0.71073","MoKα","","0.0812","0.0429","","","0.0956","0.1154","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207432","6.3222","0.0008","9.2626","0.0011","9.4421","0.0012","88.316","0.002","73.963","0.002","76.626","0.002","516.65","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Poly[aquahemi(μ~6~-benzene-1,2,4,5-tetracarboxylato)hemi(μ~6~- 2,5-dicarboxybenzene-1,4-dicarboxylato)samarium]","","- C20 H10 O18 Sm2 -","- C20 H10 O18 Sm2 -","- C20 H10 O18 Sm2 -","1","0.5","BD6013","Yu-Mei Dai; Xiao-Qin Wang; Jin-Feng Huang","Poly[diaqua(μ~6~-benzene-1,2,4,5-tetracarboxylato)(μ~6~-2,5-dicarboxybenzene-1,4-dicarboxylato)disamarium]","Acta Crystallographica Section E","2005","61","12","m2548","m2549","10.1107/S1600536805036081","","","0.71073","MoKα","","","0.0322","","","0.0789","0.081","","","","","","1.133","","","","has coordinates,has Fobs","196234","2020-10-21","18:00:00",""
"2207433","8.4996","0.0006","20.1067","0.0014","11.774","0.0008","90","","103.544","0.001","90","","1956.2","0.2","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis(μ-4-sulfamoylbenzoato)bis[chloro(di-2-pyridylamine)copper(II)] dihydrate","","- C17 H17 Cl Cu N4 O5 S -","- C17 H17 Cl Cu N4 O5 S -","- C68 H68 Cl4 Cu4 N16 O20 S4 -","4","1","BD6014","Xin-Hua Li","Bis(μ-4-sulfamoylbenzoato)bis[chloro(di-2-pyridylamine)copper(II)] dihydrate","Acta Crystallographica, Section E","2005","61","12","m2623","m2625","10.1107/S1600536805036858","","","0.71073","MoKα","","0.0402","0.0355","","","0.0883","0.0911","","","","","","1.054","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2207434","25.392","0.002","13.1747","0.0011","19.5144","0.0016","90","","96.011","0.002","90","","6492.3","0.9","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diethylenetriammonium oxonium naphthalene-1,6-disulfonate 3.5-hydrate","","- C24 H38 N3 O16.5 S4 -","- C24 H38 N3 O16.5 S4 -","- C192 H304 N24 O132 S32 -","8","1","BD6015","Zhi-Min Jin; Li Li; Li-Zhao Chen; Ling-Su Li; Mao-Lin Hu","Diethylenetriammonium oxonium naphthalene-1,6-disulfonate 3.5-hydrate","Acta Crystallographica Section E","2005","61","12","o4325","o4327","10.1107/S1600536805038766","","","0.71073","MoKα","","0.0639","0.0545","","","0.1402","0.147","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207435","22.088","0.004","7.556","0.0015","11.152","0.002","90","","113.56","0.03","90","","1706.1","0.7","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(thiocyanato-κN)cobalt(II)]-di-μ-2-aminobenzonitrile- κ^2^N,N']","","- C16 H12 Co N6 S2 -","- C16 H12 Co N6 S2 -","- C64 H48 Co4 N24 S8 -","4","0.5","BD6016","Moitsheki, Lesego J.; Bourne, Susan A.; Nassimbeni, Luigi R.","<i>catena</i>-Poly[[bis(thiocyanato-κ<i>N</i>)cobalt(II)]-di-μ-2-aminobenzonitrile-κ^2^<i>N</i>,<i>N</i>']","Acta Crystallographica Section E","2005","61","12","m2580","m2581","10.1107/S1600536805036846","","","0.71073","MoKα","","0.0372","0.0273","","","0.0643","0.0679","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207436","7.652","0.005","20.37","0.005","18.173","0.005","90","","101.546","0.005","90","","2775","2","100","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Carbonyl(8-hydroxyquinolinato)[tris(2-methylphenyl) phosphite]rhodium(I)","","- C31 H27 N O5 P Rh -","- C31 H27 N O5 P Rh -","- C124 H108 N4 O20 P4 Rh4 -","4","1","BD6017","Janse van Rensburg, J. Marthinus; Roodt, Andreas; Muller, Alfred; Meijboom, Reinout","Carbonyl(8-hydroxyquinolinato)[tris(2-methylphenyl) phosphite]rhodium(I)","Acta Crystallographica Section E","2005","61","12","m2743","m2745","10.1107/S1600536805038912","","","0.71069","MoKα","","","0.0418","","","","0.0942","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207437","11.987","0.002","14.069","0.003","22.709","0.003","90","","104.485","0.003","90","","3708","1.1","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","1-Acetonitrile-3-chloro-1,2-(μ-3,5-dinitrobenzoato-κ^2^O,O')- 1-(triphenylphosphine-κP)-closo-1-ruthenaundecaborane","","- C27 H29 B10 Cl N3 O6 P Ru -","- C27 H29 B10 Cl N3 O6 P Ru -","- C108 H116 B40 Cl4 N12 O24 P4 Ru4 -","4","1","BH6038","Guo, Qing-Liang; Dou, Jian-Min; Wu, Li-Bin; Li, Da-Cheng; Wang, Daqi","1-Acetonitrile-3-chloro-1,2-(μ-3,5-dinitrobenzoato-κ^2^<i>O</i>,<i>O</i>')-1-(triphenylphosphine-κ<i>P</i>)-<i>closo</i>-1-ruthenaundecaborane","Acta Crystallographica Section E","2005","61","12","m2613","m2615","10.1107/S1600536805036639","","","0.71073","MoKα","","0.0902","0.0424","","","0.0768","0.0847","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207438","3.8486","0.0005","5.818","0.001","25.437","0.004","90","","91.408","0.012","90","","569.39","0.15","296","","296","","","","","","","","","5","P 1 21 1","P 2yb","4","","(E)-5-(4-Chlorophenyldiazenyl)salicylaldehyde","","- C13 H9 Cl N2 O2 -","- C13 H9 Cl N2 O2 -","- C26 H18 Cl2 N4 O4 -","2","1","BH6039","Şahin, Onur; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-5-(4-Chlorophenyldiazenyl)salicylaldehyde","Acta Crystallographica Section E","2005","61","12","o4149","o4150","10.1107/S1600536805036810","","","0.71073","MoKα","","0.0684","0.0549","","","0.1378","0.1487","","","","","","0.976","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207439","14.2617","0.0012","13.731","0.002","6.776","0.003","90","","96.958","0.014","90","","1317.2","0.6","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-5-(4-Ethylphenyldiazenyl)salicylaldehyde","","- C15 H14 N2 O2 -","- C15 H14 N2 O2 -","- C60 H56 N8 O8 -","4","1","BH6040","Şahin, Onur; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-5-(4-Ethylphenyldiazenyl)salicylaldehyde","Acta Crystallographica Section E","2005","61","12","o4154","o4155","10.1107/S1600536805036834","","","0.71073","MoKα","","0.1702","0.049","","","0.108","0.1442","","","","","","0.836","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2207440","3.8914","0.0006","5.8043","0.0005","25.745","0.004","90","","92.101","0.012","90","","581.11","0.14","296","","296","","","","","","","","","5","P 1 21 1","P 2yb","4","","(E)-5-(4-Bromophenyldiazenyl)salicylaldehyde","","- C13 H9 Br N2 O2 -","- C13 H9 Br N2 O2 -","- C26 H18 Br2 N4 O4 -","2","1","BH6041","Şahin, Onur; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-5-(4-Bromophenyldiazenyl)salicylaldehyde","Acta Crystallographica Section E","2005","61","12","o4151","o4153","10.1107/S1600536805036822","","","0.71073","MoKα","","0.0366","0.0332","","","0.078","0.0799","","","","","","1.069","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207441","9.9557","0.0019","9.8964","0.0019","15.715","0.003","90","","101.938","0.002","90","","1514.8","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis(4-nitropyridine N-oxide-κO)bis(perchlorato)copper(II)","","- C20 H16 Cl2 Cu N8 O20 -","- C20 H16 Cl2 Cu N8 O20 -","- C40 H32 Cl4 Cu2 N16 O40 -","2","0.5","BH6043","Shi, Jing-Min; Chen, Ju-Na; Wu, Chang-Ju; Liu, Lian-Dong","Tetrakis(4-nitropyridine <i>N</i>-oxide-κ<i>O</i>)bis(perchlorato)copper(II)","Acta Crystallographica Section E","2005","61","12","m2621","m2622","10.1107/S1600536805036809","","","0.71073","MoKα","","0.0479","0.0429","","","0.1248","0.1301","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207442","7.0888","0.0006","14.4398","0.0013","24.085","0.002","90","","96.112","0.002","90","","2451.3","0.4","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-4-(4-Chlorophenyl)-2-[(2-chlorophenyl)(3-pyridylmethylamino)methyl]-5,5- dimethyl-1,3,2-dioxaphosphinane 2-oxide","","- C24 H25 Cl2 N2 O3 P -","- C24 H25 Cl2 N2 O3 P -","- C96 H100 Cl8 N8 O12 P4 -","4","1","BH6044","Sun, Feng-Mei; Tian, Man-Man; Luo, Zai-Gang; Shi, De-Qing","<i>trans</i>-4-(4-Chlorophenyl)-2-[(2-chlorophenyl)(3-pyridylmethylamino)methyl]-5,5-dimethyl-1,3,2-dioxaphosphinane 2-oxide","Acta Crystallographica Section E","2005","61","12","o4162","o4164","10.1107/S1600536805037049","","","0.71073","MoKα","","0.0932","0.0572","","","0.1216","0.1377","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207443","23.75","0.02","6.869","0.005","21.65","0.02","90","","93.46","0.03","90","","3526","5","123","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(Adeninato-N^9^)[N-(2-aminoethyl)salicylideneiminato]palladium(II) 3.5-hydrate","{[(2-aminoethyl)iminomethyl]phenolato-κ^3^N,N',O}(9H-purine-6-aminato- κN^9^)palladium(II) 3.5-hydrate","","- C28 H44 N14 O9 Pd2 -","- C14 H22 N7 O4.5 Pd -","- C112 H176 N56 O36 Pd8 -","8","1","BH6045","Odoko, Mamiko; Okabe, Nobuo","(Adeninato-<i>N</i>^9^)[<i>N</i>-(2-aminoethyl)salicylideneiminato]palladium(II) 3.5-hydrate","Acta Crystallographica Section E","2005","61","12","m2670","m2673","10.1107/S1600536805037864","","","0.7107","MoKα","","","0.026","","","","0.07","","","","","","1.072","","","","has coordinates","209077","2020-10-21","18:00:00",""
"2207444","15.785","0.005","10.357","0.002","13.502","0.001","90","","105.96","0.02","90","","2122.3","0.8","287","2","287","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","(E,E)-4-(4-Nitrophenylethenyl)-1-(2,4,6-trimethoxyphenylethenyl)benzene","","- C25 H23 N O5 -","- C25 H23 N O5 -","- C100 H92 N4 O20 -","4","1","BH6051","Vande Velde, Christophe M. L.; De Borger, Roeland; Blockhuys, Frank","(<i>E</i>,<i>E</i>)-1-[2-(4-Nitrophenyl)ethenyl]-4-[2-(2,4,6-trimethoxyphenyl)ethenyl]benzene","Acta Crystallographica Section E","2005","61","12","o4289","o4291","10.1107/S1600536805038419","","","0.71073","MoKα","","0.0977","0.0395","","","0.0992","0.1214","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207445","9.766","0.002","9.692","0.002","9.811","0.002","90","","102.53","0.02","90","","906.4","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[sodium [aqua-μ~3~-hydroxo-di-μ~4~-phosphato-diferrate(III)] hydrate]","","- Fe2 H5 Na O11 P2 -","- Fe2 H5 Na O11 P2 -","- Fe8 H20 Na4 O44 P8 -","4","1","BR6221","Gao, Shan; Ng, Seik Weng","Sodium diiron(III) diphosphate hydroxide dihydrate","Acta Crystallographica, Section E","2005","61","12","i268","i269","10.1107/S1600536805036226","","","0.71073","MoKα","","0.024","0.022","","","0.071","0.072","","","","","","1.09","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207446","9.837","0.0002","13.347","0.0003","15.023","0.0003","90","","95.809","0.0013","90","","1962.31","0.07","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Bis-{2-[(N,N-dimethylaminomethyl)phenyl]}tin(IV)dibromide","Dibromobis[2-(N,N-dimethylaminomethyl)phenyl]tin(IV)","","- C18 H24 Br2 N2 Sn -","- C18 H24 Br2 N2 Sn -","- C72 H96 Br8 N8 Sn4 -","4","1","BR6222","Padělková, Zdeňka; Císařová, Ivana; Rǔžička, Aleš","Dibromobis[2-(<i>N</i>,<i>N</i>-dimethylaminomethyl)phenyl]tin(IV)","Acta Crystallographica Section E","2005","61","12","m2691","m2693","10.1107/S1600536805037827","","","0.71073","MoKα","","0.0589","0.048","","","0.1187","0.1243","","","","","","1.099","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207447","17.805","0.004","6.023","0.0012","18.504","0.004","90","","100.47","0.03","90","","1951.3","0.7","200","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","supermesitylenetellurenyl iodide","2,4,6-tri-tert-butylbenzenetellurenyl iodide","","- C18 H29 I Te -","- C18 H29 I Te -","- C72 H116 I4 Te4 -","4","1","BT6772","Klapötke, Thomas M.; Krumm, Burkhard; Schwab, Ingo","2,4,6-Tri-<i>tert</i>-butylbenzenetellurenyl iodide","Acta Crystallographica Section E","2005","61","12","o4045","o4046","10.1107/S1600536805035841","","","0.71073","MoKα","","0.0371","0.026","","","0.0596","0.0621","","","","","","0.925","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207448","16.076","0.003","17.248","0.003","9.995","0.002","90","","101.18","0.03","90","","2718.8","0.9","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Tpsi tellurenyl iodide","Tris(dimethylphenylsilyl)methanetellurenyl iodide","","- C25 H33 I Si3 Te -","- C25 H33 I Si3 Te -","- C100 H132 I4 Si12 Te4 -","4","1","BT6773","Klapötke, Thomas M.; Krumm, Burkhard; Schwab, Ingo","Tris(dimethylphenylsilyl)methanetellurenyl iodide","Acta Crystallographica Section E","2005","61","12","o4047","o4048","10.1107/S1600536805035853","","","0.71073","MoKα","","0.0461","0.0309","","","0.0674","0.0729","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207449","7.5866","0.0002","8.5684","0.0002","8.8257","0.0002","90","","102.77","0.0015","90","","559.52","0.02","120","2","120","2","","","","","","","","5","C 1 2 1","C 2y","5","","diaquabis(L-serinato)copper(II) decihydrate","","- C6 H16.2 Cu N2 O8.1 -","- C6 H16.2 Cu N2 O8.1 -","- C12 H32.4 Cu2 N4 O16.2 -","2","0.5","BT6774","Otavio Versiane; Judith Felcman; Jussara Lopes de Miranda; R. Alan Howie; Janet M. S. Skakle","Diaquabis(<small>L</small>-serinato)copper(II) 0.1-hydrate at 120K","Acta Crystallographica Section E","2005","61","12","m2517","m2519","10.1107/S1600536805035221","","","0.71073","MoKα","","0.0193","0.0192","","","0.0524","0.0525","","","","","","1.097","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2207450","4.8373","0.0005","9.8906","0.0011","16.093","0.0017","81.414","0.002","84.968","0.002","86.248","0.002","757.32","0.14","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","1,4-Dihydro-6-methyl-5-(N-methylcarbamoyl)-4-(4-nitrophenyl)pyrimidine- 2(3H)-thione monohydrate","","- C13 H16 N4 O4 S -","- C13 H16 N4 O4 S -","- C26 H32 N8 O8 S2 -","2","1","BT6775","Balasubramanian Sridhar; Krishnan Ravikumar","1,4-Dihydro-6-methyl-5-(<i>N</i>-methylcarbamoyl)-4-(4-nitrophenyl)pyrimidine-2(3<i>H</i>)-thione monohydrate","Acta Crystallographica Section E","2005","61","12","o4130","o4132","10.1107/S1600536805037098","","","0.71073","MoKα","","0.0459","0.043","","","0.1255","0.1291","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207451","5.787","0.001","8.776","0.002","12.617","0.003","90","","91.25","0.03","90","","640.6","0.2","293","2","293","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","1,4-diphenylbutane","","- C16 H18 -","- C16 H18 -","- C32 H36 -","2","0.5","BT6776","Michel Fleck; Walter Martin","1,4-Diphenylbutane","Acta Crystallographica Section E","2005","61","12","o4099","o4100","10.1107/S1600536805036706","","","0.71073","MoKα","","0.0602","0.0476","","","0.1334","0.1432","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207452","13.007","0.003","7.1317","0.0014","14.743","0.003","90","","102.14","0.03","90","","1337","0.5","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-[(4-Methoxyphenylamino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione","","- C14 H15 N O5 -","- C14 H15 N O5 -","- C56 H60 N4 O20 -","4","1","BT6778","Silva, Luiz Everson da; Joussef, Antonio Carlos; Nunes, Ricardo José; Andrighetti-Fröhner, Carla Regina; Bortoluzzi, Adailton José","5-[(4-Methoxyphenylamino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione","Acta Crystallographica Section E","2005","61","12","o4121","o4122","10.1107/S1600536805036871","","","0.71073","MoKα","","0.0813","0.0408","","","0.098","0.111","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207453","6.96","0.005","9.298","0.005","10.424","0.005","95.57","0.005","101.043","0.005","99.508","0.005","647.2","0.7","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","5-[(2-Bromophenylamino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione","","- C13 H12 Br N O4 -","- C13 H12 Br N O4 -","- C26 H24 Br2 N2 O8 -","2","1","BT6779","Silva, Luiz Everson da; Joussef, Antonio Carlos; Nunes, Ricardo José; Andrighetti-Fröhner, Carla Regina; Bortoluzzi, Adailton José","5-[(2-Bromophenylamino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione","Acta Crystallographica Section E","2005","61","12","o4252","o4253","10.1107/S1600536805036883","","","0.71073","MoKα","","0.0651","0.0302","","","0.0657","0.0733","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207454","9.858","0.002","10.027","0.002","9.787","0.002","90","","115.92","0.03","90","","870.1","0.4","292","2","292","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","not relevant","Caesium dimethyldiselenidoarsenate(V)","","- C2 H6 As Cs Se2 -","- C2 H6 As Cs Se2 -","- C8 H24 As4 Cs4 Se8 -","4","0.5","BT6780","Tobias van Almsick; William S. Sheldrick","Caesium dimethyldiselenidoarsenate(V)","Acta Crystallographica Section E","2005","61","12","m2661","m2663","10.1107/S1600536805037669","","","0.71073","MoKα","","0.0679","0.0469","","","0.1131","0.1249","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207455","6.4427","0.0003","8.1772","0.0005","11.3794","0.0006","69.954","0.005","77.247","0.004","83.521","0.004","548.84","0.05","291","0.3","291","0.3","","","","","","","","4","P -1","-P 1","2","","(1S,2S,7aR)-1,2,7a-trihydroxy-2-methylperhydro-1-phosphaindene 1-oxide hydrate","","- C9 H19 O5 P -","- C9 H19 O5 P -","- C18 H38 O10 P2 -","2","1","BT6781","Kruszynski, Rafal; Trzesowska, Agata; Majewski, Piotr; Bodalski, Ryszard","Racemic (1<i>SR</i>,2<i>SR</i>,7a<i>RS</i>)-1,2,7a-trihydroxy-2-methylperhydro-1-phosphaindene 1-oxide monohydrate","Acta Crystallographica Section E","2005","61","12","o4123","o4125","10.1107/S1600536805036664","","","0.71073","MoKα","","0.0304","0.0282","","","0.0779","0.0793","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207456","10.105","0.001","11.095","0.002","12.677","0.002","84.697","0.002","79.043","0.002","73.712","0.002","1338.2","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Poly-{catena-[μ-1,2-bis(diphenylphosphinyl)ethane-κ^2^P:P'](trifluoroacetato- κO)silver(I)}","","- C28 H24 Ag F3 O2 P2 -","- C28 H24 Ag F3 O2 P2 -","- C56 H48 Ag2 F6 O4 P4 -","2","1","BT6782","Bao, Feng; Lü, Xing-Qiang; Ng, Seik Weng","<i>catena</i>-Poly[[(trifluoroacetato-κ<i>O</i>)silver(I)]-μ-1,2-bis(diphenylphosphino)ethane-κ^2^<i>P</i>:<i>P</i>']","Acta Crystallographica Section E","2005","61","12","m2637","m2638","10.1107/S1600536805037189","","","0.71073","MoKα","","0.062","0.046","","","0.132","0.147","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207457","6.986","0.002","24.629","0.007","10.333","0.003","90","","92.399","0.005","90","","1776.3","0.9","294","2","294","2","","","","","","","","6","C 1 c 1","C -2yc","9","","N-[4-(2,4-Difluorophenyl]-5-(1H-1,2,4-triazol-1-yl)-1,3-thiazol-2-yl]-2- fluorobenzamide","","- C18 H10 F3 N5 O S -","- C18 H10 F3 N5 O S -","- C72 H40 F12 N20 O4 S4 -","4","1","BT6783","Du, Ding; Lu, Yan-Chang; Dai, Hong; Liu, Jian-Bing; Fang, Jian-Xin","<i>N</i>-[4-(2,4-Difluorophenyl)-5-(1<i>H</i>-1,2,4-triazol-1-yl)-1,3-thiazol-2-yl]-2-fluorobenzamide","Acta Crystallographica Section E","2005","61","12","o4241","o4242","10.1107/S1600536805037955","","","0.71073","MoKα","","0.0597","0.0333","","","0.0672","0.0771","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207458","9.677","0.002","5.291","0.001","12.818","0.003","90","","106.45","0.03","90","","629.4","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","S-(-)-3-Chloro-1-(4-morpholino-5-nitro-1H-imidazol-1-yl)propan-2-ol","","- C10 H15 Cl N4 O4 -","- C10 H15 Cl N4 O4 -","- C20 H30 Cl2 N8 O8 -","2","1","BT6787","Gzella, Andrzej; Żwawiak, Justyna; Zaprutko, Lucjusz","(S)-(-)-3-Chloro-1-(4-morpholino-5-nitro-1H-imidazol-1-yl)propan-2-ol","Acta Crystallographica, Section E","2005","61","12","o4232","o4231","10.1107/S1600536805037931","","","1.54178","CuKα","","0.0569","0.0441","","","0.116","0.1231","","","","","","1.093","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207459","14.174","0.003","8.0458","0.0016","6.2037","0.0012","90","","90","","90","","707.5","0.2","292","2","292","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Trimethylarsonium iodide","","- C3 H10 As I -","- C3 H10 As I -","- C12 H40 As4 I4 -","4","0.5","BT6788","Tobias van Almsick","Trimethylarsonium iodide","Acta Crystallographica Section E","2005","61","12","o4229","o4230","10.1107/S160053680503792X","","","0.71073","MoKα","","0.0372","0.0292","","","0.0751","0.078","","","","","","1.156","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207460","6.6438","0.0003","6.6438","0.0003","5.4206","0.0006","90","","90","","90","","239.27","0.03","157","0.1","157","0.1","","","","","","","","2","I 4/m c m","-I 4 2c","140","","manganese distannite","","- Mn Sn2 -","- Mn Sn2 -","- Mn4 Sn8 -","4","0.125","BT6789","Yongkwan Dong; Francis J. DiSalvo","Reinvestigation of MnSn~2~","Acta Crystallographica Section E","2005","61","12","i282","i284","10.1107/S1600536805038092","","","0.71073","MoKα","","0.0171","0.0162","","","0.0302","0.0304","","","","","","1.219","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207461","20.651","0.004","4.1381","0.0008","7.2842","0.0015","90","","90","","90","","622.5","0.2","291","2","291","2","","","","","","","","3","P n m a","-P 2ac 2n","62","cerium triplatinum pentaaluminium","cerium triplatinum pentaaluminium","","- Al5 Ce Pt3 -","- Al5 Ce Pt3 -","- Al20 Ce4 Pt12 -","4","0.5","BT6790","Tursina, Anna I.; Bukhan'ko, Natalia G.; Gribanov, Alexandr V.; Shchelkunov, Viktor A.; Nelyubina, Yuliya V.","A new ternary aluminide, CePt~3~Al~5~","Acta Crystallographica Section E","2005","61","12","i285","i286","10.1107/S1600536805038122","","","0.71073","MoKα","","0.0485","0.0335","","","0.0786","0.0842","","","","","","0.994","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207462","13.1122","0.0001","17.62","0.0001","11.618","0.0001","90","","94.9554","0.0004","90","","2674.15","0.03","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Dichlorobis(tris{4-[(dimethylamino)methyl]phenyl}phosphine)platinum(II)","","- C54 H72 Cl2 N6 P2 Pt -","- C54 H72 Cl2 N6 P2 Pt -","- C108 H144 Cl4 N12 P4 Pt2 -","2","0.5","BT6791","Lutz, Martin; Spek, Anthony L.; Kreiter, Robert; Klein Gebbink, Robertus J. M.; Koten, Gerard van","<i>trans</i>-Dichlorobis(tris{4-[(dimethylamino)methyl]phenyl}phosphine)platinum(II)","Acta Crystallographica Section E","2005","61","12","m2728","m2729","10.1107/S1600536805038882","","","0.71073","MoKα","","0.0292","0.0203","","","0.0469","0.05","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207463","10.4483","0.0012","10.2152","0.0012","11.6877","0.0013","90","","94.506","0.002","90","","1243.6","0.2","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3S,1S)-1-tert-Butyldiphenylsiloxy-3-hydroxy-3-isopropenyl-1,2,3,4- tetrahydronaphthalene","","- C29 H34 O2 Si -","- C29 H34 O2 Si -","- C58 H68 O4 Si2 -","2","1","BT6798","Fan, Eric; Lowary, Todd L.; Ferguson, Michael J.","(1<i>S</i>,3<i>S</i>)-1-<i>tert</i>-Butyldiphenylsiloxy-3-hydroxy-3-isopropenyl-1,2,3,4-tetrahydronaphthalene","Acta Crystallographica Section E","2005","61","12","o4295","o4297","10.1107/S1600536805037736","","","0.71073","MoKα","","0.0458","0.0382","","","0.0915","0.0951","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207464","13.2867","0.0009","11.9185","0.0008","16.2352","0.001","90","","109.503","0.001","90","","2423.5","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","trans-Bispyridine palladium methyl chloride","trans-Chloromethyldipyridinepalladium(II)","","- C11 H13 Cl N2 Pd -","- C11 H13 Cl N2 Pd -","- C88 H104 Cl8 N16 Pd8 -","8","1","BV6036","Gareth R. Owen; Mairi F. Haddow","<i>trans</i>-Chloromethyldipyridinepalladium(II)","Acta Crystallographica Section E","2005","61","12","m2651","m2652","10.1107/S1600536805037268","","","0.71073","MoKα","","0.0214","0.0189","","","0.0507","0.0515","","","","","","1.286","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207465","12.4689","0.001","13.0731","0.0011","13.3104","0.0011","106.408","0.002","101.908","0.001","114.895","0.001","1751.1","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","cis-Diaquabis(1,10-phenanthroline)manganese(II) 4-sulfonatobenzoate 6.5-hydrate","","- C31 H37 Mn N4 O13.5 S -","- C31 H32.5 Mn N4 O13.5 S -","- C62 H65 Mn2 N8 O27 S2 -","2","1","BV6037","Zhang, Li-Ping; Zhu, Long-Guan; Cai, Guo-Qiang","<i>cis</i>-Diaquabis(1,10-phenanthroline)manganese(II) 4-sulfonatobenzoate 6.5-hydrate","Acta Crystallographica Section E","2005","61","12","m2634","m2636","10.1107/S1600536805037001","","","0.71073","MoKα","","0.057","0.05","","","0.14","0.145","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2207466","9.5324","0.0009","13.6579","0.0012","14.4179","0.0013","109.4","0.001","103.369","0.001","90.738","0.001","1714.3","0.3","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","Hexaaquacadmium(II) tetraaquabis(hexamethylenetetramine)cadmium(II)] tetrakis(4-aminonaphthalene-1-sulfonate) hexahydrate","","- C52 H88 Cd2 N12 O28 S4 -","- C52 H88 Cd2 N12 O28 S4 -","- C52 H88 Cd2 N12 O28 S4 -","1","0.5","BV6040","Hongbin Zhou; Mingtian Li; Yu Ding; Shaomin Shi","Hexaaquacadmium(II) tetraaquabis(hexamethylenetetramine)cadmium(II) tetrakis(4-aminonaphthalene-1-sulfonate) hexahydrate","Acta Crystallographica Section E","2005","61","12","m2749","m2751","10.1107/S1600536805038821","","","0.71073","MoKα","","0.0527","0.0383","","","0.0819","0.0874","","","","","","0.963","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207467","26.732","0.0014","9.7504","0.0005","21.9268","0.0012","90","","125.989","0.001","90","","4624.3","0.4","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,5-Bis(2,2-diphenylethenyl)thiophene","","- C32 H24 S -","- C32 H24 S -","- C256 H192 S8 -","8","1","CF2001","Zeller, Matthias; Hunter, Allen D.; Hoefnagels, Roel; Geise, Herman; Blockhuys, Frank","2,5-Bis(2,2-diphenylethenyl)thiophene","Acta Crystallographica Section E","2005","61","12","o4183","o4184","10.1107/S1600536805037517","","","0.71073","MoKα","","0.0443","0.0387","","","0.1015","0.1056","","","","","","1.058","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207468","10.1554","0.0009","16.5088","0.0015","11.7903","0.0011","90","","97.154","0.002","90","","1961.3","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-[(Z)-Benzylidene]-2,3-diphenyl-2-azabicyclo[2.2.2]octan-5-one","","- C26 H23 N O -","- C26 H23 N O -","- C104 H92 N4 O4 -","4","1","CF2002","K. Ravikumar; B. Sridhar; M. Mahesh; V. V. Narayana Reddy","6-[(<i>Z</i>)-Benzylidene]-2,3-diphenyl-2-azabicyclo[2.2.2]octan-5-one","Acta Crystallographica Section E","2005","61","12","o4198","o4199","10.1107/S1600536805037530","","","0.71073","MoKα","","0.0878","0.0683","","","0.1363","0.1445","","","","","","1.177","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207469","9.297","0.003","15.673","0.005","24.329","0.009","90","","90","","90","","3545","2","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2,5-diiodophenyl acridine-9-carboxylate","","- C20 H11 I2 N O2 -","- C20 H11 I2 N O2 -","- C160 H88 I16 N8 O16 -","8","1","CF2003","Artur Sikorski; Karol Krzymiński; Agata Białońska; Tadeusz Lis; Jerzy Błażejowski","2,6-Diiodophenyl acridine-9-carboxylate","Acta Crystallographica Section E","2005","61","12","o4355","o4357","10.1107/S1600536805038729","","","0.71073","MoKα","","0.0694","0.0381","","","0.0879","0.0955","","","","","","1.02","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207470","10.436","0.003","10.542","0.003","11.756","0.004","78.135","0.004","73.553","0.004","67.874","0.004","1141.9","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-acetato-κ^4^O:O'-bis[bis(2,2'-bipyridine-κ^2^N,N')manganese(II)] bis(perchlorate)","","- C44 H38 Cl2 Mn2 N8 O12 -","- C44 H38 Cl2 Mn2 N8 O12 -","- C44 H38 Cl2 Mn2 N8 O12 -","1","0.5","CF6458","Xue-Li Niu; Jian-Min Dou; Chang-Wen Hu; Da-Cheng Li; Da-Qi Wang","Di-μ-acetato-κ^4^<i>O</i>:<i>O</i>'-bis[bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)] bis(perchlorate)","Acta Crystallographica Section E","2005","61","12","m2538","m2540","10.1107/S1600536805034367","","","0.71073","MoKα","","0.0895","0.0521","","","0.1201","0.1432","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207471","9.8043","0.001","15.1538","0.0016","18.8497","0.0019","104.648","0.002","102.068","0.002","101.456","0.002","2554.3","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dichloro-1κ<i>Cl</i>,3κ<i>Cl</i>-bis[μ-methylenebis(diphenylphosphine)]- 1:2κ^2^<i>P</i>:<i>P</i>';2:3κ^2^<i>P</i>:<i>P</i>'-trigold(I) perchlorate","","- C50 H44 Au3 Cl3 O4 P4 -","- C50 H44 Au3 Cl3 O4 P4 -","- C100 H88 Au6 Cl6 O8 P8 -","2","1","CF6461","Zhang, Tian-Le; Qin, Yu; Meng, Xiang-Gao","Dichloro-1κ<i>Cl</i>,3κ<i>Cl</i>-bis[μ-methylenebis(diphenylphosphine)]-1:2κ^2^<i>P</i>:<i>P</i>';2:3κ^2^<i>P</i>:<i>P</i>'-trigold(I) perchlorate","Acta Crystallographica Section E","2005","61","12","m2588","m2589","10.1107/S1600536805036500","","","0.71073","MoKα","","0.0754","0.0541","","","0.1568","0.1763","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207472","18.656","0.002","16.674","0.003","18.863","0.003","90","","90","","90","","5867.7","1.5","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,1-Diaqua-2,3,4,5,6-pentaisopropoxy-1-nickeladodecaborane","","- C15 H45 B11 Ni O7 -","- C15 H45 B11 Ni O7 -","- C120 H360 B88 Ni8 O56 -","8","1","CF6470","Li-Bin Wu; Jian-Min Dou; Qing-Liang Guo; Da-Cheng Li; Da-Qi Wang","1,1-Diaqua-2,3,4,5,6-pentaisopropoxy-1-nickeladodecaborane","Acta Crystallographica Section E","2005","61","12","m2585","m2587","10.1107/S1600536805036470","","","0.71073","MoKα","","0.1422","0.0513","","","0.1144","0.1685","","","","","","1.077","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207473","17.962","0.004","6.7649","0.0014","14.892","0.003","90","","95.22","0.03","90","","1802","0.7","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","poly[[tetraaquabarium(II)-di-μ-1H-imidazole-4,5-dicarboxylato] dihydrate]","","- C10 H18 Ba N4 O14 -","- C10 H18 Ba N4 O14 -","- C40 H72 Ba4 N16 O56 -","4","0.5","CF6471","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Zhao, Hui","A two-dimensional brick-wall layer barium(II) coordination polymer: poly[[tetraaquabarium(II)-di-μ-1<i>H</i>-imidazole-4,5-dicarboxylato] dihydrate]","Acta Crystallographica Section E","2005","61","12","m2488","m2490","10.1107/S1600536805035464","","","0.71073","MoKα","","0.0176","0.0161","","","0.0369","0.0374","","","","","","1.096","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207474","8.8057","0.0018","11.211","0.002","12.097","0.003","70.148","0.003","84.255","0.004","74.874","0.004","1084.3","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","10-Amino-9-(4-chlorophenyl)-3,3,6,6-tetramethyl-3,4,5,6,9,10- hexahydroacridine-1,8(2H,7H)-dione","","- C23 H27 Cl N2 O2 -","- C23 H27 Cl N2 O2 -","- C46 H54 Cl2 N4 O4 -","2","1","CF6472","Shujiang Tu; Jinpeng Zhang; Xiaotong Zhu; Jianing Xu; Qian Wang","10-Amino-9-(4-chlorophenyl)-3,3,6,6-tetramethyl-3,4,5,6,9,10-hexahydroacridine-1,8(2<i>H</i>,7<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","12","o4082","o4084","10.1107/S1600536805036482","","","0.71073","MoKα","","0.1926","0.0779","","","0.1346","0.1701","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207475","7.72","0.001","16.2","0.002","18.058","0.002","90","","90","","90","","2258.4","0.5","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5,5'-Dipropyl-1,1'-bis(2-nitrophenyl)-3,3'-bipyrazole","","- C24 H24 N6 O4 -","- C24 H24 N6 O4 -","- C96 H96 N24 O16 -","4","1","CF6473","Bouabdallah, Ibrahim; Ramdani, Abdelkrim; Zidane, Ismail; Eddike, Driss; Tillard, Monique; Belin, Claude","1,1'-Bis(2-nitrophenyl)-5,5'-dipropyl-3,3'-bipyrazole","Acta Crystallographica Section E","2005","61","12","o4243","o4245","10.1107/S1600536805037785","","","0.71073","MoKα","","0.1289","0.0759","","","0.1085","0.1259","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207476","21.923","0.004","14.532","0.003","14.82","0.003","90","","95.351","0.014","90","","4700.9","1.6","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","tris(1,10-phenanthroline)zinc(II) nitrate bis(glutaric acid) dihydrate","","- C46 H44 N8 O16 Zn -","- C46 H44 N8 O16 Zn -","- C184 H176 N32 O64 Zn4 -","4","0.5","CF6474","Aghabozorg, Hossein; Bahar Nakhjavan; Fatemeh Zabihi; Ramezanipour, Farshid; Aghabozorg, Hamid Reza","Infinite hydrogen-bonded chains in tris(1,10-phenanthroline)zinc(II) nitrate bis(glutaric acid) dihydrate","Acta Crystallographica Section E","2005","61","12","m2664","m2666","10.1107/S1600536805037633","","","0.71073","MoKα","","0.0619","0.0363","","","0.0634","0.0655","","","","","","0.985","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207477","8.4786","0.0007","8.4786","0.0007","59.562","0.009","90","","90","","120","","3708.1","0.7","295","2","","","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","","1,2-Bis[2-ethyl-5-(2,2-dicyanovinyl)-3-thienyl]-3,3,4,4,5,5- hexafluorocyclopent-1-ene","","- C25 H14 F6 N4 S2 -","- C25 H14 F6 N4 S2 -","- C150 H84 F36 N24 S12 -","6","0.5","CF6475","Pu, Shou-Zhi; Yang, Tian-She; Wang, Ru-Ji; Xu, Jing-Kun","1,2-Bis[5-(2,2-dicyanovinyl)-2-ethyl-3-thienyl]-3,3,4,4,5,5-hexafluorocyclopent-1-ene, a new photochromic diarylethene compound","Acta Crystallographica Section E","2005","61","12","o4077","o4079","10.1107/S1600536805036512","","","0.71073","MoKα","","0.0774","0.0486","","","0.1034","0.1179","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207478","11.8563","0.0015","13.7789","0.0018","15.281","0.002","81.368","0.009","82.348","0.009","82.442","0.009","2430.3","0.6","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","1-[2-Methyl-5-(2-fluorophenyl)-3-thienyl]-2-(2-methyl-5-phenyl-3-thienyl)- 3,3,4,4,5,5-hexafluorocyclopent-1-ene","","- C27 H17 F7 S2 -","- C27 H17 F7 S2 -","- C108 H68 F28 S8 -","4","2","CF6476","Pu, Shou-Zhi; Li, Gui-Zhen; Wang, Ru-Ji; Zhao, Ji-Quan","3,3,4,4,5,5-Hexafluoro-1-[2-methyl-5-(2-fluorophenyl)-3-thienyl]-2-(2-methyl-5-phenyl-3-thienyl)cyclopent-1-ene, a new photochromic dithienylethene","Acta Crystallographica Section E","2005","61","12","o4246","o4249","10.1107/S160053680503816X","","","0.71073","MoKα","","0.0993","0.0697","","","0.1319","0.1446","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207479","8.332","0.005","10.797","0.01","8.939","0.002","90","","116.56","0.03","90","","719.3","0.8","295","","295","2","","","","","","","","5","C 1 c 1","C -2yc","9","Zinc(II) Formaldehyde Sulfoxylate","Poly[di-μ~3~-hydroxymethanesulfinato-zinc(II)]","","- C2 H6 O6 S2 Zn -","- C2 H6 O6 S2 Zn -","- C8 H24 O24 S8 Zn4 -","4","1","CI6658","Masciocchi, Norberto; Rigamonti, Carlo; Maspero, Angelo","Poly[di-μ~3~-hydroxymethanesulfinato-zinc(II)]","Acta Crystallographica Section E","2005","61","12","m2683","m2685","10.1107/S1600536805038237","","","0.71073","MoKα","","0.0285","0.0283","","","0.0735","0.0738","","","","","","1.147","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207480","12.5579","0.001","20.3993","0.0017","13.2756","0.0011","90","","93.493","0.001","90","","3394.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(pyridine-kN)[salicylaldehyde (2-hydroxybenzoyl)hydrazonato-k^2^N,O]nickel(II) pyridine sesquisolvate","","- C36.5 H32.5 N6.5 Ni O3 -","- C36.5 H32.5 N6.5 Ni O3 -","- C146 H130 N26 Ni4 O12 -","4","1","CI6663","Zong-Qiu Hu; Wen-Hui Li; Yu Ding; Yu Wu","Tris(pyridine-κ<i>N</i>)[salicylaldehyde (2-hydroxybenzoyl)hydrazonato-κ^2^<i>N</i>,<i>O</i>]nickel(II) pyridine sesquisolvate","Acta Crystallographica Section E","2005","61","12","m2526","m2527","10.1107/S1600536805035701","","","0.71073","MoKα","","0.0671","0.0544","","","0.1451","0.1548","","","","","","1.025","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2207481","11.0871","0.0017","11.8713","0.0019","12.0846","0.0019","117.308","0.004","96.217","0.006","100.195","0.005","1357.9","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","N-(1-Cyanocyclohexyl)-1,2,3-benzothiadiazole-7-carboxamide","","- C14 H14 N4 O S -","- C14 H14 N4 O S -","- C56 H56 N16 O4 S4 -","4","2","CI6667","Feng-Li Liu; Zhi-Jin Fan; Hai-Bin Song; Xiu-Feng Liu; Yong-Gang Zhang","<i>N</i>-(1-Cyanocyclohexyl)-1,2,3-benzothiadiazole-7-carboxamide","Acta Crystallographica Section E","2005","61","12","o4054","o4055","10.1107/S160053680503607X","","","0.71073","MoKα","","0.0607","0.0391","","","0.0902","0.1031","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207482","7.96","0.003","5.4531","0.0017","12.142","0.004","90","","95.379","0.006","90","","524.7","0.3","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3S,4S)-4-Amino-5-phenylpentane-1,3-diol","","- C11 H17 N O2 -","- C11 H17 N O2 -","- C22 H34 N2 O4 -","2","1","CI6669","Tan, Bin; Fang, Hua; Huang, Rong-Bin; Wei, Zan-Bin; Jin, Li-Ren","(3<i>S</i>,4<i>S</i>)-4-Amino-5-phenylpentane-1,3-diol","Acta Crystallographica Section E","2005","61","12","o4382","o4383","10.1107/S1600536805036421","","","0.71073","MoKα","","0.0345","0.0342","","","0.0996","0.1001","","","","","","0.983","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207483","9.4105","0.0003","9.5397","0.0002","10.1276","0.0004","88.564","0.002","73.253","0.002","72.304","0.002","827.48","0.05","120","2","120","2","","","","","","","","6","P -1","-P 1","2","Trimethoprim fluoroborate","2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidinium fluoroborate","","- C14 H19 B F4 N4 O3 -","- C14 H19 B F4 N4 O3 -","- C28 H38 B2 F8 N8 O6 -","2","1","CI6673","Madhukar Hemamalini; Packianathan Thomas Muthiah; Daniel E. Lynch","Hydrogen-bonding patterns in trimethoprim tetrafluoroborate","Acta Crystallographica Section E","2005","61","12","o4107","o4109","10.1107/S1600536805036615","","","0.71073","MoKα","","0.0598","0.0491","","","0.1237","0.1322","","","","","","1.146","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207484","9.7282","0.0006","15.7656","0.001","15.1477","0.001","90","","98.183","0.006","90","","2299.6","0.3","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aquatris(nitrato-κ^2^O,O')(2,2':6,2''-terpyridine)praseodymium(III) acetone solvate","","- C18 H19 N6 O11 Pr -","- C18 H19 N6 O11 Pr -","- C72 H76 N24 O44 Pr4 -","4","1","CI6675","Charushnikova, Iraida A.; Den Auwer, Christophe","Aquatris(nitrato-κ^2^<i>O</i>,<i>O</i>')(2,2':6,2''-terpyridine)praseodymium(III) acetone solvate","Acta Crystallographica Section E","2005","61","12","m2514","m2516","10.1107/S1600536805035403","","","0.71073","MoKα","","0.0807","0.0453","","","0.0865","0.0978","","","","","","0.982","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207485","7.9168","0.0007","8.5941","0.0008","14.1572","0.0013","90.225","0.002","101.459","0.002","94.81","0.002","940.49","0.15","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","t(3),t(5)-Dimethyl N-nitroso-r(2),c(6)-bis(o-chlorophenyl)piperidine-4-one oxime.","","- C19 H19 Cl2 N3 O2 -","- C19 H19 Cl2 N3 O2 -","- C38 H38 Cl4 N6 O4 -","2","1","CI6677","Hema, R.; Parthasarathi, V.; Ravikumar, K.; Sridhar, B.; Pandiarajan, K.; Muthukumaran, G.","<i>r</i>-2,<i>c</i>-6-Bis(2-chlorophenyl)-<i>t</i>-3,<i>t</i>-5-dimethyl-1-nitrosopiperidin-4-one oxime","Acta Crystallographica Section E","2005","61","12","o3987","o3989","10.1107/S160053680503521X","","","0.71073","MoKα","","0.0409","0.0383","","","0.099","0.1008","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207486","10.8869","0.0009","6.1138","0.0005","17.3497","0.0014","90","","90.182","0.007","90","","1154.8","0.16","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tert-Butyl 4,4-dimethyl-5-oxo-1,3-oxazolidine-3-carboxylate","","- C10 H17 N O4 -","- C10 H17 N O4 -","- C40 H68 N4 O16 -","4","1","CI6678","D. Gayathri; D. Velmurugan; Kantharaju; V.V. Suresh Babu","<i>tert</i>-Butyl 4,4-dimethyl-5-oxo-1,3-oxazolidine-3-carboxylate","Acta Crystallographica Section E","2005","61","12","o4088","o4090","10.1107/S1600536805036068","","","0.71073","MoKα","","0.037","0.034","","","0.083","0.086","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207487","9.9029","0.0011","10.2823","0.0011","11.6261","0.0013","104.37","0.002","94.036","0.002","101.771","0.002","1113.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4'-(4-Bromobenzoyl)-1'-methyl-dispiro[indole-3(2H),2'-pyrrolidine- 3',3''(2''H)-indole]-2,2''-dione","","- C26 H20 Br N3 O3 -","- C26 H20 Br N3 O3 -","- C52 H40 Br2 N6 O6 -","2","1","CI6682","K. Palani; M. N. Ponnuswamy; A. R. Suresh Babu; R. Raghunathan; K. Ravikumar","4'-(4-Bromobenzoyl)-1'-methyldispiro[indole-3(2<i>H</i>),2'-pyrrolidine-3',3''(2''<i>H</i>)-indole]-2,2''-dione","Acta Crystallographica Section E","2005","61","12","o4254","o4256","10.1107/S1600536805037888","","","0.71073","MoKα","","0.0633","0.0429","","","0.1047","0.1143","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207488","9.795","0.006","10.316","0.006","11.67","0.007","104.275","0.009","93.998","0.01","102.305","0.009","1107.2","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4'-(4-Chlorobenzoyl)-1'-methyl-dispiro[indole-3(2H),2'-pyrrolidine- 3',3''(2''H)-indole]-2,2''-dione","","- C26 H20 Cl N3 O3 -","- C26 H20 Cl N3 O3 -","- C52 H40 Cl2 N6 O6 -","2","1","CI6683","K. Palani; M. N. Ponnuswamy; A. R. Suresh Babu; R. Raghunathan; M. Nethaji","4'-(4-Chlorobenzoyl)-1'-methyldispiro[indole-3(2<i>H</i>),2'-pyrrolidine-3',3''(2''<i>H</i>)-indole]-2,2''-dione","Acta Crystallographica Section E","2005","61","12","o4257","o4259","10.1107/S160053680503789X","","","0.71073","MoKα","","0.0481","0.0397","","","0.1018","0.1079","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207489","8.684","0.005","11.485","0.007","22.751","0.013","90","","90.852","0.01","90","","2269","2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4'-(4-Methoxybenzoyl)-1'-methyl-dispiro[indole-3(2H),2'-pyrrolidine- 3',3''(2''H)-indole]-2,2''-dione","","- C27 H23 N3 O4 -","- C27 H23 N3 O4 -","- C108 H92 N12 O16 -","4","1","CI6684","K. Palani; M. N. Ponnuswamy; A. R. Suresh Babu; R. Raghunathan; M. Nethaji","4'-(4-Methoxybenzoyl)-1'-methyldispiro[indole-3(2<i>H</i>),2'-pyrrolidine-3',3''(2''<i>H</i>)-indole]-2,2''-dione","Acta Crystallographica Section E","2005","61","12","o4260","o4262","10.1107/S1600536805037906","","","0.71073","MoKα","","0.1076","0.0741","","","0.1207","0.1296","","","","","","1.193","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207490","12.9203","0.0007","13.949","0.0011","8.7609","0.001","90","","92.502","0.001","90","","1577.4","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","6-(2,4-Difluorophenyl)-3-(4-methoxyphenyl)-7H-1,2,4-triazolo[3,4- b][1,3,4]thiadiazine","","- C17 H12 F2 N4 O S -","- C17 H12 F2 N4 O S -","- C68 H48 F8 N16 O4 S4 -","4","1","CI6687","Li-Xue Zhang; San-Nv Zhou; An-Jiang Zhang; Xin-Xiang Lei; Chang-Xiu Cai","6-(2,4-Difluorophenyl)-3-(4-methoxyphenyl)-7<i>H</i>-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazine","Acta Crystallographica Section E","2005","61","12","o4058","o4059","10.1107/S1600536805036160","","","0.71073","MoKα","","0.0603","0.0501","","","0.1132","0.1187","","","","","","1.105","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207491","23.4","0.003","8.1922","0.001","15.7447","0.0019","90","","127.465","0.002","90","","2395.6","0.5","273","2","273","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Dichlorobis[phosphonic tris(dimethylamide)]manganese(II)","","- C12 H36 Cl2 Mn N6 O2 P2 -","- C12 H36 Cl2 Mn N6 O2 P2 -","- C48 H144 Cl8 Mn4 N24 O8 P8 -","4","0.5","CI6688","Zhi Min Jin; Bing Tu; Ya Qin Li; Mei Chao Li","Dichlorobis[phosphonic tris(dimethylamide)]manganese(II)","Acta Crystallographica Section E","2005","61","12","m2510","m2511","10.1107/S1600536805035506","","","0.71073","MoKα","","0.0343","0.0325","","","0.0854","0.087","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207492","8.563","0.003","9.572","0.003","14.684","0.006","102.97","0.03","103.66","0.03","98.24","0.03","1114.9","0.7","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","3,3'-(1,4-Naphthalenedimethylene)bis(1-methylimidazolium) diiodide monohydrate","","- C20 H24 I2 N4 O -","- C20 H24 I2 N4 O -","- C40 H48 I4 N8 O2 -","2","1","CI6689","Lin-Hai Jing; Da-Bin Qin; Huan-Xia Zhang; Shao-Jin Gu; Zhi-Hua Mao","3,3'-(1,4-Naphthalenedimethylene)bis(1-methylimidazolium) diiodide monohydrate","Acta Crystallographica Section E","2005","61","12","o3992","o3993","10.1107/S1600536805035518","","","0.71073","MoKα","","0.0553","0.0315","","","0.0769","0.0834","","","","","","0.999","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207493","29.203","0.007","4.0724","0.001","16.679","0.004","90","","120.465","0.003","90","","1709.7","0.7","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 5-bromosalicylate","","- C8 H7 Br O3 -","- C8 H7 Br O3 -","- C64 H56 Br8 O24 -","8","1","CI6690","Xiao, Feng-Ping; Li, Fen-Fang; Jin, Long-Fei; Wu, Yong-Fei","Methyl 5-bromosalicylate","Acta Crystallographica Section E","2005","61","12","o4171","o4172","10.1107/S1600536805035567","","","0.71073","MoKα","","0.0478","0.0358","","","0.093","0.0993","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207494","14.983","0.001","13.587","0.001","25.143","0.002","90","","90","","90","","5118.5","0.7","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis[4-bromo-2-(cyclohexyliminomethyl)phenolato]zinc(II)","","- C26 H30 Br2 N2 O2 Zn -","- C26 H30 Br2 N2 O2 Zn -","- C208 H240 Br16 N16 O16 Zn8 -","8","1","CI6692","You, Zhong-Lu","Bis[4-bromo-2-(cyclohexyliminomethyl)phenolato]zinc(II)","Acta Crystallographica Section E","2005","61","12","m2493","m2494","10.1107/S160053680503552X","","","0.71073","MoKα","","0.1027","0.0514","","","0.1093","0.1306","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207495","10.759","0.001","11.108","0.001","12.439","0.001","113.74","0.01","104.39","0.01","94.99","0.01","1288.5","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[2-(cyclohexyliminomethyl)-4-nitrophenolato]zinc(II)","","- C26 H30 N4 O6 Zn -","- C26 H30 N4 O6 Zn -","- C52 H60 N8 O12 Zn2 -","2","1","CI6693","You, Zhong-Lu","Bis[2-(cyclohexyliminomethyl)-4-nitrophenolato]zinc(II)","Acta Crystallographica Section E","2005","61","12","m2495","m2496","10.1107/S1600536805035531","","","0.71073","MoKα","","0.0588","0.0469","","","0.1023","0.1084","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207496","11.363","0.001","16.873","0.002","11.266","0.001","90","","113.283","0.001","90","","1984.1","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[2-(cyclopropyliminomethyl)-4-nitrophenolato]zinc(II)","","- C20 H18 N4 O6 Zn -","- C20 H18 N4 O6 Zn -","- C80 H72 N16 O24 Zn4 -","4","1","CI6694","You, Zhong-Lu","Bis[2-(cyclopropyliminomethyl)-4-nitrophenolato]zinc(II)","Acta Crystallographica Section E","2005","61","12","m2497","m2498","10.1107/S1600536805035543","","","0.71073","MoKα","","0.0721","0.0548","","","0.1116","0.1197","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207497","23.574","0.002","7.926","0.001","24.264","0.002","90","","110.881","0.001","90","","4235.9","0.7","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[2,4-dichloro-6-(cyclopropyliminomethyl)phenolato]zinc(II)","","- C20 H16 Cl4 N2 O2 Zn -","- C20 H16 Cl4 N2 O2 Zn -","- C160 H128 Cl32 N16 O16 Zn8 -","8","1","CI6695","You, Zhong-Lu","Bis[2,4-dichloro-6-(cyclopropyliminomethyl)phenolato]zinc(II)","Acta Crystallographica Section E","2005","61","12","m2499","m2500","10.1107/S1600536805035555","","","0.71073","MoKα","","0.056","0.0406","","","0.0963","0.1045","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207498","23.26","0.002","13.305","0.002","13.119","0.003","90","","90","","90","","4060","1.2","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis[4-bromo-2-(cyclopropyliminomethyl)phenolato]zinc(II)","","- C20 H18 Br2 N2 O2 Zn -","- C20 H18 Br2 N2 O2 Zn -","- C160 H144 Br16 N16 O16 Zn8 -","8","1","CI6696","You, Zhong-Lu","Bis[4-bromo-2-(cyclopropyliminomethyl)phenolato]zinc(II)","Acta Crystallographica Section E","2005","61","12","m2501","m2502","10.1107/S1600536805035579","","","0.71073","MoKα","","0.1033","0.0431","","","0.0824","0.1016","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207499","8.4115","0.0003","9.6525","0.0003","23.3886","0.0008","90","","90","","90","","1898.97","0.11","150","1","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(S,S)-N,N'-Dicyanoethyl-1,2-(2-hydroxyphenyl)ethylenediamine","3,3'-[1,2-bis(2-hydroxyphenyl)ethane-1,2-diyldiimino]propanenitrile","","- C20 H22 N4 O2 -","- C20 H22 N4 O2 -","- C80 H88 N16 O8 -","4","1","CI6697","Chun, Cindy P.; Kim, Woosung; Kim, Hyunwoo; Chin, Jik; Lough, Alan J.","(<i>S</i>,<i>S</i>)-<i>N</i>,<i>N</i>'-Dicyanoethyl-1,2-(2-hydroxyphenyl)ethylenediamine","Acta Crystallographica Section E","2005","61","12","o4328","o4330","10.1107/S1600536805037876","","","0.71073","MoKα","","0.0607","0.0391","","","0.0864","0.0959","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207500","7.1217","0.0013","7.3672","0.0014","18.959","0.003","98.319","0.003","92.196","0.003","100.566","0.003","965.4","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Smeathxanthone A","2-(3,7-Dimethylocta-2,6-dienyl)-1,3,5,8-tetrahydroxyxanthone","","- C23 H24 O6 -","- C23 H24 O6 -","- C46 H48 O12 -","2","1","CI6698","M. Iqbal Choudhary; Rasheeda Swaleh; Shazia Anjum; Alain Meli Lannang; Shamsher Ali; Hoong-Kun Fun","2-(3,7-Dimethylocta-2,6-dienyl)-1,3,5,8-tetrahydroxyxanthone","Acta Crystallographica Section E","2005","61","12","o4313","o4315","10.1107/S1600536805038213","","","0.71073","MoKα","","0.0687","0.0564","","","0.1482","0.165","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207501","9.0963","0.0002","9.1215","0.0002","13.6215","0.0003","71.136","0.001","86.899","0.001","72.431","0.001","1018.42","0.04","297","2","297","2","","","","","","","","4","P -1","-P 1","2","Tetra-2-pyridylcarbohydrazone","N''-N'''-Bis(di-2-pyridylmethylene)carbonic dihydrazide","","- C23 H18 N8 O -","- C23 H18 N8 O -","- C46 H36 N16 O2 -","2","1","CI6701","E. Manoj; M. R. Prathapachandra Kurup; Hoong-Kun Fun; Suchada Chantrapromma","<i>N</i>''-<i>N</i>'''-Bis(di-2-pyridylmethylene)carbonic dihydrazide","Acta Crystallographica Section E","2005","61","12","o4110","o4112","10.1107/S1600536805036688","","","0.71073","MoKα","","0.0701","0.045","","","0.1014","0.1163","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207502","13.0748","0.0002","6.0256","0.0001","14.4306","0.0001","90","","109.79","0.001","90","","1069.75","0.03","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Zinc(II) bis[thiosemicarbazide] maleate","Bis(thiosemicarbazide)zinc(II) bis(maleate) dihydrate","","- C10 H24 N6 O12 S2 Zn -","- C10 H24 N6 O12 S2 Zn -","- C20 H48 N12 O24 S4 Zn2 -","2","0.5","CI6703","Sheng-Li Li; Jie-Ying Wu; Yu-Peng Tian; Hoong-Kun Fun; Suchada Chantrapromma","Bis(thiosemicarbazide)zinc(II) bis(maleate) dihydrate","Acta Crystallographica Section E","2005","61","12","m2701","m2703","10.1107/S1600536805038353","","","0.71073","MoKα","","0.0623","0.0507","","","0.1234","0.1276","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207503","12.3909","0.0009","11.167","0.0008","14.198","0.001","90","","100.991","0.001","90","","1928.5","0.2","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","r-2,c-6-Bis(4-chlorophenyl)-t-3,t-5-dimethyl-1-nitrosopiperidin-4-one oxime","","- C19 H19 Cl2 N3 O2 -","- C19 H19 Cl2 N3 O2 -","- C76 H76 Cl8 N12 O8 -","4","1","CI6706","Hema, R.; Parthasarathi, V.; Ravikumar, K.; Sridhar, B.; Pandiarajan, K.","<i>r</i>-2,<i>c</i>-6-Bis(4-chlorophenyl)-<i>t</i>-3,<i>t</i>-5-dimethyl-1-nitrosopiperidin-4-one oxime","Acta Crystallographica Section E","2005","61","12","o4345","o4347","10.1107/S1600536805038432","","","0.71073","MoKα","","0.0473","0.0418","","","0.1119","0.1168","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207504","7.9578","0.0013","7.0567","0.0012","15.642","0.003","90","","100.483","0.003","90","","863.7","0.3","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","t-3-Methyl-1-nitroso-r-2,c-6-diphenylpiperidin-4-one oxime monohydrate","","- C18 H21 N3 O3 -","- C18 H21 N3 O3 -","- C36 H42 N6 O6 -","2","1","CI6707","Hema, R.; Parthasarathi, V.; Ravikumar, K.; Pandiarajan, K.; Muthukumaran, G.","<i>t</i>-3-Methyl-1-nitroso-<i>r</i>-2,<i>c</i>-6-diphenylpiperidin-4-one oxime monohydrate","Acta Crystallographica Section E","2005","61","12","o4348","o4350","10.1107/S1600536805038444","","","0.71073","MoKα","","0.0526","0.0499","","","0.1337","0.1364","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207505","11.974","0.0008","8.7618","0.0004","16.9051","0.0012","90","","97.454","0.006","90","","1758.59","0.19","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[N-(2-hydroxyethyl)ethylenediamine-κ^3^N,N',O]nickel(II) squarate monohydrate","","- C12 H26 N4 Ni O7 -","- C12 H26 N4 Ni O7 -","- C48 H104 N16 Ni4 O28 -","4","1","CI6709","Ibrahim Uçar; Ahmet Bulut","Bis[<i>N</i>-(2-hydroxyethyl)ethylenediamine-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]nickel(II) squarate monohydrate","Acta Crystallographica Section E","2005","61","12","m2730","m2732","10.1107/S1600536805039036","","","0.71073","MoKα","","0.0518","0.0417","","","0.0902","0.0945","","","","","","1.058","","","","has coordinates","206183","2020-10-21","18:00:00",""
"2207506","5.9059","0.0001","23.3103","0.0003","18.4042","0.0002","90","","103.438","0.001","90","","2464.31","0.06","100","0.1","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Prunifoxanthone A","1,6,7-Trihydroxy-3-methoxy-2,8-bis(3-methyl-2-butenyl)-9H-xanthen-9-one chloroform solvate","","- C25 H27 Cl3 O6 -","- C25 H27 Cl3 O6 -","- C100 H108 Cl12 O24 -","4","1","CI6713","Nawong Boonnak; Suchada Chantrapromma; Hoong-Kun Fun; Chatchanok Karalai","1,6,7-Trihydroxy-3-methoxy-2,8-bis(3-methyl-2-butenyl)-9<i>H</i>-xanthen-9-one chloroform solvate","Acta Crystallographica Section E","2005","61","12","o4376","o4378","10.1107/S1600536805038900","","","0.71073","MoKα","","0.074","0.0634","","","0.2047","0.2183","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207507","7.979","0.006","9.222","0.004","9.653","0.005","75.54","0.04","69.18","0.05","65.39","0.04","599.3","0.7","291","2","291","2","","","","","","","","3","P -1","-P 1","2","","Dimethyl naphthalene-1,4-dicarboxylate","","- C14 H12 O4 -","- C14 H12 O4 -","- C28 H24 O8 -","2","1","CI6715","Lin-Hai Jing; Da-Bin Qin; Zhi-Hua Mao; Shao-Jin Gu; Huan-Xia Zhang","Dimethyl naphthalene-1,4-dicarboxylate","Acta Crystallographica Section E","2005","61","12","o4365","o4366","10.1107/S1600536805038894","","","0.71073","MoKα","","0.1261","0.0591","","","0.1625","0.1914","","","","","","0.942","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2207508","16.9406","0.0004","3.8619","0.0001","21.7968","0.0004","90","","106.52","0.01","90","","1367.15","0.09","297","2","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5-hydroxy-7,4'-dimethoxyflavone","5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one","","- C17 H14 O5 -","- C17 H14 O5 -","- C68 H56 O20 -","4","1","CI9676","Jeannie Bee Jan Teh; Hoong-Kun Fun; Abdul Razak Ibrahim; Suchada Chantrapromma; Nawong Boonnak; Chatchanok Karalai","5-Hydroxy-7-methoxy-2-(4-methoxyphenyl)-4<i>H</i>-1-benzopyran-4-one. Corrigendum","Acta Crystallographica, Section E","2005","61","12","e11","e11","10.1107/S1600536805037840","","","0.71073","MoKα","","0.0755","0.0462","","","0.1111","0.128","","","","","","1.046","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207509","5.1084","0.0008","11.5966","0.0018","18.166","0.003","90","","94.018","0.003","90","","1073.5","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-propyl 5-nitrosalicylate","","- C10 H11 N O5 -","- C10 H11 N O5 -","- C40 H44 N4 O20 -","4","1","CV6598","Li, Fen-Fang; Xiao, Feng-Ping; Xu, Zhao-Bing; Jin, Long-Fei; Guo, Qian-Li","1-Propyl 5-nitrosalicylate","Acta Crystallographica Section E","2005","61","12","o3994","o3995","10.1107/S1600536805035269","","","0.71073","MoKα","","0.1373","0.0561","","","0.128","0.1661","","","","","","0.968","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207510","8.0807","0.001","13.2419","0.0016","14.579","0.0018","68.321","0.002","83.256","0.002","78.163","0.002","1417.4","0.3","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Chlorobis(1,10-phenanthroline)copper(II) 2-carboxybenzenesulfonate monohydrat","","- C31 H23 Cl Cu N4 O6 S -","- C31 H23 Cl Cu N4 O6 S -","- C62 H46 Cl2 Cu2 N8 O12 S2 -","2","1","CV6600","Wei-Bing Zhang; Jia-Guo Wang; Han-Xiang Chen; Hong-Ping Xiao","Chlorobis(1,10-phenanthroline)copper(II) 2-carboxybenzenesulfonate monohydrate","Acta Crystallographica Section E","2005","61","12","m2559","m2560","10.1107/S1600536805036202","","","0.71073","MoKα","","0.0635","0.0543","","","0.1218","0.1269","","","","","","1.119","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207511","7.6594","0.0011","13.3257","0.0012","14.1456","0.0012","72.716","0.006","85.868","0.006","74.749","0.006","1330","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","2,2'-Diamino-4,4'-bi-1,3-thiazol-3,3'-diium bis(2,2'-diamino-4,4'-bi-1,3-thiazol-3-ium) tetrakis(2-nitrobenzoate)","","- C46 H38 N16 O16 S6 -","- C46 H38 N16 O16 S6 -","- C46 H38 N16 O16 S6 -","1","0.5","CV6601","Bing-Xin Liu; Jian-Yong Yu; Duan-Jun Xu","2,2'-Diamino-4,4'-bi-1,3-thiazol-3,3'-diium bis(2,2'-diamino-4,4'-bi-1,3-thiazol-3-ium) tetrakis(2-nitrobenzoate)","Acta Crystallographica Section E","2005","61","12","o4119","o4120","10.1107/S1600536805036561","","","0.71073","MoKα","","0.053","0.038","","","0.098","0.108","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207512","12.034","0.004","18.672","0.008","12.218","0.005","90","","107.67","0.03","90","","2615.8","1.8","298","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(dibenzylamine)silver(I) nitrate","","- C28 H30 Ag N3 O3 -","- C28 H30 Ag N3 O3 -","- C112 H120 Ag4 N12 O12 -","4","1","CV6602","Brito, Iván; López-Rodríguez, Matías; Vargas, Danitza; Cárdenas, Alejandro","Bis(dibenzylamine)silver(I) nitrate","Acta Crystallographica Section E","2005","61","12","m2626","m2628","10.1107/S1600536805037013","","","0.71073","MoKα","","","0.0462","","","","0.1021","","","","","","1.125","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207513","10.7261","0.0003","12.0606","0.0004","13.4213","0.0004","107.719","0.002","103.656","0.002","108.751","0.002","1454.81","0.09","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","2,8-Bis(3-phenylquinoxalin-2-yl)-5λ^6^-dibenzo[b,d]thiophene-5,5-dione","","- C40 H24 N4 O2 S -","- C40 H24 N4 O2 S -","- C80 H48 N8 O4 S2 -","2","1","CV6605","Tai-Hsiang Huang; Wha-Tzong Whang; Yuh-Sheng Wen; Jiann T. Lin","2,8-Bis(3-phenylquinoxalin-2-yl)-5λ^6^-dibenzo[<i>b</i>,<i>d</i>]thiophene-5,5-dione","Acta Crystallographica Section E","2005","61","12","o4126","o4127","10.1107/S1600536805037116","","","0.71073","MoKα","","0.0627","0.0372","","","0.0629","0.066","","","","","","0.817","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207514","9.7819","0.0003","13.3852","0.0003","14.471","0.0004","98.446","0.001","102.79","0.001","105.392","0.001","1738.31","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Bis{μ-dimethyl 1-[1-methoxycarbonyl-3-(methoxyoxalyl)-2-methylpropenyl]-3,3- dimethylcyclopropane-1,2- dicarboxylato(2-)}bis[(triphenylphosphine)palladium(II)] acetone solvate","","- C75 H80 O19 P2 Pd2 -","- C75 H80 O19 P2 Pd2 -","- C75 H80 O19 P2 Pd2 -","1","0.5","CV6607","Bolte, Michael; Rivas Nass, Andreas; Hashmi, A. Stephen K.","Bis{μ-dimethyl 1-[1-methoxycarbonyl-3-(methoxyoxalyl)-2-methylpropenyl]-3,3-dimethylcyclopropane-1,2-dicarboxylato(2‒)}bis[(triphenylphosphine)palladium(II)] acetone solvate","Acta Crystallographica Section E","2005","61","12","m2677","m2679","10.1107/S1600536805037839","","","0.71073","MoKα","","0.132","0.0589","","","0.1267","0.1556","","","","","","1.007","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207515","8.4871","0.0008","12.9037","0.0012","18.2256","0.0017","90","","90","","90","","1996","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Matrinium Tetrachloroferrate","","- C15 H25 Cl4 Fe N2 O -","- C15 H25 Cl4 Fe N2 O -","- C60 H100 Cl16 Fe4 N8 O4 -","4","1","DN6265","Zhi-Min Jin; Zu-Guang Li; Li Li; Mei-Chao Li; Mao-Lin Hu","Matrinium tetrachloroferrate(III)","Acta Crystallographica Section E","2005","61","12","m2466","m2468","10.1107/S1600536805035075","","","0.71073","MoKα","","0.0639","0.0544","","","0.1197","0.1228","","","","","","1.108","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207516","28.035","0.002","8.7132","0.0017","21.92","0.002","90","","112.92","0.03","90","","4931.8","1.6","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ-Aqua-κ^2^O:O-di-μ-phenylacetato-κ^2^O:O'-bis[(1,10-phenanthroline- κ^2^N,N')(phenylacetato-κO)cobalt(II)]","","- C56 H46 Co2 N4 O9 -","- C56 H46 Co2 N4 O9 -","- C224 H184 Co8 N16 O36 -","4","0.5","DN6266","Kong, Li-Li; Huo, Li-Hua; Gao, Shan; Zhao, Jing-Gui","μ-Aqua-κ^2^<i>O</i>:<i>O</i>-di-μ-phenylacetato-κ^4^<i>O</i>:<i>O</i>'-bis[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(phenylacetato-κ<i>O</i>)cobalt(II)]","Acta Crystallographica Section E","2005","61","12","m2485","m2487","10.1107/S1600536805035440","","","0.71073","MoKα","","0.0489","0.0362","","","0.0924","0.0983","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207517","11.2682","0.0007","14.1695","0.0009","16.0841","0.001","90","","90","","90","","2568.1","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3S,5R,6S,7S,10S,11R,15S,18R,19R)-5,10,19-triacetoxy-12,12- dimethyl-2-methylene-9,16-dioxapentacyclo [14.2.1.0^6,18^.0^7,11^.0^7,15^]nonadecane-1,17-dione","","- C26 H32 O10 -","- C26 H32 O10 -","- C104 H128 O40 -","4","1","DN6269","Shi, Hao","(3<i>S</i>,5<i>R</i>,6<i>S</i>,7<i>S</i>,10<i>S</i>,11<i>R</i>,15<i>S</i>,18<i>R</i>,19<i>R</i>)-12,12-Dimethyl-2-methylene-1,17-dioxo-9,16-dioxapentacyclo[14.2.1.0^6,18^.0^7,11^.0^7,15^]nonadeca-5,10,19-triyl triacetate","Acta Crystallographica Section E","2005","61","12","o3966","o3967","10.1107/S1600536805035099","","","0.71073","MoKα","","0.0648","0.0455","","","0.1033","0.1105","","","","","","0.963","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207518","10.1963","0.0005","14.0035","0.0007","32.1357","0.0017","90","","98.508","0.001","90","","4538","0.4","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Aqua(1,10-phenanthroline)[1,1,1-trifluoro-3-(2-thenoyl)acetonato]copper(II) (1,10-phenanthroline)(5-sulfonatosalicylato)[1,1,1-trifluoro- 3-(2-thenoyl)acetonato]copper(II)","","- C47 H30 Cu2 F6 N4 O11 S3 -","- C47 H30 Cu2 F6 N4 O11 S3 -","- C188 H120 Cu8 F24 N16 O44 S12 -","4","1","DN6270","Fan, Sai-Rong; Zhu, Long-Guan","Aqua(1,10-phenanthroline)[1,1,1-trifluoro-3-(2-thenoyl)acetonato]copper(II) (1,10-phenanthroline)(5-sulfonatosalicylato)[1,1,1-trifluoro-3-(2-thenoyl)acetonato]cuprate(II)","Acta Crystallographica Section E","2005","61","12","m2480","m2482","10.1107/S1600536805035452","","","0.71073","MoKα","","0.073","0.0568","","","0.1169","0.1244","","","","","","1.129","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207519","11.0058","0.0007","10.199","0.0007","12.7693","0.0008","90","","106.922","0.001","90","","1371.27","0.15","297","2","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Nigricin","4'-Hydroxy-5-methoxy-6,7-methylenedioxyisoflavone","","- C17 H12 O6 -","- C17 H12 O6 -","- C68 H48 O24 -","4","1","DN6271","Jeannie Bee-Jan Teh; Hoong-Kun Fun; Ibrahim Abdul Razak; Suad Naheed; M. Iqbal Choudhary; Shazia Anjum","4'-Hydroxy-5-methoxy-6,7-methylenedioxyisoflavone","Acta Crystallographica Section E","2005","61","12","o4310","o4312","10.1107/S1600536805036962","","","0.71073","MoKα","","0.0495","0.04","","","0.1044","0.1116","","","","","","1.053","","","","has coordinates,has Fobs","192347","2020-10-21","18:00:00",""
"2207520","11.9319","0.0008","14.3968","0.0009","15.3024","0.0009","116.811","0.003","108.353","0.003","95.164","0.004","2141.6","0.3","150","1","150","2","","","","","","","","5","P -1","-P 1","2","","Tris(1-cyclopropyl-6-methyl-2-N-methylaminocarbonyl-4-oxo-1,4-dihydropyridin- 4-olato)iron(III) dimethylformamide sesquisolvate dihydrate","","- C37.5 H53.5 Fe N7.5 O12.5 -","- C36 H50 Fe N7 O12 -","- C72 H100 Fe2 N14 O24 -","2","1","DN6272","Tam, Tim F.; Leung-Toung, Regis; Wang, Yingsheng; Spino, Michael; Lough, Alan J.","Tris(1-cyclopropyl-6-methyl-2-(<i>N</i>-methylaminocarbonyl)-4-oxo-1,4-dihydropyridin-4-olato)iron(III) dimethylformamide sesquisolvate dihydrate","Acta Crystallographica Section E","2005","61","12","m2601","m2603","10.1107/S1600536805036251","","","0.71073","MoKα","","0.0964","0.0619","","","0.1621","0.1761","","","","","","1.117","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2207521","14.6448","0.0015","12.4388","0.0012","13.2805","0.0014","90","","98.362","0.002","90","","2393.5","0.4","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 2,6-di-tert-butyl-4,8-dioxo-1,2,5,6-tetrahydro-2,3a,4a,6,7a,8a- hexaazacyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C20 H32 N6 O6 -","- C20 H32 N6 O6 -","- C80 H128 N24 O24 -","4","1","DN6273","Li, Yi-Tao; Wang, Zhi-Guo; Chen, Yun-Feng; Chen, Ai-Hua","Dimethyl 2,6-di-<i>tert</i>-butyl-4,8-dioxo-1,2,5,6-tetrahydro-2,3a,4a,6,7a,8a-hexaazacyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2005","61","12","o4128","o4129","10.1107/S1600536805037050","","","0.71073","MoKα","","0.0584","0.0492","","","0.1392","0.1478","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207522","16.896","0.002","8.3711","0.001","20.345","0.003","90","","90","","90","","2877.6","0.6","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3,6-Dibromo-9-isopropyl-9H-carbazole","","- C15 H13 Br2 N -","- C15 H13 Br2 N -","- C120 H104 Br16 N8 -","8","1","DN6274","Cui, Jian-Lan; Huang, Peng-Mian; Guo, Wen-Long","3,6-Dibromo-9-isopropyl-9<i>H</i>-carbazole","Acta Crystallographica Section E","2005","61","12","o4227","o4228","10.1107/S1600536805037372","","","0.71073","MoKα","","0.1088","0.0504","","","0.119","0.1439","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207523","7.3595","0.0008","9.2465","0.0014","20.323","0.003","90","","90","","90","","1383","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(R)-(+)-2,3-Methylenedioxy-8-oxoberbine","(R)-(+)-5,6,13,13a-tetrahydro-2,3-methylenedioxy-8H- dibenzo[a,g]quinolizin-8-one","","- C18 H15 N O3 -","- C18 H15 N O3 -","- C72 H60 N4 O12 -","4","1","DN6276","Gzella, Andrzej; Chrzanowska, Maria; Dreas, Agnieszka","(<i>R</i>)-(+)-2,3-Methylenedioxy-8-oxoberbine","Acta Crystallographica Section E","2005","61","12","o4165","o4166","10.1107/S1600536805037244","","","1.54178","CuKα","","0.035","0.0312","","","0.0842","0.0868","","","","","","1.049","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207524","9.761","0.002","12.891","0.003","10.901","0.002","90","","110.64","0.02","90","","1283.6","0.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Di-μ-chloro-bis[aqua(caffeine)chlorocopper(II)]","Di-μ-chloro-bis[aquachloro(3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6- dione)copper(II)]","","- C16 H24 Cl4 Cu2 N8 O6 -","- C16 H24 Cl4 Cu2 N8 O6 -","- C32 H48 Cl8 Cu4 N16 O12 -","2","0.5","DN6277","Zhi-Min Jin; Wen-Jie Feng; Li Li; Xin-Ju Ma; Dong-Shun Dun","Di-μ-chloro-bis[aqua(caffeine)chlorocopper(II)]","Acta Crystallographica Section E","2005","61","12","m2631","m2633","10.1107/S1600536805037104","","","0.71073","MoKα","","0.0534","0.0297","","","0.0572","0.0601","","","","","","0.803","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207525","10.1586","0.0009","14.4156","0.0013","11.9245","0.0011","90","","113.675","0.002","90","","1599.3","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Isopropyl-2-propoxy-5,6,7,8-tetrahydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one","","- C16 H22 N2 O2 S -","- C16 H22 N2 O2 S -","- C64 H88 N8 O8 S4 -","4","1","DN6278","Zeng, Xiao-Hua; Yuan, Ju-Zhen; Huang, Nian-Yu; Ding, Ming-Wu; He, Hong-Wu","3-Isopropyl-2-propoxy-5,6,7,8-tetrahydro-1-benzothieno[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","12","o4336","o4337","10.1107/S1600536805038158","","","0.71073","MoKα","","0.079","0.0501","","","0.1146","0.1256","","","","","","0.922","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207526","18.5563","0.0011","7.7666","0.0005","27.4354","0.0017","90","","90","","90","","3954","0.4","173","2","173","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","1,3-Bis(3,4,5-trimethoxyphenyl)-2,3-epoxypropanone","","- C21 H24 O8 -","- C21 H24 O8 -","- C168 H192 O64 -","8","1","DN6279","Cuthbertson, Timothy; Groy, Thomas L.; Rose, Seth D.","1,3-Bis(3,4,5-trimethoxyphenyl)-2,3-epoxypropanone: an anticancer chalcone epoxide","Acta Crystallographica Section E","2005","61","12","o4300","o4302","10.1107/S1600536805038328","","","0.71073","MoKα","","0.074","0.0632","","","0.1321","0.1368","","","","","","1.191","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207527","9.661","0.003","10.364","0.004","12.23","0.006","107.74","0.04","94.68","0.03","99.22","0.03","1140.1","0.9","225","2","225","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(2-methoxy-5-pyridyl)silane","","- C24 H24 N4 O4 Si -","- C24 H24 N4 O4 Si -","- C48 H48 N8 O8 Si2 -","2","1","ER6026","Saied, Okba; Maris, Thierry; Simard, Michel; Wuest, James D.","Tetrakis(2-methoxy-5-pyridyl)silane","Acta Crystallographica Section E","2005","61","12","o4136","o4138","10.1107/S1600536805036445","","","1.54178","CuKα","","0.0597","0.0574","","","0.1698","0.1726","","","","","","1.114","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207528","12.166","0.004","7.677","0.003","9.243","0.003","90","","96.613","0.006","90","","857.5","0.5","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-[4-(2,2-Dimethylpropionylamino)phenyl]-2,2-dimethylpropionamide","","- C16 H24 N2 O2 -","- C16 H24 N2 O2 -","- C32 H48 N4 O4 -","2","0.5","ER6031","Hui-Zhen Guo; Guo-Dong Yin; Neng-Fang She; An-Xin Wu","<i>N</i>-[4-(2,2-Dimethylpropionylamino)phenyl]-2,2-dimethylpropionamide","Acta Crystallographica Section E","2005","61","12","o4062","o4063","10.1107/S1600536805035993","","","0.71073","MoKα","","0.0905","0.0679","","","0.1608","0.1738","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207529","12.804","0.002","10.139","0.002","15.734","0.002","90","","96.703","0.011","90","","2028.6","0.6","110","","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","mer-(2,2'-Bipyridine)trichloro(tetramethylene sulfoxide)ruthenium(III) dichloromethane solvate","","- C15 H18 Cl5 N2 O Ru S -","- C15 H18 Cl5 N2 O Ru S -","- C60 H72 Cl20 N8 O4 Ru4 S4 -","4","1","ER6032","Srivastava, Radhey S.; Fronczek, Frank R.","<i>mer</i>-(2,2'-Bipyridine)trichloro(tetramethylene sulfoxide)ruthenium(III) dichloromethane solvate","Acta Crystallographica Section E","2005","61","12","m2572","m2574","10.1107/S1600536805036238","","","0.71073","MoKα","","0.077","0.041","","","0.077","0.086","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207530","10.6924","0.0004","19.6175","0.0007","16.5993","0.0006","90","","93.773","0.001","90","","3474.3","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1014mw KA-36-A","2-[1-(Benzylphenylphosphinothioyl)-2-phenylethyl]-2'-[(E)-2-chlorovinyl]- 1,1'-binaphthyl","","- C43 H34 Cl P S -","- C43 H34 Cl P S -","- C172 H136 Cl4 P4 S4 -","4","1","FL6185","Peter Kasák; Widhalm, Michael; Mereiter, Kurt","2-[1-(Benzylphenylphosphinothioyl)-2-phenylethyl]-2'-[(<i>E</i>)-2-chlorovinyl]-1,1'-binaphthyl","Acta Crystallographica Section E","2005","61","12","o4093","o4095","10.1107/S1600536805034033","","","0.71073","MoKα","","0.0541","0.0453","","","0.1137","0.1209","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207531","20.293","0.003","9.999","0.003","37.594","0.003","90","","91.53","0.01","90","","7625","3","299","2","299","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,2-bis[4-(p-chlorophenyl)-1,3-thiazol-2-yl]disulfane","","- C18 H10 Cl2 N2 S4 -","- C18 H10 Cl2 N2 S4 -","- C288 H160 Cl32 N32 S64 -","16","2","FL6195","Hartung, Jens; Daniel, Kristina; Schmidt, Philipp; Laug, Stefanie; Svoboda, Ingrid; Fuess, Hartmut","A polymorph of 1,2-bis[4-(4-chlorophenyl)-1,3-thiazol-2-yl]disulfane","Acta Crystallographica, Section E","2005","61","12","o3971","o3973","10.1107/S1600536805034859","","","0.71073","MoKα","","0.1098","0.0394","","","0.0943","0.1226","","","","","","0.993","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207532","22.643","0.002","5.702","0.002","15.315","0.003","90","","106.28","0.01","90","","1898","0.8","301","2","301","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,2-bis[4-(p-chlorophenyl)-1,3-thiazol-2-yl]disulfane","","- C18 H10 Cl2 N2 S4 -","- C18 H10 Cl2 N2 S4 -","- C72 H40 Cl8 N8 S16 -","4","1","FL6196","Hartung, Jens; Daniel, Kristina; Schmidt, Philipp; Laug, Stefanie; Svoboda, Ingrid; Fuess, Hartmut","1,2-Bis[4-(4-chlorophenyl)-1,3-thiazol-2-yl]disulfane","Acta Crystallographica, Section E","2005","61","12","o3974","o3976","10.1107/S1600536805034860","","","0.71093","MoKα","","0.1457","0.039","","","0.0924","0.1176","","","","","","0.967","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207533","10.5135","0.0005","10.5135","0.0005","41.618","0.003","90","","90","","90","","4600.2","0.5","299","2","273","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","Quininium S-2-chloro-n-butyrate","6'-methoxy (8α, 9R) Cinchonan-9-ol (2s)-2-chloro-Butanoate","","- C24 H31 Cl N2 O4 -","- C24 H31 Cl N2 O4 -","- C192 H248 Cl8 N16 O32 -","8","1","FL6199","Samas, Brian; Blackburn, Anthony C.; Kreuchauf, Kenneth C.","Quininium (<i>S</i>)-2-chloro-<i>n</i>-butyrate","Acta Crystallographica Section E","2005","61","12","o3983","o3984","10.1107/S1600536805035294","","","0.71073","MoKα","","0.0589","0.0507","","","0.1017","0.1051","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207534","7.4654","0.0002","9.9907","0.0003","20.3404","0.0005","90","","90","","90","","1517.08","0.07","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-α-methylbenzylammonium (R)-2-carboxymethyl-5-oxofuran-2-carboxylate","","- C15 H19 N O6 -","- C15 H19 N O6 -","- C60 H76 N4 O24 -","4","1","FL6200","Jia, Yun-Hua; Palmer, David R. J.; Quail, J. Wilson","The mono-(<i>S</i>)-α-methylbenzylammonium salt of (<i>R</i>)-homocitric lactone","Acta Crystallographica Section E","2005","61","12","o4034","o4036","10.1107/S1600536805034240","","","0.71073","MoKα","","0.0564","0.0417","","","0.0896","0.0972","","","","","","1.1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207535","10.114","0.002","6.5143","0.0014","19.311","0.004","90","","93.372","0.003","90","","1270.1","0.5","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5endo,6endo-di-(acetoxymethyl)-bicyclo[2.2.1]hept-2-ene","","- C13 H18 O4 -","- C13 H18 O4 -","- C52 H72 O16 -","4","1","FL6201","Lili Sun; Chunbao Li; Huiming Chen","5-<i>endo</i>,6-<i>endo</i>-Bis(acetoxymethyl)bicyclo[2.2.1]hept-2-ene","Acta Crystallographica, Section E","2005","61","12","3981","o3982","10.1107/S1600536805035051","","","0.71073","MoKα","","0.0715","0.0442","","","0.1106","0.1278","","","","","","1.004","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207536","7.028","0.004","7.981","0.005","9.69","0.006","90.414","0.008","90.672","0.007","105.677","0.007","523.2","0.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Tetraaquabis[5-(4-pyridyl)-1,3,4-oxadiazole-2-thiolato-κN^4^]zinc(II) dihydrate","","- C14 H20 N6 O8 S2 Zn -","- C14 H20 N6 O8 S2 Zn -","- C14 H20 N6 O8 S2 Zn -","1","0.5","FL6202","Xu, Hong Xia; Ma, Jian Ping; Huang, Ru Qi; Dong, Yu Bin","Tetraaquabis[5-(4-pyridyl)-1,3,4-oxadiazole-2-thiolato-κ<i>N</i>^4^]zinc(II) dihydrate","Acta Crystallographica Section E","2005","61","12","m2462","m2463","10.1107/S1600536805034987","","","0.71073","MoKα","","0.0267","0.0261","","","0.067","0.0674","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2207537","8.3102","0.0015","10.332","0.0016","13.995","0.002","84.549","0.013","79.701","0.015","72.128","0.012","1124.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aqua[N,N'-ethylenebis(5-nitrosalicylideneiminato)]methanolmanganese(III) perchlorate","","- C17 H18 Cl Mn N4 O12 -","- C17 H18 Cl Mn N4 O12 -","- C34 H36 Cl2 Mn2 N8 O24 -","2","1","HB2001","Butcher, Ray J.; Towns, William","Aqua[<i>N</i>,<i>N</i>'-ethylenebis(5-nitrosalicylideneiminato)]methanolmanganese(III) perchlorate","Acta Crystallographica Section E","2005","61","12","m2618","m2620","10.1107/S1600536805036913","","","0.71073","MoKα","","0.0941","0.0555","","","0.1277","0.1464","","","","","","1.027","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207538","15.563","0.002","12.975","0.002","16.486","0.003","90","","96.48","0.01","90","","3307.7","0.9","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetra-μ-6-methylpyridin-2-olato-ditungsten toluene sesquisolvate","","- C34.5 H36 N4 O4 W2 -","- C34.5 H36 N4 O4 W2 -","- C138 H144 N16 O16 W8 -","4","1","HB6284","Chisholm, Malcolm H.; Gallucci, Judith C.; Hollandsworth, Carl B.","Tetra-μ-6-methylpyridin-2-olato-ditungsten toluene sesquisolvate","Acta Crystallographica Section E","2005","61","12","m2503","m2504","10.1107/S1600536805035397","","","0.71073","MoKα","","0.0563","0.0344","","","0.0735","0.0805","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2207539","8.7183","0.0009","14.0994","0.0016","16.9212","0.0018","90","","100.9","0.002","90","","2042.5","0.4","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[diaquabis(1,10-phenanthroline)bis(μ~3~-5- sulfonatosalicylato)tricopper(II)] tetrahydrate]","","- C38 H34 Cu3 N4 O18 S2 -","- C38 H26 Cu3 N4 O18 S2 -","- C76 H52 Cu6 N8 O36 S4 -","2","0.5","HB6292","Fan, Sai-Rong; Zhu, Long-Guan","Poly[[diaquabis(1,10-phenanthroline)bis(μ~3~-5-sulfonatosalicylato)tricopper(II)] tetrahydrate]","Acta Crystallographica Section E","2005","61","12","m2556","m2558","10.1107/S1600536805036159","","","0.71073","MoKα","","0.081","0.051","","","0.109","0.116","","","","","","0.942","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"2207540","6.964","0.005","7.139","0.005","22.193","0.015","90","","90","","90","","1103.3","1.3","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(biguanido-κ^2^N,N')nickel(II) dihydrate","","- C4 H16 N10 Ni O2 -","- C4 H16 N10 Ni O2 -","- C16 H64 N40 Ni4 O8 -","4","0.5","HB6293","Su, Ying-Lan; Lu, Li-Ping; Zhu, Miao-Li","Bis(biguanido-κ^2^<i>N</i>,<i>N</i>')nickel(II) dihydrate","Acta Crystallographica Section E","2005","61","12","m2531","m2533","10.1107/S1600536805035944","","","0.71073","MoKα","","0.0541","0.0356","","","0.0813","0.0859","","","","","","0.886","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207541","9.445","0.003","16.72","0.005","13.474","0.004","90","","91.584","0.004","90","","2127","1.1","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichlorodiphenylbis(pyridine-κN)tin(IV)","","- C22 H20 Cl2 N2 Sn -","- C22 H20 Cl2 N2 Sn -","- C88 H80 Cl8 N8 Sn4 -","4","1","HB6294","Handong Yin; Shaowen Chen; Daqi Wang","Dichlorodiphenylbis(pyridine-κ<i>N</i>)tin(IV)","Acta Crystallographica Section E","2005","61","12","m2568","m2569","10.1107/S1600536805035956","","","0.71073","MoKα","","0.0987","0.0376","","","0.0763","0.1009","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207542","8.991","0.0018","10.475","0.002","11.441","0.002","93.72","0.03","97.55","0.03","111.96","0.03","983","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Bis(3,5-dimethylpyrazolium) bis(hydroxonium) β-octamolybdate(VI) diethanol solvate","","- C14 H36 Mo8 N4 O30 -","- C14 H36 Mo8 N4 O30 -","- C14 H36 Mo8 N4 O30 -","1","0.5","HB6295","Deng, Zhao-Peng; Gao, Shan; Huo, Li-Hua; Zhao, Hui","Bis(3,5-dimethylpyrazolium) bis(hydroxonium) β-octamolybdate(VI) ethanol disolvate","Acta Crystallographica Section E","2005","61","12","m2553","m2555","10.1107/S1600536805035968","","","0.71073","MoKα","","0.0277","0.0236","","","0.0603","0.0616","","","","","","1.103","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2207543","8.2088","0.0004","8.3132","0.0004","8.5259","0.0005","99.432","0.001","97.766","0.001","111.39","0.001","522.25","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(2-Acryloylaminophenyl)arsonic acid","","","- C9 H10 As N O4 -","- C9 H10 As N O4 -","- C18 H20 As2 N2 O8 -","2","1","HB6297","Herrera, Ana M.; García-Serrano, Jesús; Alvarado-Rodríguez, José A.; Rivas-Silva, José Francisco; Pal, Umapada","(2-Acryloylaminophenyl)arsonic acid","Acta Crystallographica Section E","2005","61","12","m2752","m2754","10.1107/S1600536805038857","","","0.71073","MoKα","","0.049","0.0382","","","0.0842","0.0882","","","","","","0.944","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2207544","9.1463","0.0005","10.7369","0.0006","10.9623","0.0007","113.685","0.001","93.418","0.001","95.906","0.001","974.58","0.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Bis[bis(4-aminopyridine-κN^1^)silver(I)] terephthalate decahydrate","","- C28 H48 Ag2 N8 O14 -","- C28 H48 Ag2 N8 O14 -","- C28 H48 Ag2 N8 O14 -","1","0.5","HB6298","Li, Yu-Guang; Zhu, Hai-Liang; Song, Yu; Ng, Seik Weng","Bis[bis(4-aminopyridine-κ<i>N</i>^1^)silver(I)] terephthalate decahydrate","Acta Crystallographica Section E","2005","61","12","m2564","m2565","10.1107/S160053680503597X","","","0.71073","MoKα","","0.036","0.032","","","0.095","0.109","","","","","","1.12","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2207545","8.964","0.002","11.174","0.003","22.689","0.006","90","","99.142","0.004","90","","2243.7","1","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[bis(tetrahydrofuran)lithium(I)]-μ-N-(2- isopropylphenyl)benzamidinato]","","- C24 H33 Li N2 O2 -","- C24 H33 Li N2 O2 -","- C96 H132 Li4 N8 O8 -","4","1","HB6300","Sheng-Di Bai; Jian-Ping Guo","<i>catena</i>-Poly[[bis(tetrahydrofuran)lithium(I)]-μ-<i>N</i>-(2-isopropylphenyl)benzamidinato]","Acta Crystallographica Section E","2005","61","12","m2726","m2727","10.1107/S1600536805038407","","","0.71073","MoKα","","0.0786","0.06","","","0.1372","0.1478","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207546","10.8602","0.0004","7.1828","0.0003","13.7933","0.0005","90","","101.584","0.002","90","","1054.05","0.07","299","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","hexaaqua[μ-di-μ-oxo-bis(hydroxodioxoiodate)]dieuropium(III) bis(perchlorate) dihydrate","","- Cl Eu H9 I O13 -","- Cl Eu H I O13 -","- Cl4 Eu4 H4 I4 O52 -","4","1","HB6301","Andreas Fischer","Hexaaqua[μ-di-μ-oxo-bis(hydroxodioxoiodate)]dieuropium(III) bis(perchlorate) dihydrate","Acta Crystallographica Section E","2005","61","12","i262","i264","10.1107/S1600536805035737","","","0.5608","AgKα","","0.039","0.031","","","0.073","0.077","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207547","19.9","0.003","16.809","0.002","7.66","0.002","90","","106.23","0.02","90","","2460.2","0.8","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[N-[4-(1H-benzimidazol-3-yl)butyl]benzimidazolium [[diiodobismuthate(III)]-di-μ~2~-iodo]]","","- C18 H19 Bi I4 N4 -","- C18 H19 Bi I4 N4 -","- C72 H76 Bi4 I16 N16 -","4","0.5","HB6302","Niu, Yun-Yin; Zhang, Ning; Hou, Hong-Wei; Ng, Seik Weng","<i>catena</i>-Poly[<i>N</i>-[4-(1<i>H</i>-benzimidazol-3-yl)butyl]benzimidazolium [[diiodobismuthate(III)]-di-μ~2~-iodo]]","Acta Crystallographica Section E","2005","61","12","m2534","m2535","10.1107/S1600536805035804","","","0.71073","MoKα","","0.032","0.029","","","0.069","0.07","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207548","9.3325","0.0005","17.6438","0.0009","10.3499","0.0005","90","","90","","90","","1704.22","0.15","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","catena-Poly[[diiodocadmium(II)]-μ-1,4-bis(1,2,4-triazol-1-ylmethyl)benzene- κN^4^:N^4'^]","","- C12 H12 Cd I2 N6 -","- C12 H12 Cd I2 N6 -","- C48 H48 Cd4 I8 N24 -","4","0.5","HB6303","Niu, Yun-Yin; Zhang, He-Li; Hou, Hong-Wei; Ng, Seik Weng","<i>catena</i>-Poly[[diiodocadmium(II)]-μ-1,4-bis(1,2,4-triazol-1-ylmethyl)benzene-κ^2^<i>N</i>^4^:<i>N</i>^4'^]","Acta Crystallographica Section E","2005","61","12","m2536","m2537","10.1107/S1600536805035816","","","0.71073","MoKα","","0.018","0.017","","","0.048","0.049","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207549","6.6435","0.0008","8.596","0.001","19.135","0.002","90","","90","","90","","1092.8","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Cyclohexylammonium dichloroacetate","","- C8 H15 Cl2 N O2 -","- C8 H15 Cl2 N O2 -","- C32 H60 Cl8 N4 O8 -","4","1","HG6248","Jian-Ping Wang; Xi-Xing Cheng; Jian-Ge Wang; Qing-Hua Chen","Cyclohexylammonium dichloroacetate","Acta Crystallographica Section E","2005","61","12","o4006","o4007","10.1107/S1600536805035324","","","0.71073","MoKα","","0.0328","0.0298","","","0.0766","0.0784","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207550","6.28","0.0013","8.665","0.0017","13.709","0.003","105.41","0.03","99.37","0.03","92.7","0.03","706.4","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis(triaquasodium) 2,5-dibenzoylterephthalate tetrahydrate","","- C22 H32 Na2 O16 -","- C22 H32 Na2 O16 -","- C22 H32 Na2 O16 -","1","0.5","HG6257","Wang, Dan-Dan; Zhu, Hong-Jun; Song, Guang-Liang; Wang, Jin-Tang","Bis(triaquasodium) 2,5-dibenzoylterephthalate tetrahydrate","Acta Crystallographica Section E","2005","61","12","m2610","m2612","10.1107/S1600536805036597","","","0.71073","MoKα","","0.0746","0.0564","","","0.1889","0.2046","","","","","","0.996","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207551","9.4528","0.0019","10.84","0.002","13.178","0.003","104.62","0.03","99.57","0.03","97.02","0.03","1269.2","0.5","289","2","289","2","","","","","","","","5","P -1","-P 1","2","","2-(2-Pyridyl)pyridinium bis(pyridine-2,6-dicarboxylato-κ^2^O^2^,O^6^)iron(III) trihydrate","","- C24 H21 Fe N4 O11 -","- C24 H21 Fe N4 O11 -","- C48 H42 Fe2 N8 O22 -","2","1","HG6258","Zhao Qi-Hua; Zhang, Mei-Su; Fang, Rui-Bing","2-(2-Pyridyl)pyridinium bis(pyridine-2,6-dicarboxylato-κ^2^<i>O</i>^2^,<i>O</i>^6^)iron(III) trihydrate","Acta Crystallographica Section E","2005","61","12","m2575","m2577","10.1107/S1600536805036469","","","0.71073","MoKα","","0.0331","0.0294","","","0.0868","0.0892","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207552","12.66","0.003","9.801","0.001","23.462","0.005","90","","96.01","0.01","90","","2895.2","1","294","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","catena-Poly[trimethyltin(IV)-μ-3,4-dichlorophenylacetato]","","- C11 H14 Cl2 O2 Sn -","- C11 H14 Cl2 O2 Sn -","- C88 H112 Cl16 O16 Sn8 -","8","1","HG6259","Saeed, M. Adeel; Craig, D. C.; Badshah, Amin; Ali, Saqib; Rauf, M. Khawar","<i>catena</i>-Poly[trimethyltin(IV)-μ-3,4-dichlorophenylacetato]","Acta Crystallographica Section E","2005","61","12","m2595","m2597","10.1107/S160053680503638X","","","0.71073","MoKα","","","0.043","","","","0.055","","","","","","1.79","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207553","8.1343","0.0004","8.352","0.0004","19.306","0.0009","90","","92.615","0.001","90","","1310.24","0.11","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis{μ-N-[bis(hydroxymethyl)(oxidomethyl)methyl]glycinato}[dimethyltin(IV)] dioxane hemisolvate","","- C18 H38 N2 O11 Sn2 -","- C18 H38 N2 O11 Sn2 -","- C36 H76 N4 O22 Sn4 -","2","0.5","HG6260","Fang, Xiao-Niu; Luo, Qiu-Yan; Zeng, Xi-Rui; Sui, Yan; Li, Xin-Fa","Bis{μ-<i>N</i>-[bis(hydroxymethyl)(oxidomethyl)methyl]glycinato}bis[dimethyltin(IV)] dioxane hemisolvate","Acta Crystallographica Section E","2005","61","12","m2604","m2606","10.1107/S1600536805036603","","","0.71073","MoKα","","0.0288","0.0272","","","0.0862","0.0878","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207554","24.151","0.01","6.503","0.003","12.39","0.005","90","","114.869","0.008","90","","1765.5","1.3","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","N,N'-Bis[4-(dimethylamino)benzylidene]ethane-1,2-diamine","","- C20 H26 N4 -","- C20 H26 N4 -","- C80 H104 N16 -","4","0.5","HG6262","Hong-Qing Hao; Hui Zhang","<i>N</i>,<i>N</i>'-Bis[4-(dimethylamino)benzylidene]ethane-1,2-diamine","Acta Crystallographica Section E","2005","61","12","o4274","o4275","10.1107/S1600536805037384","","","0.71073","MoKα","","0.0961","0.0791","","","0.2162","0.2303","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207555","7.3401","0.0015","11.688","0.002","19.841","0.004","90","","90","","90","","1702.2","0.6","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","alpha-Ferrocenyl-N-(1-phenylethyl)ethylamine","1-Ferrocenyl-N-(1-phenylethyl)ethylamine","","- C20 H23 Fe N -","- C20 H23 Fe N -","- C80 H92 Fe4 N4 -","4","1","HG6265","Qian, Heng-Yu; Cui, Xiu-Ling; Yin, Zhi-Gang","1-Ferrocenyl-<i>N</i>-(1-phenylethyl)ethylamine","Acta Crystallographica Section E","2005","61","12","m2641","m2642","10.1107/S1600536805037414","","","0.71073","MoKα","","0.0719","0.056","","","0.1233","0.1271","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207556","9.012","0.003","9.9","0.003","10.792","0.003","69.323","0.004","68.705","0.004","72.115","0.005","821.5","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","3-Methyl-1-p-tolyl-1H-pyrazol-5-yl 2-chlorobenzoate","","- C18 H15 Cl N2 O2 -","- C18 H15 Cl N2 O2 -","- C36 H30 Cl2 N4 O4 -","2","1","HG6266","Guo, Zhi-Xiong; Li, Jiang-Sheng; Fan, Mei-Lian","3-Methyl-1-<i>p</i>-tolyl-1<i>H</i>-pyrazol-5-yl 2-chlorobenzoate","Acta Crystallographica Section E","2005","61","12","o4080","o4081","10.1107/S160053680503641X","","","0.71073","MoKα","","0.0946","0.0449","","","0.1057","0.1323","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207557","8.5644","0.0014","9.4816","0.0016","11.7155","0.0019","79.093","0.003","73.925","0.003","75.318","0.003","877","0.3","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","5,5-Dimethyl-4-(3-nitrophenyl)-2-oxo-2-(2-pyridylamino)-1,3,2-dioxaphosphorinane","","- C16 H18 N3 O5 P -","- C16 H18 N3 O5 P -","- C32 H36 N6 O10 P2 -","2","1","HG6267","Yan Yu; Chang Liu; Xingyu Yang","5,5-Dimethyl-4-(3-nitrophenyl)-2-oxo-2-(2-pyridylamino)-1,3,2-dioxaphosphorinane","Acta Crystallographica Section E","2005","61","12","o4268","o4269","10.1107/S1600536805036627","","","0.71073","MoKα","","0.0597","0.0482","","","0.138","0.1612","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207558","16.844","0.002","7.308","0.0011","15.202","0.002","90","","104.964","0.002","90","","1807.8","0.4","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(2-Methylbenzoyl)-3-{5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}urea","","- C18 H13 F3 N4 O2 S -","- C18 H13 F3 N4 O2 S -","- C72 H52 F12 N16 O8 S4 -","4","1","HG6269","Tan, Xiao-Hong; Zhang, Zheng-Wen; Wang, Sheng; Song, Xin-Jian; Wang, Yan-Gang","1-(2-Methylbenzoyl)-3-{5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}urea","Acta Crystallographica Section E","2005","61","12","o4212","o4214","10.1107/S160053680503761X","","","0.71073","MoKα","","0.0617","0.0492","","","0.1324","0.148","","","","","","1.104","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207559","11.984","0.001","12.408","0.001","9.2792","0.0007","90","","102.74","0.01","90","","1345.82","0.19","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-Fluoro-N-(quinolin-8-yl)benzenesulfonamide","","- C15 H11 F N2 O2 S -","- C15 H11 F N2 O2 S -","- C60 H44 F4 N8 O8 S4 -","4","1","HG6273","da Silva, Luiz Everson; Joussef, Antonio Carlos; Foro, Sabine; Schmidt, Boris","4-Fluoro-<i>N</i>-(quinolin-8-yl)benzenesulfonamide","Acta Crystallographica Section E","2005","61","12","o4387","o4388","10.1107/S1600536805039188","","","1.5418","CuKα","","0.042","0.0349","","","0.0913","0.0961","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207560","6.875","0.0015","9.3471","0.0017","11.9198","0.0011","105.393","0.012","91.856","0.011","111.341","0.018","680.7","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Piperidinium picrate","","- C11 H14 N4 O7 -","- C11 H14 N4 O7 -","- C22 H28 N8 O14 -","2","1","HG6275","Kolandaivelu Saminathan; Chellamuthu Muthamizhchelvan; Kandasamy Sivakumar","Piperidinium picrate","Acta Crystallographica Section E","2005","61","12","o4379","o4381","10.1107/S1600536805039164","","","0.71073","MoKα","","0.0575","0.0403","","","0.1097","0.1212","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207561","14.94","0.004","8.262","0.002","13.236","0.004","90","","114.816","0.004","90","","1482.9","0.7","294","2","294","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","4,4'-Dihydroxy-5,5'-dimethoxy-3,3'-methylenedibenzaldehyde","","- C17 H16 O6 -","- C17 H16 O6 -","- C68 H64 O24 -","4","0.5","HK6055","Jiao, Gui-Li; Li, Xiao-Yan; Cao, Rui-Xia; Li, Min","6,6'-Dihydroxy-5,5'-dimethoxy-3,3'-methylenedibenzaldehyde","Acta Crystallographica Section E","2005","61","12","o4298","o4299","10.1107/S1600536805038146","","","0.71073","MoKα","","0.0833","0.04","","","0.1022","0.1254","","","","","","0.999","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207562","22.8042","0.0016","10.9268","0.0008","17.7465","0.0012","90","","125.562","0.001","90","","3597.3","0.4","292","2","292","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-(4-Methylphenyl)-2-morpholinobenzo[4,5]furo[3,2-d]pyrimidin-4(3H)-one","","- C21 H19 N3 O3 -","- C21 H19 N3 O3 -","- C168 H152 N24 O24 -","8","1","HK6056","Yong Sun; Yang-Gen Hu","3-(4-Methylphenyl)-2-morpholinobenzo[4,5]furo[3,2-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","12","o4233","o4235","10.1107/S1600536805037918","","","0.71073","MoKα","","0.073","0.0501","","","0.1222","0.132","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207563","6.2806","0.0008","9.9148","0.0012","13.6958","0.0016","90.813","0.01","97.042","0.01","108.051","0.009","803.53","0.18","296","","296","","","","","","","","","4","P -1","-P 1","2","","Methyl [6-amino-5-cyano-4-(4-methoxyphenyl)pyrano[2,3-c]pyrazol-3-yl]acetate","","- C17 H16 N4 O4 -","- C17 H16 N4 O4 -","- C34 H32 N8 O8 -","2","1","HK6057","Mehmet Akkurt; Sema Öztürk Yıldırım; Orhan Büyükgüngör; Edmont Stoyanov; Dieter Heber","Methyl [6-amino-5-cyano-4-(4-methoxyphenyl)pyrano[2,3-<i>c</i>]pyrazol-3-yl]acetate","Acta Crystallographica Section E","2005","61","12","o4206","o4208","10.1107/S1600536805037621","","","0.71073","MoKα","","0.0876","0.0553","","","0.1311","0.144","","","","","","1.026","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207564","7.275","0.002","17.27","0.006","15.342","0.005","90","","91.475","0.006","90","","1926.9","1.1","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-Hydroxyethyl)-13c-methoxy-1-oxo-1,13c- dihydrodibenzo[a,kl]xanthene-2-carboxamide","","- C24 H19 N O5 -","- C24 H19 N O5 -","- C96 H76 N4 O20 -","4","1","HK6058","Xiu-Zhen Wang; Zun-Le Xu; Dong-Sheng Deng; Zhao-Xuen Lian","<i>N</i>-(2-Hydroxyethyl)-13c-methoxy-1-oxo-1,13c-dihydrodibenzo[<i>a</i>,<i>kl</i>]xanthene-2-carboxamide","Acta Crystallographica Section E","2005","61","12","o4353","o4354","10.1107/S1600536805038468","","","0.71073","MoKα","","0.0539","0.0372","","","0.0957","0.1075","","","","","","1.023","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207565","13.9064","0.0009","8.7793","0.0006","17.4342","0.0012","90","","101.143","0.001","90","","2088.4","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(1H-1,2,3-Benzotriazol-1-ylmethyl)-1-benzoylethyl 4-ethylbenzoate","","- C24 H21 N3 O3 -","- C24 H21 N3 O3 -","- C96 H84 N12 O12 -","4","1","HK6059","Jun Wan; Zheng-Zhong Peng; Xue-Mei Li; Shu-Sheng Zhang","2-(1<i>H</i>-1,2,3-Benzotriazol-1-ylmethyl)-1-benzoylethyl 4-ethylbenzoate","Acta Crystallographica Section E","2005","61","12","o4218","o4219","10.1107/S1600536805037402","","","0.71073","MoKα","","0.0675","0.0509","","","0.1392","0.1534","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207566","5.6966","0.0014","16.098","0.004","7.4113","0.0018","90","","100.309","0.004","90","","668.7","0.3","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-[2-(3-Formylphenoxy)ethoxy]benzaldehyde","","- C16 H14 O4 -","- C16 H14 O4 -","- C32 H28 O8 -","2","0.5","HK6060","Han, Jian-Rong; Zhen, Xiao-Li","3-[2-(3-Formylphenoxy)ethoxy]benzaldehyde","Acta Crystallographica Section E","2005","61","12","o4250","o4251","10.1107/S1600536805038080","","","0.71073","MoKα","","0.0724","0.0428","","","0.1077","0.1299","","","","","","0.997","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207567","14.005","0.003","15.339","0.003","6.437","0.001","90","","90","","90","","1382.8","0.5","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Aquadichlorobis(2-chloropyridine-κN)copper(II)","","- C10 H10 Cl4 Cu N2 O -","- C10 H10 Cl4 Cu N2 O -","- C40 H40 Cl16 Cu4 N8 O4 -","4","0.5","IS6138","Zhi-Min Jin; Zu-Guang Li; Bing Tu; Zhen-Lu Shen; Mao-Lin Hu","Aquadichlorobis(2-chloropyridine-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2005","61","12","m2566","m2567","10.1107/S1600536805036019","","","0.71073","MoKα","","0.0484","0.0285","","","0.0551","0.0579","","","","","","0.968","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207568","10.019","0.002","12.952","0.003","14.798","0.003","90","","106.56","0.03","90","","1840.6","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[μ~2~-1,4-Bis(ethylthio)butane-S,S']dibromomercury(II)","","- C4 H9 Br2 Hg S -","- C4 H9 Br2 Hg S -","- C32 H72 Br16 Hg8 S8 -","8","1","IS6139","Liu, Chun-Bo; Che, Guang-Bo; Cui, Yun-Cheng; Li, Chuan-Bi","Poly[[μ-1,4-bis(ethylsulfanyl)butane-κ^2^<i>S</i>,<i>S</i>']di-μ-bromo-mercury(II)]","Acta Crystallographica Section E","2005","61","12","m2469","m2470","10.1107/S1600536805035348","","","0.71073","MoKα","","0.0466","0.0343","","","0.078","0.082","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207569","8.8011","0.0002","19.831","0.0004","7.0073","0.0001","90","","93.783","0.001","90","","1220.35","0.04","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3,5-Bis(2-hydroxyethyl)-4- oxahexacyclo[5.4.1.0^2,6^.0^3,10^.0^5,9^.0^8,11^]dodecane","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","IS6141","Kruger, Hendrik G.; Rademeyer, Melanie; Ramdhani, Reshika","3,5-Bis(2-hydroxyethyl)-4-oxahexacyclo[5.4.1.0^2,6^.0^3,10^.0^5,9^.0^8,11^]dodecane","Acta Crystallographica Section E","2005","61","12","o3968","o3970","10.1107/S1600536805034732","","","0.71073","MoKα","","0.0637","0.0487","","","0.1258","0.1362","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207570","5.0364","0.0013","16.716","0.004","23.04","0.006","90","","90","","90","","1939.7","0.8","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-[3-(4-Methoxybenzoyl)thiouredo]-3-phenylpropionic acid methanol solvate","","- C19 H22 N2 O5 S -","- C19 H22 N2 O5 S -","- C76 H88 N8 O20 S4 -","4","1","IS6142","Ngah, Nurziana; Jusoh, Asmizar; Yamin, Bohari M.","2-[3-(4-Methoxybenzoyl)thioureido]-3-phenylpropionic acid methanol solvate","Acta Crystallographica Section E","2005","61","12","o4307","o4309","10.1107/S1600536805035427","","","0.71073","MoKα","","0.092","0.079","","","0.133","0.137","","","","","","1.33","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207571","8.1925","0.0003","8.1925","0.0003","35.462","0.003","90","","90","","90","","2380.1","0.2","293","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","2-(2H-Benzotriazol-2-yl)-1-phenylethanone","","- C14 H11 N3 O -","- C14 H11 N3 O -","- C112 H88 N24 O8 -","8","1","IS6143","Shi-Ying Wang; Jun Wan; Bo Yang; Xue-Mei Li; Shu-Sheng Zhang","2-(2<i>H</i>-Benzotriazol-2-yl)-1-phenylethanone","Acta Crystallographica Section E","2005","61","12","o4056","o4057","10.1107/S1600536805036020","","","0.71073","MoKα","","0.0508","0.042","","","0.0936","0.0975","","","","","","1.197","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207572","16.403","0.0013","10.3467","0.0005","11.4251","0.0009","90","","100.052","0.006","90","","1909.3","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-6-{[1,3-Dihydroxy-2-(hydroxymethyl)propan-2-ylamino]methylene}- 2-methoxy-4-{(E)-[3-(trifluoromethyl)phenyl]diazenyl}cyclohexa-2,4-dienone","","- C19 H20 F3 N3 O5 -","- C19 H20 F3 N3 O5 -","- C76 H80 F12 N12 O20 -","4","1","IS6144","Ersanlı, Cem Cüneyt; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Kazak, Canan","(<i>Z</i>)-6-{[1,3-Dihydroxy-2-(hydroxymethyl)propan-2-ylamino]methylene}-2-methoxy-4-{(<i>E</i>)-[3-(trifluoromethyl)phenyl]diazenyl}cyclohexa-2,4-dienone","Acta Crystallographica Section E","2005","61","12","o4051","o4053","10.1107/S1600536805035415","","","0.71073","MoKα","","0.044","0.033","","","0.082","0.086","","","","","","1.04","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2207573","9.842","0.0016","12.501","0.002","17.696","0.003","80.269","0.003","81.207","0.003","76.412","0.003","2071.2","0.6","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","9-(2-pyridylmethyl)carbazole","","- C18 H14 N2 -","- C18 H14 N2 -","- C108 H84 N12 -","6","3","IS6145","Wang, Lei; Li, Jiang-Sheng; Zhao, Guang-Le; Huang, Peng-Mian; Zeng, Tao","9-(2-Pyridylmethyl)carbazole","Acta Crystallographica Section E","2005","61","12","o4060","o4061","10.1107/S1600536805036196","","","0.71073","MoKα","","0.0957","0.0453","","","0.1028","0.1312","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207574","10.5668","0.0009","17.8266","0.0015","14.9814","0.0013","90","","104.734","0.001","90","","2729.3","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N'-(2,4-Dichlorobenzylidene)benzohydrazide","","- C14 H10 Cl2 N2 O -","- C14 H10 Cl2 N2 O -","- C112 H80 Cl16 N16 O8 -","8","2","IS6146","Jing, Zuo-Liang; Wang, Xue-Yuan; Chen, Xin; Deng, Qi-Liang","<i>N</i>'-(2,4-Dichlorobenzylidene)benzohydrazide","Acta Crystallographica Section E","2005","61","12","o4316","o4317","10.1107/S1600536805038420","","","0.71073","MoKα","","0.0791","0.0436","","","0.1025","0.1153","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207575","11.7686","0.001","13.4861","0.0011","11.2137","0.001","90","","112.552","0.002","90","","1643.7","0.2","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(2-Aminophenyl)-2-methylsulfanyl-5,6,7,8- tetrahydrobenzothieno[2,3-d]pyrimidin-4(3H)-one","","- C17 H17 N3 O S2 -","- C17 H17 N3 O S2 -","- C68 H68 N12 O4 S8 -","4","1","IS6148","Zeng, Xiao-Hua; Wang, Hong-Mei; Luo, Zai-Gang; Ding, Ming-Wu; He, Hong-Wu","3-(2-Aminophenyl)-2-methylsulfanyl-5,6,7,8-tetrahydrobenzothieno[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","12","o4160","o4161","10.1107/S1600536805037025","","","0.71073","MoKα","","0.1097","0.0605","","","0.1334","0.155","","","","","","0.985","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207576","26.462","0.015","9.566","0.006","16.159","0.009","90","","115.155","0.006","90","","3702","4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 2-oxopropyl 1,4-dihydro-2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylate","","- C19 H20 N2 O7 -","- C19 H20 N2 O7 -","- C152 H160 N16 O56 -","8","1","IS6149","Xue-Yuan Wang; Ming-Jie Zhang; Xiang-Qian Wang; Yu-Min Nie","Acetonyl methyl 1,4-dihydro-2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2005","61","12","o4287","o4288","10.1107/S1600536805038456","","","0.71073","MoKα","","0.0588","0.0415","","","0.109","0.1184","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207577","6.1848","0.0016","14.685","0.005","19.097","0.005","90","","95.439","0.01","90","","1726.7","0.9","296","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionohydrazide","","- C17 H28 N2 O2 -","- C17 H28 N2 O2 -","- C68 H112 N8 O8 -","4","1","IS6150","Xu, Wei-Ming; Hu, Xiu-Rong; Gu, Jian-Ming","3-(3,5-Di-<i>tert</i>-butyl-4-hydroxyphenyl)propionohydrazide","Acta Crystallographica Section E","2005","61","12","o4190","o4191","10.1107/S1600536805037426","","","0.71075","MoKα","","","0.0412","","","","0.0842","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207578","8.7109","0.0014","10.8764","0.0017","11.251","0.0018","106.481","0.003","90.471","0.003","100.828","0.003","1001.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-[N-(2-Ethoxyphenyl)carbamoylmethoxy]-N-(2-pyridylmethyl)benzamide","","- C23 H23 N3 O4 -","- C23 H23 N3 O4 -","- C46 H46 N6 O8 -","2","1","IS6157","Yong-Hong Wen; Xue-Mei Li; Shu-Sheng Zhang; Mao-Jie Li","2-[<i>N</i>-(2-Ethoxyphenyl)carbamoylmethoxy]-<i>N</i>-(2-pyridylmethyl)benzamide","Acta Crystallographica Section E","2005","61","12","o4333","o4335","10.1107/S1600536805038614","","","0.71073","MoKα","","0.0685","0.0516","","","0.1104","0.1205","","","","","","1.072","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207579","21.3","0.008","7.756","0.003","15.227","0.006","90","","90","","90","","2515.5","1.7","298","2","298","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","4-Acetylphenyl phenyl sulfone","","- C14 H12 O3 S -","- C14 H12 O3 S -","- C112 H96 O24 S8 -","8","1","JH6019","Guo, Shengrong; Yuan, Yanqin","4-Acetylphenyl phenyl sulfone","Acta Crystallographica Section E","2005","61","12","o4032","o4033","10.1107/S1600536805034252","","","0.71073","MoKα","","0.0489","0.0445","","","0.1157","0.1194","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207580","9.842","0.003","15.29","0.005","19.434","0.006","90","","90","","90","","2924.5","1.6","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-[2-(Aminosulfonyl)-5,6-dihydro-6-methyl-7,7-dioxo-4H-thieno[2,3-b]thiopyran- 4-yl]acetamide","","- C10 H14 N2 O5 S3 -","- C10 H14 N2 O5 S3 -","- C80 H112 N16 O40 S24 -","8","1","JH6024","Zhen-Guang Zou; Peng Guo; Yin-Xiang Lu","<i>N</i>-[2-(Aminosulfonyl)-5,6-dihydro-6-methyl-7,7-dioxo-4<i>H</i>-thieno[2,3-<i>b</i>]thiopyran-4-yl]acetamide","Acta Crystallographica Section E","2005","61","12","o4096","o4098","10.1107/S1600536805036718","","","0.71073","MoKα","","0.0749","0.0393","","","0.1053","0.1135","","","","","","0.959","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207581","12.1518","0.0014","7.2055","0.0005","15.6894","0.0014","90","","90.212","0.008","90","","1373.8","0.2","122","1","122","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","trichloro(tmtacn)chromium(III)","Trichloro(1,4,7-trimethyl-1,4,7-triazacyclononane)chromium(III)","","- C9 H21 Cl3 Cr N3 -","- C9 H21 Cl3 Cr N3 -","- C36 H84 Cl12 Cr4 N12 -","4","1","JH6025","Klitgaard, Søren Kegnaes; Magnussen, Magnus","Trichloro(1,4,7-trimethyl-1,4,7-triazacyclononane)chromium(III)","Acta Crystallographica Section E","2005","61","12","m2616","m2617","10.1107/S1600536805037086","","","0.71073","MoKα","","0.0444","0.0274","","","0.0547","0.0603","","","","","","1.124","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207582","10.7801","0.0008","12.7006","0.0009","12.1039","0.0009","90","","96.973","0.001","90","","1644.9","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]- 4-(trifluoromethylsulfanyl)-1H-pyrazole-3-carbonitrile","","- C12 H4 Cl2 F6 N4 S -","- C12 H4 Cl2 F6 N4 S -","- C48 H16 Cl8 F24 N16 S4 -","4","1","KP6064","Tang, Riyuan; Zhong, Ping; Lin, Qiulian; Hu, Maolin; Shi, Qian","5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfanyl)-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","12","o4374","o4375","10.1107/S1600536805039280","","","0.71073","MoKα","","0.0527","0.0471","","","0.1099","0.1135","","","","","","1.098","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207583","14.992","0.003","5.002","0.0011","21.237","0.004","90","","93.375","0.004","90","","1589.8","0.6","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-Hydroxy-1-phenyl-3-(3,4,5-trimethoxylphenyl)propan-1-one","","- C18 H20 O5 -","- C18 H20 O5 -","- C72 H80 O20 -","4","1","KP6066","Zhifang Yu; Zhimin Zhao; Bing Zhao; Jianwei Sun","3-Hydroxy-1-phenyl-3-(3,4,5-trimethoxyphenyl)propan-1-one","Acta Crystallographica Section E","2005","61","12","o4075","o4076","10.1107/S160053680503610X","","","0.71073","MoKα","","0.0927","0.0455","","","0.1017","0.1201","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207584","9.5843","0.0005","17.8784","0.0009","10.6912","0.0006","90","","93.094","0.001","90","","1829.29","0.17","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[aqua(2,2'-bipyridine)copper(II)]-μ-3-sulfonatobenzoato] monohydrate]","","- C17 H16 Cu N2 O7 S -","- C17 H16 Cu N2 O7 S -","- C68 H64 Cu4 N8 O28 S4 -","4","1","KP6068","Miao, Xiao-He; Xiao, Hong-Ping; Zhu, Long-Guan","<i>catena</i>-Poly[[[aqua(2,2'-bipyridine)copper(II)]-μ-3-sulfonatobenzoato] monohydrate]","Acta Crystallographica Section E","2005","61","12","m2561","m2563","10.1107/S1600536805036184","","","0.71073","MoKα","","0.036","0.032","","","0.083","0.085","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207585","11.084","0.004","15.12","0.005","8.133","0.003","90","","109.77","0.03","90","","1282.7","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 1-acetonyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylate","","- C14 H13 N O5 -","- C14 H13 N O5 -","- C56 H52 N4 O20 -","4","1","KP6069","Shishkina, Svetlana V.; Shishkin, Oleg V.; Ukrainets, Igor V.; Sidorenko, Lyudmila V.","Methyl 1-acetonyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylate","Acta Crystallographica Section E","2005","61","12","o4180","o4182","10.1107/S1600536805037463","","","0.71073","MoKα","","0.2255","0.0489","","","0.1028","0.1384","","","","","","0.876","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207586","12.408","0.001","6.4174","0.0006","15.004","0.002","90","","90","","90","","1194.7","0.2","291","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,3-Di-4-pyridylbutane-2,3-diol","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C56 H64 N8 O8 -","4","0.5","LH2001","Niu, Yun-Yin; Liu, Xiu-Cun; Zain, Sharifuddin M.; Ng, Seik Weng","2,3-Di-4-pyridylbutane-2,3-diol","Acta Crystallographica Section E","2005","61","12","o4303","o4304","10.1107/S1600536805038250","","","0.71073","MoKα","","0.054","0.037","","","0.091","0.103","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207587","6.2189","0.0012","6.4643","0.0013","12.79","0.003","90","","101.8","0.03","90","","503.3","0.19","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-(Aminocarbonyl)ethylammonium hydrogensquarate monohydrate","","- C7 H12 N2 O6 -","- C7 H12 N2 O6 -","- C14 H24 N4 O12 -","2","1","LH6527","Tsonko Kolev; Michael Spiteller; William S. Sheldrick; Heike Mayer-Figge","1-(Aminocarbonyl)ethylammonium hydrogensquarate monohydrate","Acta Crystallographica Section E","2005","61","12","o4292","o4294","10.1107/S1600536805038079","","","0.71073","MoKα","","0.0687","0.0493","","","0.1218","0.1344","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207588","8.395","0.001","10.055","0.001","13.157","0.002","89.336","0.002","82.842","0.002","72.231","0.001","1049","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ~2~-3-hydroxypyridine-2-carboxylato-κ^2^O,N)di-μ~3~oxo- tetrakis[dimethyltin(IV)]","","- C32 H40 N4 O14 Sn4 -","- C32 H40 N4 O14 Sn4 -","- C32 H40 N4 O14 Sn4 -","1","0.5","LH6528","Tian, Guang-Ru; Zhang, Ru-Fen; Ma, Chun-Lin; Ng, Seik Weng","Tetrakis(μ~2~-3-hydroxypyridine-2-carboxylato-κ^2^<i>O</i>,<i>N</i>)di-μ~3~oxo-tetrakis[dimethyltin(IV)]","Acta Crystallographica Section E","2005","61","12","m2528","m2530","10.1107/S1600536805035907","","","0.71073","MoKα","","0.056","0.037","","","0.096","0.114","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207589","5.8324","0.0004","9.1911","0.0006","23.042","0.002","90","","90","","90","","1235.19","0.16","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(E)-2-[(2-morpholinoethylimino)methyl]phenol","","- C13 H18 N2 O2 -","- C13 H18 N2 O2 -","- C52 H72 N8 O8 -","4","1","LH6532","Petek, Hande; Albayrak, Çiğdem; Nazan Ocak İskeleli; Ağar, Erbil; Şenel, İsmet","(<i>E</i>)-2-[(2-Morpholinoethylimino)methyl]phenol","Acta Crystallographica Section E","2005","61","12","o3990","o3991","10.1107/S1600536805034847","","","0.71073","MoKα","","0.0346","0.0323","","","0.0842","0.0853","","","","","","1.122","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207590","20.337","0.003","4.571","0.0006","18.456","0.003","90","","90","","90","","1715.7","0.4","294","2","294","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","3,6-Dibromo-9-hexyl-9H-carbazole","","- C18 H19 Br2 N -","- C18 H19 Br2 N -","- C72 H76 Br8 N4 -","4","1","LH6533","Duan, Xue-Min; Huang, Peng-Mian; Li, Jiang-sheng; Zheng, Peng-Wu; Zeng, Tao","3,6-Dibromo-9-hexyl-9<i>H</i>-carbazole","Acta Crystallographica Section E","2005","61","12","o3977","o3978","10.1107/S1600536805035282","","","0.71073","MoKα","","0.0937","0.0465","","","0.1014","0.1174","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207591","7.828","0.002","7.261","0.002","16.445","0.004","90","","94.499","0.005","90","","931.8","0.4","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-[4-(5-Formyl-2-methoxyphenoxy)butoxy]-4-methoxybenzaldehyde","","- C20 H22 O6 -","- C20 H22 O6 -","- C40 H44 O12 -","2","0.5","LH6534","Han, Jian-Rong; Zhen, Xiao-Li","3-[4-(5-Formyl-2-methoxyphenoxy)butoxy]-4-methoxybenzaldehyde","Acta Crystallographica Section E","2005","61","12","o4049","o4050","10.1107/S1600536805036135","","","0.71073","MoKα","","0.0971","0.049","","","0.1134","0.1308","","","","","","1.138","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207592","9.9452","0.0007","11.6962","0.0009","12.7037","0.0009","90.48","0.003","102.645","0.003","102.501","0.002","1405.27","0.18","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","2-Phenyl-3-[6-(3-phenylquinoxalin-2-yl)dibenzo[b,d]thiophen-3-yl]quinoxaline","","- C40 H24 N4 S -","- C40 H24 N4 S -","- C80 H48 N8 S2 -","2","1","LH6536","Huang, Tai-Hsiang; Whang, Wha-Tzong; Wen, Yuh-Sheng; Lin, Jiann T.","2-Phenyl-3-[6-(3-phenylquinoxalin-2-yl)dibenzo[<i>b</i>,<i>d</i>]thiophen-3-yl]quinoxaline","Acta Crystallographica Section E","2005","61","12","o4236","o4237","10.1107/S1600536805037700","","","0.71073","MoKα","","0.0886","0.0593","","","0.1692","0.1785","","","","","","1.092","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207593","9.3023","0.0002","25.5447","0.0007","10.3794","0.0002","90","","113.766","0.0013","90","","2257.25","0.09","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Methyl-4-(4-nitrophenyl)-1-phenyl-1,7-dihydro-6H- pyrazolo[3,4-b]thiazolo[5,4-e]pyridine-6- thione‒dimethylformamide (1/1)","","- C23 H20 N6 O3 S2 -","- C23 H20 N6 O3 S2 -","- C92 H80 N24 O12 S8 -","4","1","LH6537","Delgado, Paula; Cruz, Silvia; Cobo, Justo; Low, John N.; Glidewell, Christopher","3-Methyl-4-(4-nitrophenyl)-1-phenyl-1,7-dihydro-6<i>H</i>-pyrazolo[3,4-<i>b</i>]thiazolo[5,4-<i>e</i>]pyridine-6-thione‒dimethylformamide (1/1)","Acta Crystallographica Section E","2005","61","12","o3998","o4000","10.1107/S1600536805035270","","","0.71073","MoKα","","0.0682","0.0509","","","0.1302","0.1409","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207594","9.5296","0.0017","13.411","0.003","28.434","0.005","90","","94.443","0.004","90","","3623","1.2","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,6-Di-tert-butyl-4-(isopropylaminomethyl)phenol","","- C18 H31 N O -","- C18 H31 N O -","- C144 H248 N8 O8 -","8","2","LH6538","Xue-Gui Shu; Zeng, Tao; Chen, Li-Gong; Yan, Fan-Yong; Zhang, Yue-Cheng","2,6-Di-<i>tert</i>-butyl-4-(isopropylaminomethyl)phenol","Acta Crystallographica Section E","2005","61","12","o4192","o4194","10.1107/S160053680503727X","","","0.71073","MoKα","","0.1794","0.0555","","","0.1156","0.1664","","","","","","0.986","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207595","9.691","0.003","5.2631","0.0017","17.297","0.006","90","","90.752","0.005","90","","882.2","0.5","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","5-Ethyl L-glutamate","","- C7 H13 N O4 -","- C7 H13 N O4 -","- C28 H52 N4 O16 -","4","2","LH6541","Wu, Yong-Fei; Xiao Fengping; Jin, Long-Fei; Li, Fen-Fang; Dai, Xu-Ya","5-Ethyl <small>L</small>-glutamate","Acta Crystallographica Section E","2005","61","12","o4028","o4029","10.1107/S1600536805035919","","","0.71073","MoKα","","0.0748","0.0602","","","0.1636","0.1778","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207596","8.26","0.001","9.706","0.001","7.77","0.001","90","","117.45","0.01","90","","552.8","0.12","173","2","173","2","","","","","","","","3","P 1 c 1","P -2yc","7","","Dimethyl dipropargylmalonate","","- C11 H12 O4 -","- C11 H12 O4 -","- C22 H24 O8 -","2","1","LH6542","Bolte, Michael; Naumann, Frank; Hashmi, A. Stephen K.","Dimethyl dipropargylmalonate","Acta Crystallographica Section E","2005","61","12","o4025","o4027","10.1107/S1600536805035890","","","0.71073","MoKα","","0.0302","0.0278","","","0.0765","0.0776","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207597","10.7715","0.001","5.4301","0.0005","12.9139","0.0012","90","","119.58","0.007","90","","656.89","0.11","295","","","","","","","","","","","5","P 1 c 1","P -2yc","7","","2-Carboxypyridinium hydrogen chloranilate","","- C12 H7 Cl2 N O6 -","- C12 H7 Cl2 N O6 -","- C24 H14 Cl4 N2 O12 -","2","1","LH6547","Tabuchi, Youhei; Takahashi, Akiko; Gotoh, Kazuma; Akashi, Haruo; Ishida, Hiroyuki","2-Carboxypyridinium hydrogen chloranilate","Acta Crystallographica Section E","2005","61","12","o4215","o4217","10.1107/S1600536805037591","","","0.71073","MoKα","","0.0384","0.0311","","","0.0693","0.0717","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207598","18.252","0.002","17.012","0.002","16.073","0.002","90","","103.686","0.003","90","","4849","1","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,3,4,4,5,5-Hexafluoro-1,2-bis(3-methyl-5-phenyl-2-thienyl)cyclopent-1-ene","","- C27 H18 F6 S2 -","- C27 H18 F6 S2 -","- C216 H144 F48 S16 -","8","2","LH6548","Pu, Shou-Zhi; Fan, Cong-Bin; Chen, Bing; Wang, Ru-Ji; Xu, Jing-Kun","3,3,4,4,5,5-Hexafluoro-1,2-bis(3-methyl-5-phenyl-2-thienyl)cyclopent-1-ene, a new photochromic diarylethene compound","Acta Crystallographica Section E","2005","61","12","o4369","o4371","10.1107/S1600536805038845","","","0.71073","MoKα","","0.1347","0.0515","","","0.1146","0.1533","","","","","","0.994","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207599","13.6038","0.0009","13.9457","0.0009","7.1524","0.0007","90","","103.031","0.001","90","","1321.97","0.18","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[4,4'-bipyridinium(+) [argentate(I)-di-μ-iodo]]","","- C10 H9 Ag I2 N2 -","- C10 H9 Ag I2 N2 -","- C40 H36 Ag4 I8 N8 -","4","0.5","LH6550","Niu, Yun-Yin; Ye, E.; Zhang, Hong-Yun; Hou, Hong-Wei; Ng, Seik Weng","<i>catena</i>-Poly[4,4'-bipyridinium(+) [argentate(I)-di-μ-iodo]]","Acta Crystallographica Section E","2005","61","12","m2736","m2737","10.1107/S1600536805039012","","","0.71073","MoKα","","0.043","0.041","","","0.116","0.117","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207600","15.8573","0.0008","20.0393","0.0013","20.0147","0.001","90","","110.436","0.004","90","","5959.8","0.6","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5,11,17,23-Tetra-tert-butyl-25,26,27,28-tetrapentoxycalix[4]arene","","- C64 H96 O4 -","- C64 H96 O4 -","- C256 H384 O16 -","4","1","LH6555","Brusko, Vasiliy; Böhmer, Volker; Bolte, Michael","5,11,17,23-Tetra-<i>tert</i>-butyl-25,26,27,28-tetrapentoxycalix[4]arene","Acta Crystallographica Section E","2005","61","12","o4272","o4273","10.1107/S1600536805038067","","","0.71073","MoKα","","0.074","0.0501","","","0.1361","0.1479","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207601","6.6287","0.0004","26.629","0.002","10.0073","0.0006","90","","104.655","0.001","90","","1708.98","0.19","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[sesqui(1,2-ethanediammonium) [[aqua(sulfato-κO)cerate(III)]-di-μ-sulfato-κ^3^O,O':O'';κ^4^O,O':O'',O'''] dihydrate]","","- C3 H21 Ce N3 O15 S3 -","- C3 H21 Ce N3 O15 S3 -","- C12 H84 Ce4 N12 O60 S12 -","4","1","LH6556","Fu, Yun-Long; Ren, Jia-Lin; Xu, Zhi-Wei; Ng, Seik Weng","<i>catena</i>-Poly[sesqui(1,2-ethanediammonium) [[aqua(sulfato-κ<i>O</i>)cerate(III)]-di-μ-sulfato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>'';κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''] dihydrate]","Acta Crystallographica Section E","2005","61","12","m2738","m2740","10.1107/S1600536805039024","","","0.71073","MoKα","","0.039","0.03","","","0.067","0.071","","","","","","0.99","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207602","10.6785","0.0006","13.3996","0.0008","16.1443","0.0009","106.334","0.001","96.64","0.001","109.95","0.001","2025.6","0.2","292","2","295","2","","","","","","","","5","P -1","-P 1","2","","Bis{4-methyl-N-[(Z)-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4- ylidene)(phenyl)methyl]anilinato-κ^2^N,O}cobalt(II)","","- C48 H40 Co N6 O2 -","- C48 H40 Co N6 O2 -","- C96 H80 Co2 N12 O4 -","2","1","LH6557","Ma, Rong-Ming; Sun, Shao-Fa; Ng, Seik Weng","Bis{4-methyl-<i>N</i>-[(<i>Z</i>)-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazol-4-ylidene)(phenyl)methyl]anilinato-κ^2^<i>N</i>,<i>O</i>}cobalt(II)","Acta Crystallographica Section E","2005","61","12","m2741","m2742","10.1107/S1600536805039139","","","0.71073","MoKα","","0.089","0.064","","","0.165","0.182","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207603","8.731","0.0005","12.7348","0.0005","17.2366","0.001","90","","99.44","0.005","90","","1890.54","0.17","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1,4,7,7-Pentamethyldiethylenetriammonium bis(hexafluorophosphate)","","- C9 H25 F12 N3 P2 -","- C9 H25 F12 N3 P2 -","- C36 H100 F48 N12 P8 -","4","1","LH6562","Morawitz, Thorsten; Lerner, Hans-Wolfram; Bru Roig, Miriam; Bolte, Michael","1,1,4,7,7-Pentamethyldiethylenetriammonium bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","12","o4367","o4368","10.1107/S1600536805039140","","","0.71073","MoKα","","0.0404","0.0389","","","0.1039","0.1052","","","","","","1.108","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207604","6.5532","0.0006","7.594","0.001","11.026","0.001","87.773","0.003","73.715","0.002","79.578","0.004","517.96","0.1","295","1","","","","","","","","","","4","P -1","-P 1","2","","6-Bromo-3-(2-methylpropenyl)imidazo[1,2-a]pyridine","","- C11 H11 Br N2 -","- C11 H11 Br N2 -","- C22 H22 Br2 N4 -","2","1","NC6047","Rui Zhang; Yongzhou Hu","6-Bromo-3-(2-methylpropenyl)imidazo[1,2-<i>a</i>]pyridine","Acta Crystallographica Section E","2005","61","12","o4037","o4038","10.1107/S1600536805035634","","","0.7107","MoKα","","","0.038","","","","0.114","","","","","","1.009","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207605","10.2935","0.0006","10.906","0.0006","15.409","0.0007","90","","98.562","0.004","90","","1710.55","0.16","298","1","298","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","α-benzyldibenzoylmethane","2-benzyl-1,3-diphenylpropane-1,3-dione","","- C22 H18 O2 -","- C22 H18 O2 -","- C88 H72 O8 -","4","1","NC6049","Nenad Judaš; Branko Kaitner","2-Benzyl-1,3-diphenylpropane-1,3-dione","Acta Crystallographica Section E","2005","61","12","o4008","o4010","10.1107/S1600536805035476","","","0.71073","MoKα","","0.0742","0.0512","","","0.1379","0.152","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207606","6.002","0.003","8.822","0.005","29.339","0.015","90","","90","","90","","1553.5","1.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4F","1,1-dibenzoyl-3,3-dimethylurea","","- C17 H16 N2 O3 -","- C17 H16 N2 O3 -","- C68 H64 N8 O12 -","4","1","NC6050","Blewett, Gavin; Esterhuysen, Catharine; Bredenkamp, Martin W.; Koch, Klaus R.","1,1-Dibenzoyl-3,3-dimethylurea","Acta Crystallographica Section E","2005","61","12","o4042","o4044","10.1107/S1600536805035786","","","0.71073","MoKα","","0.0624","0.0483","","","0.0998","0.1052","","","","","","1.151","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207607","9.7257","0.0011","16.6879","0.0017","7.6056","0.0011","90","","90","","90","","1234.4","0.3","295","2","295","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","1H-benzimidazole","","- C7 H6 N2 -","- C7 H6 N2 -","- C56 H48 N16 -","8","1","NC6052","Sławomir Krawczyk; Maria Gdaniec","Polymorph β of 1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","12","o4116","o4118","10.1107/S1600536805036536","","","0.71073","MoKα","","0.0744","0.0531","","","0.1067","0.116","","","","","","1.174","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207608","36.113","0.005","6.8124","0.0009","15.931","0.002","90","","105.504","0.002","90","","3776.7","0.9","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(4-Hydroxy-3-methoxyphenyl)-1-phenethyl-1,2-dihydroquinazolin-4(3H)-one","","- C23 H22 N2 O3 -","- C23 H22 N2 O3 -","- C184 H176 N16 O24 -","8","1","NC6055","G. Y. S. K. Swamy; K. Ravikumar","2-(4-Hydroxy-3-methoxyphenyl)-1-phenethyl-1,2-dihydroquinazolin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","12","o4238","o4240","10.1107/S1600536805037979","","","0.71073","MoKα","","0.1115","0.0581","","","0.1587","0.1926","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207609","13.245","0.003","7.223","0.002","7.649","0.002","90","","122.66","0.01","90","","616.1","0.3","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Zinc acetylenedicarboxylate dihydrate","Poly[diaqua-μ~4~-acetylenedicarboxylato-zinc(II)]","","- C4 H4 O6 Zn -","- C4 H4 O6 Zn -","- C16 H16 O24 Zn4 -","4","0.5","NC6056","Stein, Irena; Ruschewitz, Uwe","Poly[diaqua-μ~4~-acetylenedicarboxylato-zinc(II)]","Acta Crystallographica Section E","2005","61","12","m2680","m2682","10.1107/S1600536805037797","","","0.71073","MoKα","","0.0832","0.0416","","","0.0795","0.0912","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207610","5.5894","0.0018","14.444","0.005","7.013","0.004","90","","108.56","0.03","90","","536.7","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2-Hydroxyethyl)-4H-1,2,4-triazole","","- C4 H7 N3 O -","- C4 H7 N3 O -","- C16 H28 N12 O4 -","4","1","NC6057","Martin U. Schmidt; Chunhua Hu; Jan W. Bats; Jens Kühne","4-(2-Hydroxyethyl)-4<i>H</i>-1,2,4-triazole, an intermediate in the synthesis of iron‒triazole spin-crossover compounds","Acta Crystallographica Section E","2005","61","12","o4343","o4344","10.1107/S1600536805038511","","","0.71073","MoKα","","0.0658","0.0408","","","0.0881","0.1002","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207611","9.6835","0.0016","5.2925","0.0013","12.823","0.002","90","","106.47","0.015","90","","630.2","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(R)-(+)-3-Chloro-1-(4-morpholino-5-nitro-1H-imidazol-1-yl)propan-2-ol","","- C10 H15 Cl N4 O4 -","- C10 H15 Cl N4 O4 -","- C20 H30 Cl2 N8 O8 -","2","1","NC6059","Gzella, Andrzej; Zwawiak, Justyna; Zaprutko, Lucjusz","(<i>R</i>)-(+)-3-Chlor-1-(4-morpholino-5-nitro-1<i>H</i>-imidazol-1-yl)propan-2-ol","Acta Crystallographica Section E","2005","61","12","o4071","o4072","10.1107/S1600536805036275","","","1.54178","CuKα","","0.0292","0.0267","","","0.0738","0.0756","","","","","","1.034","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207612","13.88","0.003","9.86","0.005","17.962","0.004","90","","95.42","0.01","90","","2447.2","1.5","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dinitratodioxo[3-(triphenylphosphonio)propionato]uranium(VI)","","- C21 H19 N2 O10 P U -","- C21 H19 N2 O10 P U -","- C84 H76 N8 O40 P4 U4 -","4","1","NG6220","Yang, Lin; Jiang, Ning-Yi; Chen, Xue-Hui; Li, Song-Lin","Dinitratodioxo[3-(triphenylphosphonio)propionato]uranium(VI)","Acta Crystallographica Section E","2005","61","12","m2578","m2579","10.1107/S1600536805036032","","","0.71073","MoKα","","0.0823","0.0419","","","0.071","0.0808","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207613","19.063","0.004","9.6915","0.0019","14.968","0.003","90","","96.114","0.003","90","","2749.6","1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Triphenyltin(IV) N-benylpiperazinyldithiocarbamate","","- C30 H30 N2 S2 Sn -","- C30 H30 N2 S2 Sn -","- C120 H120 N8 S8 Sn4 -","4","1","NG6225","Feng Li; Han-Dong Yin; Da-Qi Wang","(4-Benzylpiperazine-1-carbodithioato)triphenyltin(IV)","Acta Crystallographica Section E","2005","61","12","m2464","m2465","10.1107/S1600536805035087","","","0.71073","MoKα","","0.0833","0.0433","","","0.0911","0.1099","","","","","","1.003","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207614","11.051","0.002","8.9055","0.0018","19.203","0.004","90","","96.31","0.03","90","","1878.4","0.7","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquatris(nitrato-κ^2^O,O')bis(4-pyridone-κO)lanthanum(III)","","- C10 H14 La N5 O13 -","- C10 H14 La N5 O13 -","- C40 H56 La4 N20 O52 -","4","0.5","NG6231","Deng, Zhao-Peng; Gao, Shan; Huo, Li-Hua; Zhao, Hui","Diaquatris(nitrato-κ^2^<i>O</i>,<i>O</i>')bis(4-pyridone-κ<i>O</i>)lanthanum(III)","Acta Crystallographica Section E","2005","61","12","m2523","m2525","10.1107/S1600536805035439","","","0.71073","MoKα","","0.0162","0.0159","","","0.0398","0.0399","","","","","","1.242","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207615","14.542","0.003","12.806","0.003","22.265","0.004","90","","101.39","0.03","90","","4064.6","1.5","150","2","123","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","(3,5-Dimethylpyridine)bis(tri-tert-butoxysilanethiolato)zinc(II)","","- C31 H63 N O6 S2 Si2 Zn -","- C31 H63 N O6 S2 Si2 Zn -","- C124 H252 N4 O24 S8 Si8 Zn4 -","4","0.5","NG6232","Dołęga, Anna; Konitz, Antoni; Baum, Elke; Wojnowski, Wiesław","(3,5-Dimethylpyridine)bis(tri-<i>tert</i>-butoxysilanethiolato)zinc(II)","Acta Crystallographica Section E","2005","61","12","m2582","m2584","10.1107/S1600536805036391","","","0.71073","MoKα","","0.0406","0.0376","","","0.0954","0.097","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207616","10.807","0.002","12.614","0.003","16.055","0.003","103.89","0.03","108.77","0.03","103.69","0.03","1890.7","1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(4,4'-bipyridine-κN)bis(4-carboxyphenoxyacetato-κO)cobalt(II) tetrahydrate","","- C38 H42 Co N4 O16 -","- C38 H42 Co N4 O16 -","- C76 H84 Co2 N8 O32 -","2","1","NG6234","Deng, Zhao-Peng; Gao, Shan; Huo, Li-Hua; Zhao, Jing-Gui","Diaquabis(4,4'-bipyridine-κ<i>N</i>)bis(4-carboxyphenoxyacetato-κ<i>O</i>)cobalt(II) tetrahydrate","Acta Crystallographica Section E","2005","61","12","m2550","m2552","10.1107/S1600536805036172","","","0.71073","MoKα","","0.0667","0.0422","","","0.1102","0.1205","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207617","7.7792","0.0007","11.238","0.0011","17.5795","0.0015","90","","107.761","0.004","90","","1463.6","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ~2~-Oxalato-κ^2^O,O':κ^2^O'',O'''-bis[aqua(1,10-phenanthroline- κ^2^N,N')copper(II)] dinitrate dihydrate","","- C26 H24 Cu2 N6 O14 -","- C26 H24 Cu2 N6 O14 -","- C52 H48 Cu4 N12 O28 -","2","0.5","NG6236","Zhang, Xiang-Dong; Zhao, Zhen; Sun, Jin-Yu; Ma, Yong-Chao; Zhu, Miao-Li","μ~2~-Oxalato-κ^2^<i>O</i>,<i>O</i>':κ^2^<i>O</i>'',<i>O</i>'''-bis[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)] dinitrate dihydrate","Acta Crystallographica Section E","2005","61","12","m2643","m2645","10.1107/S1600536805037396","","","0.71073","MoKα","","0.0322","0.0292","","","0.0822","0.0845","","","","","","1.031","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207618","7.9627","0.0009","10.4988","0.0012","12.3751","0.0014","76.616","0.002","87.507","0.002","70.685","0.002","949.18","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-2-nitrobenzoato-κ^2^O:O')bis[(pyridine-κN)zinc(II)]","","- C38 H26 N6 O16 Zn2 -","- C38 H26 N6 O16 Zn2 -","- C38 H26 N6 O16 Zn2 -","1","0.5","NG6245","Guo-Liang Zhao; Yi-Hang Wen","Tetrakis(μ-2-nitrobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(pyridine-κ<i>N</i>)zinc(II)]","Acta Crystallographica Section E","2005","61","12","m2699","m2700","10.1107/S1600536805037712","","","0.71073","MoKα","","","0.0449","","","0.0993","0.1028","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207619","11.245","0.002","12.354","0.003","15.226","0.003","112.05","0.02","92.83","0.03","86.44","0.03","1955.9","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Tetramethylammonium chlorodiphenylthiocyanatoantimonate(III)","Tetramethylammonium chlorodiphenylthiocyanatoantimonate(III)","","- C17 H22 Cl N2 S Sb -","- C17 H22 Cl N2 S Sb -","- C68 H88 Cl4 N8 S4 Sb4 -","4","2","NG6252","Artali, Roberto; Bombieri, Gabriella; Bertazzi, Nuccio","Tetramethylammonium chlorodiphenylthiocyanatoantimonate(III)","Acta Crystallographica Section E","2005","61","12","m2733","m2735","10.1107/S1600536805038870","","","0.71073","MoKα","","0.0408","0.0393","","","0.098","0.0995","","","","","","1.285","","","","has coordinates","278247","2022-09-28","15:09:33",""
"2207620","35.531","0.007","12.536","0.003","9.518","0.002","90","","91.61","0.002","90","","4237.8","1.6","173","2","173","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","11,12-Bis(2,2-dimethylpropyl)-9,10-dihydro-9,10-ethenoanthracene","","- C26 H32 -","- C26 H32 -","- C208 H256 -","8","1","OM6267","Herres, Joseph P.; Forman, Mark A.; Wheeler, Kraig A.","11,12-Bis(2,2-dimethylpropyl)-9,10-dihydro-9,10-ethenoanthracene","Acta Crystallographica Section E","2005","61","12","o3961","o3963","10.1107/S1600536805034896","","","0.71073","MoKα","","0.0569","0.0476","","","0.116","0.1195","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207621","22.699","0.005","4.1854","0.0009","6.9782","0.0015","90","","100.415","0.018","90","","652","0.2","173","2","173","2","","","","","","","","3","C 1 2 1","C 2y","5","","Methyl 3-carboxy-2-hydroxypropanoate","","- C5 H8 O5 -","- C5 H8 O5 -","- C20 H32 O20 -","4","1","OM6268","He, Xiangjiu; Lobkovsky, Emil; Liu, Rui Hai","(<i>R</i>*)-Methyl 3-carboxy-2-hydroxypropanoate","Acta Crystallographica Section E","2005","61","12","o4104","o4106","10.1107/S1600536805036378","","","0.71073","MoKα","","0.0335","0.0312","","","0.0829","0.0844","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207622","18.785","0.011","9.581","0.005","18.523","0.01","90","","90.924","0.017","90","","3333","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(1,10-phenanthroline-κ^2^N,N)bis(thiosalicylato- 1κ^2^O,O':2κ^2^O',S)dizinc(II)","","- C38 H24 N4 O4 S2 Zn2 -","- C38 H24 N4 O4 S2 Zn2 -","- C152 H96 N16 O16 S8 Zn8 -","4","0.5","OM6269","Yu-Mei Dai; Jin-Feng Huang; Hui-Ying Shen","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>)bis(thiosalicylato-1κ^2^<i>O</i>,<i>O</i>':2κ^2^<i>O</i>',<i>S</i>)dizinc(II)","Acta Crystallographica Section E","2005","61","12","m2491","m2492","10.1107/S1600536805035312","","","0.71073","MoKα","","","0.0402","","","0.0831","0.0881","","","","","","1.104","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207623","11.9781","0.001","24.094","0.002","10.7056","0.0009","90","","105.925","0.002","90","","2971.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","poly[bis(4,4'-bipyridine)(μ~3~-4,4'-dicarboxy-biphenyl-3,3'- dicarboxylato)cobalt(II)]","","- C36 H24 Co N4 O8 -","- C36 H24 Co N4 O8 -","- C144 H96 Co4 N16 O32 -","4","1","RN6063","Xiang-Rong Hao; Zhong-Min Su; Ya-Hui Zhao; Kui-Zhan Shao; Yong Wang","Poly[bis(4,4'-bipyridine)(μ~3~-4,4'-dicarboxybiphenyl-3,3'-dicarboxylato)cobalt(II)]","Acta Crystallographica Section E","2005","61","12","m2477","m2479","10.1107/S1600536805033842","","","0.71073","MoKα","","0.0851","0.0429","","","0.094","0.1005","","","","","","0.969","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207624","10.0756","0.0019","7.0683","0.0013","15.62","0.003","90","","102.03","0.003","90","","1088","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(3-chlorobenzyl)pyrimidine-2,4(1H,3H)-dione","","- C11 H9 Cl N2 O2 -","- C11 H9 Cl N2 O2 -","- C44 H36 Cl4 N8 O8 -","4","1","RN6068","Gong-chun Li; You-Quan Zhu; Yi-Feng Wang; Wei-Min Liu; Hua-Zheng Yang","1-(3-Chlorobenzyl)pyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","12","o4220","o4221","10.1107/S160053680503758X","","","0.71073","MoKα","","0.0717","0.0373","","","0.0912","0.1102","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207625","7.891","0.0002","8.6355","0.0002","9.2002","0.0003","89.42","0.001","72.741","0.001","66.316","0.001","543.99","0.03","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Bis(triethanolamine-κ^3^N,O,O')nickel(II) benzene-1,4-dicarboxylate","","- C20 H34 N2 Ni O10 -","- C20 H34 N2 Ni O10 -","- C20 H34 N2 Ni O10 -","1","0.5","RN6069","Haukka, Matti; Kirillov, Alexander M.; Kopylovich, Maximilian N.; Pombeiro, Armando J.L.","Bis(triethanolamine-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')nickel(II) benzene-1,4-dicarboxylate","Acta Crystallographica Section E","2005","61","12","m2746","m2748","10.1107/S1600536805039127","","","0.71073","MoKα","","0.03","0.0267","","","0.0643","0.0657","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207626","7.4255","0.001","15.497","0.002","7.0806","0.001","90","","108.648","0.002","90","","772.01","0.18","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 N4 O4 -","- C16 H14 N4 O4 -","- C32 H28 N8 O8 -","2","0.5","RZ6131","Li, Yu-Guang; Zhu, Hai-Liang; Chen, Xin-Zhi; Song, Yu","<i>N</i>,<i>N</i>'-Bis(2-nitrobenzylidene)ethylenediamine","Acta Crystallographica Section E","2005","61","12","o4156","o4157","10.1107/S1600536805037153","","","0.71073","MoKα","","0.0671","0.0544","","","0.1439","0.1542","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207627","15.4","0.002","7.4361","0.0011","33.601","0.005","90","","90","","90","","3847.9","0.9","294","2","294","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","3-(4-(2,3-dichlorophenyl)piperazin-1-yl)-1-(thiophen-2-yl)propan-1-one hydrochloride","","- C17 H19 Cl3 N2 O S -","- C17 H19 Cl3 N2 O S -","- C136 H152 Cl24 N16 O8 S8 -","8","1","RZ6132","Yang, Xiong-Wen; Li, Ai-Jun; Zhu, Kong-Ming; Zhou, Xue-Qin; Liu, Dong-Zhi","4-(2,3-Dichlorophenyl)-1-[3-oxo-3-(2-thienyl)propyl]piperazin-1-ium chloride","Acta Crystallographica Section E","2005","61","12","o4144","o4145","10.1107/S1600536805037190","","","0.71073","MoKα","","0.0801","0.0583","","","0.1278","0.139","","","","","","1.115","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207628","26.353","0.003","7.3649","0.0007","14.8434","0.0016","90","","120.057","0.01","90","","2493.5","0.5","295","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Cu I4 N4 -","- C20 H16 Cu I4 N4 -","- C80 H64 Cu4 I16 N16 -","4","0.5","RZ6134","Choi, Sung-Nak; Heo, Ji Youn; Ryu, Hae-Wook; Oh, Myung-Jin; Kang, Sung Kwon","Redetermination of bis(2,2'-bipyridine)iodocopper(II) triiodide","Acta Crystallographica Section E","2005","61","12","m2658","m2660","10.1107/S1600536805037578","","","0.71073","MoKα","","","0.0436","","","","0.0952","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207629","6.9279","0.0004","11.4613","0.0007","10.198","0.0007","90","","99.052","0.001","90","","799.66","0.09","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(Methylsulfanyl)-1H-benzimidazole","","- C8 H8 N2 S -","- C8 H8 N2 S -","- C32 H32 N8 S4 -","4","1","RZ6137","G. Y. S. K. Swamy; K. Ravikumar","2-(Methylsulfanyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","12","o4200","o4202","10.1107/S1600536805037566","","","0.71073","MoKα","","0.0357","0.0333","","","0.0877","0.0904","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207630","7.841","0.002","9.043","0.002","12.012","0.002","106.96","0.002","102.78","0.003","93.04","0.003","788.2","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aqua[4-bromo-2-(pyridinylmethyliminomethyl)phenolato]zinc(II) nitrate monohydrate","","- C13 H14 Br N3 O6 Zn -","- C13 H14 Br N3 O6 Zn -","- C26 H28 Br2 N6 O12 Zn2 -","2","1","RZ6138","Chen, Yue","Aqua[4-bromo-2-(pyridinylmethyliminomethyl)phenolato]zinc(II) nitrate monohydrate","Acta Crystallographica Section E","2005","61","12","m2716","m2717","10.1107/S1600536805037694","","","0.71073","MoKα","","0.0397","0.0331","","","0.0895","0.0935","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207631","9.26","0.002","10.846","0.003","15.531","0.004","77.794","0.004","87.324","0.004","65.873","0.004","1390","0.6","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2,6-Bis(1H-imidazol-1-ylmethyl)pyridine 1.5-hydrate","","- C13 H16 N5 O1.5 -","- C13 H16 N5 O1.5 -","- C52 H64 N20 O6 -","4","2","RZ6142","Xiang-Tai Meng; Qing-Shan Li; Feng-Bo Xu; Hai-Bin Song; Zheng-Zhi Zhang","2,6-Bis(1<i>H</i>-imidazol-1-ylmethyl)pyridine sesquihydrate","Acta Crystallographica Section E","2005","61","12","o4338","o4339","10.1107/S1600536805038742","","","0.71073","MoKα","","0.1161","0.0491","","","0.1181","0.1485","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207632","20.888","0.002","11.8633","0.0014","23.109","0.003","90","","107.686","0.002","90","","5455.8","1.1","297","2","297","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[Bis(diphenylphosphino)methane-κ^2^P,P'][bis(diphenylthiophosphinyl)methane- κ^2^S,S']platinum(II) bis(perchlorate) acetone solvate","","- C53 H50 Cl2 O9 P4 Pt S2 -","- C53 H50 Cl2 O9 P4 Pt S2 -","- C212 H200 Cl8 O36 P16 Pt4 S8 -","4","1","RZ6143","Alkan, Leman; İrişli, Sevil","[Bis(diphenylphosphino)methane-κ^2^<i>P</i>,<i>P</i>'][bis(diphenylthiophosphinyl)methane-κ^2^<i>S</i>,<i>S</i>']platinum(II) bis(perchlorate) acetone solvate","Acta Crystallographica Section E","2005","61","12","m2706","m2708","10.1107/S1600536805038304","","","0.71073","MoKα","","0.0834","0.0763","","","0.1584","0.1616","","","","","","1.255","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207633","9.0892","0.0005","11.878","0.0006","15.8131","0.0008","90","","97.975","0.001","90","","1690.7","0.15","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 5,5''-dimethyl-2,2';6',2''terpyridine-4'-carboxylate","","- C20 H19 N3 O2 -","- C20 H19 N3 O2 -","- C80 H76 N12 O8 -","4","1","RZ6145","Guido Kickelbick; Richard Hoogenboom; Ulrich S. Schubert","Ethyl 5,5''-dimethyl-2,2';6',2''-terpyridine-4'-carboxylate","Acta Crystallographica Section E","2005","61","12","o4322","o4324","10.1107/S1600536805038547","","","0.71073","MoKα","","0.0558","0.0486","","","0.1422","0.1489","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207634","9.951","0.0019","11.188","0.002","13.907","0.003","69.96","0.003","83.727","0.004","63.665","0.003","1301.9","0.4","293","2","294","2","","","","","","","","7","P -1","-P 1","2","","bis(dimethylformamide)bis[μ-3,10,18,21-tetraazatetracyclo[20.4.0.0^4,9^.0^12,17^]hexacosa-2,10,12,14,16,22,24,26-octaene-19,20-dionato(2-)]bis(thiocyanato)dicopper(II)manganese(II)","","- C52 H54 Cu2 Mn N12 O6 S2 -","- C52 H54 Cu2 Mn N12 O6 S2 -","- C52 H54 Cu2 Mn N12 O6 S2 -","1","0.5","SG6037","Jia, Xue-Qiao; Yang, Guang-Ming","A trinuclear Cu~2~Mn complex, [Mn(Cu<i>L</i>)~2~(DMF)~2~](SCN)~2~, where H~2~<i>L</i> is 3,10,18,21-tetraazatetracyclo[20.4.0.0^4,9^.0^12,17^]hexacosa-2,10,12,14,16,22,24,26-octaene-19,20-dionate(2{-}) and DMF is dimethylformamide","Acta Crystallographica Section E","2005","61","12","m2653","m2654","10.1107/S1600536805037438","","","0.71073","MoKα","","0.0832","0.0454","","","0.0927","0.1101","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207635","12.1765","0.0009","14.2518","0.001","26.6488","0.0018","90","","90","","90","","4624.6","0.6","100","2","100","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","Dibrucinium sulfate heptahydrate","","- C46 H68 N4 O19 S -","- C46 H68 N4 O19 S -","- C184 H272 N16 O76 S4 -","4","0.5","SG6038","Agata Białońska; Zbigniew Ciunik","Dibrucinium sulfate heptahydrate","Acta Crystallographica Section E","2005","61","12","o4222","o4224","10.1107/S1600536805037451","","","0.71073","MoKα","","0.056","0.047","","","0.091","0.094","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207636","8.7541","0.001","6.8132","0.0005","13.5203","0.0019","90","","100.28","0.013","90","","793.45","0.16","295","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","3-(4-tert-Butylphenoxy)phthalonitrile","","- C18 H16 N2 O -","- C18 H16 N2 O -","- C36 H32 N4 O2 -","2","0.5","SJ6137","Xin Huang; Fuqun Zhao; Ru-Ji Wang; Fushi Zhang; Chen-Ho, Tung","3-(4-<i>tert</i>-Butylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","12","o4384","o4386","10.1107/S1600536805035725","","","0.71073","MoKα","","0.1143","0.0518","","","0.0937","0.1126","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207637","5.6051","0.0007","7.4946","0.001","13.2471","0.0017","101.308","0.002","91.883","0.002","100.565","0.002","535.06","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazine","","- C12 H7 Cl F N3 -","- C12 H7 Cl F N3 -","- C24 H14 Cl2 F2 N6 -","2","1","SJ6141","Wang, Lingling; Ma, Mingliang; Shen, Xiaohong; Zhao, Shiguo","6-Chloro-2-(4-fluorophenyl)imidazo[1,2-<i>b</i>]pyridazine","Acta Crystallographica Section E","2005","61","12","o4030","o4031","10.1107/S1600536805035920","","","0.71073","MoKα","","0.0613","0.0505","","","0.1245","0.1306","","","","","","0.958","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207638","13.174","0.006","10.506","0.005","20.259","0.008","90","","100.993","0.007","90","","2753","2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(N,N-diethyldithiocarbamato-κ^2^S,S')iodo(1,10-phenanthroline)bismuth(III)","","- C22 H28 Bi I N4 S4 -","- C22 H28 Bi I N4 S4 -","- C88 H112 Bi4 I4 N16 S16 -","4","1","SJ6144","Feng Li; Han-Dong Yin; Da-Qi Wang","Bis(<i>N</i>,<i>N</i>-diethyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>')iodo(1,10-phenanthroline)bismuth(III)","Acta Crystallographica Section E","2005","61","12","m2541","m2543","10.1107/S1600536805035580","","","0.71073","MoKα","","0.1264","0.0576","","","0.1161","0.1396","","","","","","1.003","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207639","8.75","0.002","10.12","0.002","11.394","0.002","90","","107.25","0.03","90","","963.6","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,5-Dihydroxy-4,5-dimethylocta-1,7-diyne","","- C10 H14 O2 -","- C10 H14 O2 -","- C40 H56 O8 -","4","1","SJ6145","Bolte, Michael; Eckstein, Klaus; Hashmi, A. Stephen K.","<i>meso</i>-4,5-Dihydroxy-4,5-dimethylocta-1,7-diyne","Acta Crystallographica Section E","2005","61","12","o4064","o4066","10.1107/S1600536805036147","","","0.71073","MoKα","","0.0649","0.048","","","0.1197","0.1298","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207640","10.221","0.001","15.054","0.002","10.6","0.001","90","","91.19","0.001","90","","1630.6","0.3","295","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H15 N5 S2 Zn -","- C12 H15 N5 S2 Zn -","- C48 H60 N20 S8 Zn4 -","4","1","SJ6146","Chen, Guang; Bai, Zhi-Ping; Qu, Sheng-Ju","[<i>N</i>,<i>N</i>'-Dimethyl-<i>N</i>''-(2-pyridylmethylene)ethane-1,2-diamine]dithiocyanatozinc(II)","Acta Crystallographica Section E","2005","61","12","m2483","m2484","10.1107/S1600536805035300","","","0.71073","MoKα","","0.0555","0.039","","","0.1045","0.1168","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207641","10.3775","0.0009","7.4406","0.0007","20.639","0.0018","90","","96.231","0.002","90","","1584.2","0.2","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5,5-Dimethyl-2-oxo-4-phenyl-2-(2-pyridylamino)-1,3,2-dioxaphosphorinane","","- C16 H19 N2 O3 P -","- C16 H19 N2 O3 P -","- C64 H76 N8 O12 P4 -","4","1","SJ6147","Yan Yu; Chang Liu; Xingyu Yang","5,5-Dimethyl-2-oxo-4-phenyl-2-(2-pyridylamino)-1,3,2-dioxaphosphorinane","Acta Crystallographica Section E","2005","61","12","o4270","o4271","10.1107/S1600536805036585","","","0.71073","MoKα","","0.0497","0.0465","","","0.1182","0.1203","","","","","","1.123","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207642","8.528","0.002","9.128","0.001","15.371","0.001","91.737","0.001","97.043","0.001","115.639","0.001","1065.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[dipyridylcopper(II)]di-μ-thiocyanato]","","- C12 H10 Cu N4 S2 -","- C12 H10 Cu N4 S2 -","- C36 H30 Cu3 N12 S6 -","3","1.5","SJ6148","Chen, Guang; Bai, Zhi-Ping; Qu, Sheng-Ju","<i>catena</i>-Poly[[dipyridylcopper(II)]-di-μ-thiocyanato]","Acta Crystallographica Section E","2005","61","12","m2718","m2719","10.1107/S1600536805036998","","","0.71073","MoKα","","0.0481","0.0357","","","0.0916","0.0994","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207643","5.9288","0.0018","7.651","0.002","20.087","0.006","96.711","0.005","93.768","0.005","90.115","0.005","902.9","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","(E)-1-[3-(Benzyloxy)benzylidene]-2-(2,4-dinitrophenyl)hydrazine","","- C20 H16 N4 O5 -","- C20 H16 N4 O5 -","- C40 H32 N8 O10 -","2","1","SJ6149","Shi, Jun","(<i>E</i>)-1-[3-(Benzyloxy)benzylidene]-2-(2,4-dinitrophenyl)hydrazine","Acta Crystallographica Section E","2005","61","12","o4018","o4019","10.1107/S1600536805035932","","","0.71073","MoKα","","0.0714","0.0424","","","0.0995","0.1165","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207644","7.945","0.003","12.253","0.005","12.549","0.005","67.618","0.007","84.794","0.007","87.729","0.008","1124.9","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(E)-1-[3-(Benzyloxy)-4-methoxybenzylidene]-2-(2,4-dinitrophenyl)hydrazine acetonitrile solvate","","- C23 H21 N5 O6 -","- C23 H21 N5 O6 -","- C46 H42 N10 O12 -","2","1","SJ6150","Shi, Jun","(<i>E</i>)-1-[3-(Benzyloxy)-4-methoxybenzylidene]-2-(2,4-dinitrophenyl)hydrazine acetonitrile solvate","Acta Crystallographica Section E","2005","61","12","o4020","o4022","10.1107/S1600536805035981","","","0.71073","MoKα","","0.1233","0.0509","","","0.1175","0.1531","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207645","10.043","0.003","24.317","0.007","10.199","0.003","90","","108.275","0.005","90","","2365.1","1.2","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-4-[4-(Benzyloxy)-3-ethoxybenzylideneamino]-1,5-dimethyl-2-phenyl- 1H-pyrazol-3(2H)-one","","- C27 H27 N3 O3 -","- C27 H27 N3 O3 -","- C108 H108 N12 O12 -","4","1","SJ6151","Shi, Jun","(<i>E</i>)-4-[4-(Benzyloxy)-3-ethoxybenzylideneamino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","12","o4023","o4024","10.1107/S1600536805036007","","","0.71073","MoKα","","0.1197","0.0457","","","0.1013","0.1272","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207646","7.067","0.001","24.123","0.002","13.379","0.001","90","","90","","90","","2280.8","0.4","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","catena-Poly[[[aqua(di-2-pyridylamine-κ^2^N^2^,N^2'^)copper(II)]-μ- thiophene-2,5-dicarboxylato-κ^2^O^2^:O^5^] N,N-dimethylformamide monohydrate]","","- C19 H22 Cu N4 O7 S -","- C19 H22 Cu N4 O7 S -","- C76 H88 Cu4 N16 O28 S4 -","4","1","SJ6152","Hong-Ping Xiao","<i>catena</i>-Poly[[[aqua(di-2-pyridylamine-κ^2^<i>N</i>^2^,<i>N</i>^2'^)copper(II)]-μ-thiophene-2,5-dicarboxylato-κ^2^<i>O</i>^2^:<i>O</i>^5^] <i>N</i>,<i>N</i>-dimethylformamide monohydrate]","Acta Crystallographica Section E","2005","61","12","m2592","m2594","10.1107/S1600536805036433","","","0.71073","MoKα","","0.0337","0.0307","","","0.0738","0.0751","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207647","18.3934","0.0013","10.696","0.0007","10.8516","0.0008","90","","95.488","0.006","90","","2125.1","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-4-((E)-(4-butylphenyl)diazenyl)-6-((1,3-dihydroxy-2-(hydroxymethyl)p ropan- 2-ylamino)methylene)-2-methoxycyclohexa-2,4-dienone","","- C22 H29 N3 O5 -","- C22 H29 N3 O5 -","- C88 H116 N12 O20 -","4","1","SJ6154","Ersanlı, Cem Cüneyt; Albayrak, Çigdem; Odabaşoglu, Mustafa; Büyükgüngör, Orhan","(<i>Z</i>)-4-[(<i>E</i>)-(4-Butylphenyl)diazenyl]-6-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-ylamino]methylene}-2-methoxycyclohexa-2,4-dienone","Acta Crystallographica Section E","2005","61","12","o4139","o4141","10.1107/S1600536805037177","","","0.71073","MoKα","","0.146","0.083","","","0.223","0.25","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","211196","2020-10-21","18:00:00",""
"2207648","10.179","0.0015","12.5659","0.0018","12.8305","0.0019","71.764","0.002","83.782","0.003","73.156","0.002","1491.5","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","[2-phenyl-3,10,18,21-tetraazatetracyclo[20.4.0.0^4,9^.0^12,17^]hexacosa-2,10,12,14,16,22,24,26-octaene-19,20-dionato(2-)]copper(II) methanol solvate","","- C35 H32 N4 Ni O3 -","- C35 H32 N4 Ni O3 -","- C70 H64 N8 Ni2 O6 -","2","1","SJ6155","Jia, Xue-Qiao; Yang, Guang-Ming","A new nickel(II) complex, [Ni<i>L</i>]·CH~3~OH, where H~2~<i>L</i> is 2-phenyl-3,10,18,21-tetraazatetracyclo[20.4.0.0^4,9^.0^12,17^]hexacosa-2,10,12,14,16,22,24,26-octaene-19,20-dionate(2{-})","Acta Crystallographica Section E","2005","61","12","m2655","m2657","10.1107/S1600536805037335","","","0.71073","MoKα","","0.0605","0.0394","","","0.0924","0.1042","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207649","4.5854","0.0013","14.953","0.004","24.363","0.007","90","","92.475","0.005","90","","1668.9","0.8","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-1-(4-Methoxy-3-propoxybenzylidene)-2-(4-nitrophenyl)hydrazine","","- C17 H19 N3 O4 -","- C17 H19 N3 O4 -","- C68 H76 N12 O16 -","4","1","SJ6156","Shi, Jun","(<i>E</i>)-1-(4-Methoxy-3-propoxybenzylidene)-2-(4-nitrophenyl)hydrazine","Acta Crystallographica Section E","2005","61","12","o4091","o4092","10.1107/S1600536805036408","","","0.71073","MoKα","","0.1672","0.0531","","","0.122","0.1763","","","","","","0.989","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207650","9.25","0.002","19.736","0.004","10.797","0.002","90","","95.24","0.02","90","","1962.8","0.7","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tetraaquabis(3,5-dihydroxybenzoato-κO)nickel(II) trihydrate","","- C14 H24 Ni O15 -","- C14 H24 Ni O15 -","- C56 H96 Ni4 O60 -","4","1","SJ6157","Wang, Huan-Yu; Gao, Shan; Ng, Seik Weng","Tetraaquabis(3,5-dihydroxybenzoato-κ<i>O</i>)nickel(II) trihydrate","Acta Crystallographica Section E","2005","61","12","m2639","m2640","10.1107/S1600536805036792","","","0.71073","MoKα","","0.042","0.037","","","0.117","0.121","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207651","7.586","0.002","12.525","0.002","17.627","0.002","94.92","0.01","92.88","0.02","99.19","0.01","1643.7","0.5","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","2,6-Bis(4-aminophenyl)benzo[1,2-d:5,4-d']dioxazole 1-methylpyrrolidin-2-one trisolvate","","- C35 H41 N7 O5 -","- C35 H41 N7 O5 -","- C70 H82 N14 O10 -","2","1","SJ6158","Zhao, Hui; Sun, Li-Ping; Ng, Seik Weng","2,6-Bis(4-aminophenyl)benzo[1,2-<i>d</i>:5,4-<i>d</i>']dioxazole 1-methylpyrrolidin-2-one trisolvate","Acta Crystallographica Section E","2005","61","12","o4158","o4159","10.1107/S1600536805036986","","","0.71073","MoKα","","0.129","0.066","","","0.155","0.184","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207652","7.583","0.004","24.124","0.011","9.761","0.005","90","","97.18","0.008","90","","1771.6","1.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-N'-(4-Butoxy-3-methoxybenzylidene)benzohydrazide","","- C19 H22 N2 O3 -","- C19 H22 N2 O3 -","- C76 H88 N8 O12 -","4","1","SJ6159","Zhen, Xiao-Li; Han, Jian-Rong","(<i>E</i>)-<i>N</i>'-(4-Butoxy-3-methoxybenzylidene)benzohydrazide","Acta Crystallographica Section E","2005","61","12","o4282","o4284","10.1107/S1600536805038341","","","0.71073","MoKα","","0.1365","0.0484","","","0.0973","0.1253","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207653","9.2973","0.0006","13.206","0.0009","19.0372","0.0013","90","","90","","90","","2337.4","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Maleopimaric anhydride ethyl ester","","- C26 H36 O5 -","- C26 H36 O5 -","- C104 H144 O20 -","4","1","SJ6161","Yong-Hong Li; Tian-Rui Ren; Jian-Ping Guo; Jian-Cheng Liu","Maleopimaric anhydride ethyl ester","Acta Crystallographica Section E","2005","61","12","o4305","o4306","10.1107/S1600536805038390","","","0.71073","MoKα","","0.0727","0.0701","","","0.155","0.1562","","","","","","1.284","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207654","14.928","0.005","8.326","0.003","8.83","0.003","90","","90","","90","","1097.5","0.7","295","3","295","3","","","","","","","","6","P c a 21","P 2c -2ac","29","","catena-Poly[[aqua(1H-imidazole-κN)cadmium(II)]- μ-thiodiacetato-κ^4^O,S,O':O'']","","- C7 H10 Cd N2 O5 S -","- C7 H10 Cd N2 O5 S -","- C28 H40 Cd4 N8 O20 S4 -","4","1","SJ6162","Tian-Tian Pan; Duan-Jun Xu","<i>catena</i>-Poly[[aqua(1<i>H</i>-imidazole-κ<i>N</i>)cadmium(II)]-μ-thiodiacetato-κ^4^<i>O</i>,<i>S</i>,<i>O</i>':<i>O</i>'']","Acta Crystallographica Section E","2005","61","12","m2674","m2676","10.1107/S1600536805037608","","","0.71073","MoKα","","0.019","0.019","","","0.045","0.046","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207655","11.677","0.0001","13.5461","0.0001","19.063","0.0003","86.022","0.0005","86.1216","0.0005","72.6081","0.0005","2867.07","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-iodo-1κI:2κI-tris(tri-m-tolylphosphine)-1κ^2^P,P':2κP''-dicopper(I)","","- C63 H63 Cu2 I2 P3 -","- C63 H63 Cu2 I2 P3 -","- C126 H126 Cu4 I4 P6 -","2","1","SU6222","G. M. Golzar Hossain; Afroza Banu; Zaki S. Seddigi","Di-μ-iodo-1κ<i>I</i>:2κ<i>I</i>-tris(tri-<i>m</i>-tolylphosphine)-1κ^2^<i>P</i>,<i>P</i>':2κ<i>P</i>''-dicopper(I): a new polymorph","Acta Crystallographica Section E","2005","61","12","m2629","m2630","10.1107/S1600536805036925","","","0.71073","MoKα","","0.0376","0.0309","","","0.0715","0.0751","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207656","17.537","0.005","6.759","0.002","11.148","0.003","90","","118.557","0.004","90","","1160.6","0.6","293","2","273","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Methyl N-[4-(4,6-dimethylpyrimidin-2-ylamino)thiocarbonyl]carbamate","","- C9 H12 N4 O2 S -","- C9 H12 N4 O2 S -","- C36 H48 N16 O8 S4 -","4","0.5","SU6229","Ying-Hui Ren; Ji-Rong Song; Jie Huang; Xiao-Hong Sun; Huai-Ming Hu","Methyl <i>N</i>-[4-(4,6-dimethylpyrimidin-2-ylamino)thiocarbonyl]carbamate","Acta Crystallographica Section E","2005","61","12","o4013","o4015","10.1107/S160053680503549X","","","0.71073","MoKα","","0.0492","0.0389","","","0.11","0.1157","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207657","9.2193","0.0013","7.9209","0.0012","10.2436","0.0015","90","","90.034","0.002","90","","748.04","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","poly[μ~2~-4,4'-bipyridine-di-μ~2~-imidazolido-cadmium(II)]","","- C16 H14 Cd N6 -","- C16 H14 Cd N6 -","- C32 H28 Cd2 N12 -","2","0.5","SU6233","Jin-Yu Han; Jian Fang; He-Ying Chang; Yang Dong; Shuang Liang","Poly[μ~2~-4,4'-bipyridine-di-μ~2~-imidazolidocadmium(II)]","Acta Crystallographica Section E","2005","61","12","m2667","m2669","10.1107/S1600536805037293","","","0.71073","MoKα","","0.025","0.0208","","","0.0513","0.0547","","","","","","1.144","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207658","7.0605","0.0011","8.1633","0.0011","9.2352","0.0013","94.103","0.011","107.421","0.013","97.215","0.012","500.49","0.13","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","4-(Diethylamino)salicylaldehyde","","- C11 H15 N O2 -","- C11 H15 N O2 -","- C22 H30 N2 O4 -","2","1","SU6234","Vančo, Ján; Marek, Jaromír; Švajlenová, Oľga","4-(Diethylamino)salicylaldehyde","Acta Crystallographica Section E","2005","61","12","o4209","o4211","10.1107/S1600536805037323","","","0.71073","MoKα","","0.0434","0.036","","","0.0987","0.1032","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207659","7.2371","0.0014","9.5895","0.0019","11.633","0.002","75.8","0.03","75.5","0.03","72.69","0.03","733.4","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Benzimidazolium 3-carboxy-phenoxyacetate","","- C16 H14 N2 O5 -","- C16 H14 N2 O5 -","- C32 H28 N4 O10 -","2","1","SU6235","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Zhao, Jing-Gui","Benzimidazolium 4-carboxyphenoxyacetate","Acta Crystallographica Section E","2005","61","12","o3958","o3960","10.1107/S1600536805035105","","","0.71073","MoKα","","0.0734","0.0481","","","0.11","0.119","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207660","32.045","0.002","8.7676","0.0007","15.9796","0.001","90","","90","","90","","4489.6","0.5","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","Kynathrin cinnamic acid","2-amino-4,6-dimethylpyrimidine–cinnamic acid (1/2)","","- C24 H25 N3 O4 -","- C24 H25 N3 O4 -","- C192 H200 N24 O32 -","8","1","SU6236","Kasthuri Balasubramani; Packianathan Thomas Muthiah; Ramaswamy Karunanandam RajaRam; Balasubramanian Sridhar","Hydrogen-bonding patterns in 2-amino-4,6-dimethylpyrimidine–cinnamic acid (1/2)","Acta Crystallographica, Section E","2005","61","1","o4203","o4205","10.1107/S160053680503730X","","","0.71073","MoKα","","0.1074","0.048","","","0.1221","0.1576","","","","","","1.028","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2207661","11.052","0.002","6.721","0.0015","13.204","0.003","90","","114.344","0.003","90","","893.6","0.3","294","2","294","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","N-(3-Nitrophenyl)-1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxamide dimethylformamide solvate","","- C14 H18 N3 O8 P -","- C14 H18 N3 O8 P -","- C28 H36 N6 O16 P2 -","2","0.5","SU6238","Zang, Hong-Jun; Guo, Ming-Lin; Cheng, Bo-Wen; Ren, Yuan-Lin","<i>N</i>-(3-Nitrophenyl)-1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxamide dimethylformamide solvate","Acta Crystallographica Section E","2005","61","12","o4195","o4197","10.1107/S1600536805037311","","","0.71073","MoKα","","0.0704","0.0427","","","0.1093","0.1281","","","","","","1.007","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207662","11.649","0.004","11.774","0.004","13.292","0.004","90","","109.939","0.005","90","","1713.8","1","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[(1,10‒phenanthroline‒κ~2~N,N')(2,3‒pyridinedicarboxylate) manganese(II)].hydrate","","- C19 H13 Mn N3 O5 -","- C19 H13 Mn N3 O5 -","- C76 H52 Mn4 N12 O20 -","4","1","SU6239","Xue-Li Niu; Jian-Min Dou; Chang-Wen Hu; Da-Cheng Li; Da-Qi Wang","Poly[[(1,10-phenanthroline)(μ~3~-pyridine-2,3-dicarboxylato)manganese(II)] monohydrate]","Acta Crystallographica Section E","2005","61","12","m2507","m2509","10.1107/S1600536805035257","","","0.71073","MoKα","","0.1188","0.0604","","","0.1626","0.196","","","","","","1","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2207663","6.0749","0.0012","15.428","0.003","16.028","0.003","86.59","0.03","86.42","0.03","81.19","0.03","1479.7","0.5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","[Triaqua(2,2'-bipyridine-κ^2^N,N')(3-carboxyphenoxyacetato-κO)manganese(II)] 3-carboxylphenoxyacetate monohydrate","","- C28 H30 Mn N2 O14 -","- C28 H30 Mn N2 O14 -","- C56 H60 Mn2 N4 O28 -","2","1","SU6240","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Zhao, Jing-Gui","Triaqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(3-carboxyphenoxyacetato-κ<i>O</i>)manganese(II) 3-carboxyphenoxyacetate monohydrate","Acta Crystallographica Section E","2005","61","12","m2471","m2473","10.1107/S1600536805035336","","","0.71073","MoKα","","0.0616","0.0401","","","0.0843","0.0909","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207664","7.953","0.003","11.686","0.005","12.524","0.005","65.107","0.006","87.463","0.007","86.98","0.008","1054","0.7","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","(E)-1-(2,4-Dinitrophenyl)-2-{2-[2-(2-nitrophenoxy)ethoxy]benzylidene}hydrazine","","- C21 H17 N5 O8 -","- C21 H17 N5 O8 -","- C42 H34 N10 O16 -","2","1","SU6241","Diao, Chun-Hua; Fan, Zhi; Yu, Ming; Chen, Xin; Jing, Zuo-Liang","(<i>E</i>)-1-(2,4-Dinitrophenyl)-2-{2-[2-(2-nitrophenoxy)ethoxy]benzylidene}hydrazine","Acta Crystallographica Section E","2005","61","12","o4177","o4179","10.1107/S1600536805037487","","","0.71073","MoKα","","0.1038","0.0505","","","0.1236","0.1583","","","","","","0.997","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207665","13.8","0.003","8.232","0.0016","11.959","0.002","90","","103.36","0.03","90","","1321.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Methyl-N-(4-nitrophenyl)benzenesulfonamide","","- C13 H12 N2 O4 S -","- C13 H12 N2 O4 S -","- C52 H48 N8 O16 S4 -","4","1","SU6243","Jun-De Xing; Tao Zeng","4-Methyl-<i>N</i>-(4-nitrophenyl)benzenesulfonamide","Acta Crystallographica Section E","2005","61","12","o4318","o4319","10.1107/S160053680503847X","","","0.71073","MoKα","","0.041","0.037","","","0.115","0.12","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207666","7.8159","0.0016","8.0701","0.0016","25.165","0.005","90","","95.36","0.03","90","","1580.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","N-[4-(Ethoxycarbonyl)phenyl]-p-tolylsulfonamide","Ethyl 4-[(4-methylphenyl)sulfonylamino]benzoate","","- C16 H17 N O4 S -","- C16 H17 N O4 S -","- C64 H68 N4 O16 S4 -","4","1","SU6244","Jun-De Xing; Zhi-Hong Nan","<i>N</i>-[4-(Ethoxycarbonyl)phenyl]-<i>p</i>-tolylsulfonamide","Acta Crystallographica Section E","2005","61","12","o4320","o4321","10.1107/S1600536805038481","","","0.71073","MoKα","","0.054","0.041","","","0.121","0.129","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207667","13.8042","0.0009","6.791","0.0004","21.7163","0.0013","90","","90","","90","","2035.8","0.2","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Poly[di-μ~4~-1,4-benzenedicarboxylato-μ~6~-succinato-didysprosium(III)]","","- C20 H12 Dy2 O12 -","- C20 H12 Dy2 O12 -","- C80 H48 Dy8 O48 -","4","0.5","SU6248","Zhi-Feng Li; Chun-Xiang Wang","Poly[di-μ~4~-1,4-benzenedicarboxylato-μ~6~-succinato-didysprosium(III)]","Acta Crystallographica Section E","2005","61","12","m2689","m2690","10.1107/S1600536805038171","","","0.71073","MoKα","","0.0226","0.0212","","","0.0592","0.06","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207668","19.74","0.004","9.5361","0.0018","9.723","0.0018","90","","101.699","0.003","90","","1792.3","0.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","1-(4-Bromo-2-fluorophenyl)-3-trifluoromethyl-1H-pyrazol-5-yl benzenesulfonate","","- C16 H9 Br F4 N2 O3 S -","- C16 H9 Br F4 N2 O3 S -","- C64 H36 Br4 F16 N8 O12 S4 -","4","1","SU6251","Duan, Xue-Min; Fan, Mei-Lian; Zheng, Peng-Wu; Li, Jiang-Sheng; Huang, Peng-Mian","1-(4-Bromo-2-fluorophenyl)-3-trifluoromethyl-1<i>H</i>-pyrazol-5-yl benzenesulfonate","Acta Crystallographica Section E","2005","61","12","o4266","o4267","10.1107/S1600536805038183","","","0.71073","MoKα","","0.121","0.0526","","","0.12","0.1524","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207669","11.892","0.002","12.962","0.001","10.43","0.001","90","","108.8","0.01","90","","1521.9","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-6-(2,4-difluorophenyl)-7H-1,2,4- triazolo[3,4-b][1,3,4]thiadiazine","","- C16 H9 Cl F2 N4 S -","- C16 H9 Cl F2 N4 S -","- C64 H36 Cl4 F8 N16 S4 -","4","1","SU6252","Li-Xue Zhang; Jian-Yu Jin; San-Nu Zhou; Hong-Ping Xiao; An-Jiang Zhang","3-(4-Chlorophenyl)-6-(2,4-difluorophenyl)-7<i>H</i>-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazine","Acta Crystallographica Section E","2005","61","12","o4340","o4342","10.1107/S1600536805038201","","","0.71073","MoKα","","0.0401","0.0365","","","0.091","0.0934","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207670","5.876","0.0001","7.5163","0.0001","21.3393","0.0002","100.047","0.001","92.57","0.001","93.006","0.001","925.34","0.02","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Amino-1-benzyl-4-cyano-3-methylimidazolium toluene-p-sulfonate","","- C19 H20 N4 O3 S -","- C19 H20 N4 O3 S -","- C38 H40 N8 O6 S2 -","2","1","TK6267","Raja Dey; Tapati Banerjee; Vratislav Langer; Sibdas Ray; Priyobroto Roychowdhury","5-Amino-1-benzyl-4-cyano-3-methylimidazolium toluene-<i>p</i>-sulfonate","Acta Crystallographica Section E","2005","61","12","o4039","o4041","10.1107/S1600536805035610","","","0.71073","MoKα","","0.072","0.05","","","0.116","0.127","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207671","7.3551","0.0019","9.2458","0.0012","20.332","0.003","90","","90","","90","","1382.7","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-(-)-2,3-methylenedioxy-8-oxoberbine","","- C18 H15 N O3 -","- C18 H15 N O3 -","- C72 H60 N4 O12 -","4","1","TK6277","Gzella, Andrzej; Chrzanowska, Maria; Dreas, Agnieszka","(<i>S</i>)-(‒)-2,3-Methylenedioxy-8-oxoberbine","Acta Crystallographica Section E","2005","61","12","o4001","o4003","10.1107/S1600536805035609","","","1.54178","CuKα","","0.04","0.031","","","0.08","0.085","","","","","","1.07","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207672","8.9389","0.0003","12.1466","0.0004","9.4334","0.0003","90","","116.189","0.001","90","","919.11","0.05","295","1","295","1","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","trans-Diaqua(malonato)(1,10-phenanthroline)nickel(II) trihydrate","","- C15 H20 N2 Ni O9 -","- C15 H20 N2 Ni O9 -","- C30 H40 N4 Ni2 O18 -","2","0.5","TK6278","Shu-Min Zhao; Tian-Xing Wu","<i>trans</i>-Diaqua(malonato)(1,10-phenanthroline)nickel(II) trihydrate","Acta Crystallographica Section E","2005","61","12","m2544","m2545","10.1107/S1600536805035798","","","0.71069","MoKα","","0.028","0.025","","","0.067","0.076","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207673","5.46","0.006","8.496","0.007","7.433","0.006","90","","103.8","0.04","90","","334.9","0.5","100","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Trimethylammonium tetrafluoroborate","","- C3 H10 B F4 N -","- C3 H10 B F4 N -","- C6 H20 B2 F8 N2 -","2","0.5","TK6280","Gotoh, Kazuma; Ishikawa, Rie; Ishida, Hiroyuki","Trimethylammonium tetrafluoroborate at 100K","Acta Crystallographica Section E","2005","61","12","o4016","o4017","10.1107/S1600536805035592","","","0.71073","MoKα","","","0.045","","","","0.14","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207674","18.354","0.004","9.658","0.002","18.982","0.003","90","","119.69","0.02","90","","2923.1","1.2","293","2","295","2","","","","","","","","6","P 1 c 1","P -2yc","7","","catena-poly[triethylammonium [triphenylstannate(IV)-μ-2,5-thiophenedicarboxylato]]","","- C30 H33 N O4 S Sn -","- C30 H33 N O4 S Sn -","- C120 H132 N4 O16 S4 Sn4 -","4","2","TK6281","Ng, Seik Weng","Rerefinement of <i>catena</i>-poly[triethylammonium [triphenylstannate(IV)-μ-2,5-thiophenedicarboxylato]] in the space group <i>Pc</i>","Acta Crystallographica Section E","2005","61","12","m2512","m2513","10.1107/S1600536805035622","","","0.71073","MoKα","","0.055","0.041","","","0.101","0.111","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207675","14.4361","0.0019","14.4361","0.0019","8.2304","0.0015","90","","90","","90","","1715.2","0.4","294","2","294","2","","","","","","","","4","P 42/m b c","-P 4c 2ab","135","","N,N'-Bis(2-dimethylaminopropyl)dithiooxamide","","- C12 H26 N4 S2 -","- C12 H26 N4 S2 -","- C48 H104 N16 S8 -","4","0.25","TK6282","Cui, Jian-Zhong; Zhang, Dan; Lu, Fan-Li; Gao, Hong-Ling; Wang, Hai-Tao","<i>N</i>,<i>N</i>'-Bis(3-dimethylaminopropyl)dithiooxamide","Acta Crystallographica Section E","2005","61","12","o4011","o4012","10.1107/S1600536805035828","","","0.71073","MoKα","","0.081","0.045","","","0.115","0.151","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207676","8.7778","0.0016","24.029","0.004","4.7259","0.0009","90","","90","","90","","996.8","0.3","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","3-Ethoxy-4-[3-(2-ethoxy-4-formylphenoxy)propoxy]benzaldehyde","","- C21 H24 O6 -","- C21 H24 O6 -","- C42 H48 O12 -","2","0.5","TK6284","Han, Jian-Rong; Zhen, Xiao-Li","3-Ethoxy-4-[3-(2-ethoxy-4-formylphenoxy)propoxy]benzaldehyde","Acta Crystallographica Section E","2005","61","12","o4069","o4070","10.1107/S1600536805036299","","","0.71073","MoKα","","0.054","0.037","","","0.088","0.1","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207677","7.068","0.004","16.068","0.009","7.745","0.004","90","","93.171","0.01","90","","878.2","0.8","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-[4-(2-Formyl-6-methoxyphenoxy)butoxy]-3-methoxybenzaldehyde","","- C20 H22 O6 -","- C20 H22 O6 -","- C40 H44 O12 -","2","0.5","TK6285","Diao, Chun-Hua; Fan, Zhi; Yu, Ming; Chen, Xin; Jing, Zuo-Liang","2-[4-(2-Formyl-6-methoxyphenoxy)butoxy]-3-methoxybenzaldehyde","Acta Crystallographica Section E","2005","61","12","o4067","o4068","10.1107/S1600536805036317","","","0.71073","MoKα","","0.071","0.041","","","0.096","0.114","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207678","7.7378","0.0008","16.008","0.0016","7.2599","0.0007","90","","109.115","0.002","90","","849.68","0.15","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-bis(2-methylimidazol-3-ium-1-ylmethyl)benzene dibromide","2,2'-Dimethyl-3,3'-(p-phenylenedimethylene)diimidazol-1-ium dibromide","","- C16 H20 Br2 N4 -","- C16 H20 Br2 N4 -","- C32 H40 Br4 N8 -","2","0.5","TK6286","Liliana Dobrzańska","2,2'-Dimethyl-3,3'-(<i>p</i>-phenylenedimethylene)diimidazol-1-ium dibromide","Acta Crystallographica Section E","2005","61","12","o4113","o4115","10.1107/S1600536805036573","","","0.71073","MoKα","","0.027","0.025","","","0.063","0.064","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207679","10.22","0.009","9.204","0.006","11.386","0.007","90","","90.08","0.03","90","","1071","1.3","296","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(2-Nitrovinyl)-2,3,6,7-tetrahydrobenzo[1,2-b;4,5-b']difuran","","- C12 H11 N O4 -","- C12 H11 N O4 -","- C48 H44 N4 O16 -","4","1","WK6067","Wei-Ming Xu; Xiu-Rong Hu; Jian-Ming Gu","4-(2-Nitrovinyl)-2,3,6,7-tetrahydrobenzo[1,2-<i>b</i>;4,5-<i>b</i>']difuran","Acta Crystallographica Section E","2005","61","12","o4351","o4352","10.1107/S1600536805038493","","","0.71075","MoKα","","","0.0447","","","","0.1019","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207680","9.049","0.0018","10.242","0.002","11.013","0.002","69.26","0.03","81.68","0.03","64.33","0.03","860.3","0.4","295","","295","","","","","","","","","4","P -1","-P 1","2","","3-[(2-Hydroxyphenyl]amino]-1,3-diphenylprop-2-en-1-one","","- C21 H17 N O2 -","- C21 H17 N O2 -","- C42 H34 N2 O4 -","2","1","WK6068","Yao-Cheng Shi; Su-Hua Zhang","3-[(2-Hydroxyphenyl)amino]-1,3-diphenylprop-2-en-1-one","Acta Crystallographica Section E","2005","61","12","o4362","o4364","10.1107/S1600536805039085","","","0.71073","MoKα","","0.147","0.051","","","0.1173","0.1536","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207681","15.5203","0.0013","7.7786","0.0006","6.4822","0.0005","90","","90","","90","","782.57","0.11","293","2","293","2","","","","","","","Synthetic","5","P n m a","-P 2ac 2n","62","","potassium magnesium hydrogendiphosphate dihydrate","","- H5 K Mg O9 P2 -","- H5 K Mg O9 P2 -","- H20 K4 Mg4 O36 P8 -","4","0.5","WM6097","El Bali, Brahim; Alaoui Tahiri, Aziz; Lachkar, Mohammed; Arriortua, Marcaida Isabel; Urtiaga, Miren Karmele","KMg(HP~2~O~7~).2H~2~O","Acta Crystallographica, Section E","2005","61","12","i275","i277","10.1107/S1600536805036731","","","0.71073","MoKα","","0.0369","0.033","","","0.0862","0.0886","","","","","","1.054","","","","has coordinates","282068","2023-03-26","10:12:40",""
"2207682","11.922","0.001","11.922","0.001","11.922","0.001","90","","90","","90","","1694.5","0.2","293","1","293","1","","","","","","","Diamantina, Minas Gerais, Brazil","5","I a -3 d","-I 4bd 2c 3","230","grossular-andradite","magnesium aluminium silicon calcium titanium manganese iron dodecaoxide","Grossular","- Al1.338 Ca3 Fe0.662 O12 Si3 -","- Al1.338 Ca3 Fe0.662 O12 Si3 -","- Al10.704 Ca24 Fe5.296 O96 Si24 -","8","0.0833333","WM6106","Resende, Jackson Antônio Lamounier Camargos; Fernandes, Nelson G.","X-ray powder refinement of a natural garnet from Diamantina, Minas Gerais, Brazil","Acta Crystallographica, Section E","2005","61","12","i265","i267","10.1107/S1600536805035695","","","1.5405","CuKα~1~","","","","","","","","","","1.47","","","","","","","has coordinates","282068","2023-03-26","10:12:40",""
"2207683","6.9712","0.0004","6.9712","0.0004","6.2431","0.0004","90","","90","","90","","303.4","0.03","293","2","293","2","","","","","","","Synthetic","3","I 41/a m d :2","-I 4bd 2","141","Ytterbium Arsenate","Ytterbium(III) Oxoarsenate(V)","","- As O4 Yb -","- As O4 Yb -","- As4 O16 Yb4 -","4","0.125","WM6109","Kang, Dong-Hee; Höss, Patrick; Schleid, Thomas","Xenotime-type Yb[AsO~4~]","Acta Crystallographica, Section E","2005","61","12","i270","i272","10.1107/S1600536805036457","","","0.71069","MoKα","","0.0095","0.009","","","0.0226","0.023","","","","","","1.064","","","","has coordinates","282068","2023-03-26","10:12:40",""
"2207684","3.9152","0.0005","20.948","0.003","3.9313","0.0006","90","","90","","90","","322.43","0.08","295","2","295","2","","","","","","","","3","C m m m","-C 2 2","65","Erbium Nickel Trisilicide","Erbium Nickel Trisilicon","","- Er Ni Si3 -","- Er Ni Si3 -","- Er4 Ni4 Si12 -","4","0.25","WM6110","Kończyk, J.; Demchenko, P.; Demchenko, G.; Bodak, O.; Marciniak, B.","Erbium nickel trisilicide, ErNiSi~3~","Acta Crystallographica Section E","2005","61","12","i259","i261","10.1107/S160053680503566X","","","0.71073","MoKα","","0.0166","0.0163","","","0.0396","0.0398","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207685","6.836","0.001","6.836","0.001","4.148","0.0009","90","","90","","120","","167.87","0.05","295","2","295","2","","","","","","","","4","P -6 2 m","P -6 -2","189","Trierbium Nickel Trialuminium Digermanide","Trialuminium trierbium digermanium nickel","","- Al3 Er3 Ge2 Ni -","- Al3 Er3 Ge2 Ni -","- Al3 Er3 Ge2 Ni -","1","0.0833333","WM6111","Demchenko, G.; Kończyk, J.; Demchenko, P.; Bodak, O.; Marciniak, B.","Trierbium nickel trialuminium digermanide, Er~3~NiAl~3~Ge~2~","Acta Crystallographica Section E","2005","61","12","i273","i274","10.1107/S1600536805036779","","","0.71073","MoKα","","0.0282","0.0282","","","0.0731","0.0731","","","","","","1.208","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207686","7.5529","0.0004","7.6961","0.0004","11.3787","0.0005","90","","90.178","0.004","90","","661.42","0.06","299","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Iodic acid‒diiodine pentaoxide (1/1)","","- H I3 O8 -","- H I3 O8 -","- H4 I12 O32 -","4","1","WM6113","Andreas Fischer","Redetermination of HI~3~O~8~, an adduct of formula HIO~3~·I~2~O~5~","Acta Crystallographica Section E","2005","61","12","i278","i279","10.1107/S1600536805037037","","","0.71073","MoKα","","0.021","0.02","","","0.044","0.044","","","","","","1.27","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207687","9.994","0.003","10.541","0.004","12.372","0.006","90","","91.73","0.02","90","","1302.8","0.9","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tricaesium tetraselenidoarsenate(V) monohydrate","","- As Cs3 H2 O Se4 -","- As Cs3 H2 O Se4 -","- As4 Cs12 H8 O4 Se16 -","4","1","WM6117","Tobias van Almsick; William S. Sheldrick","Tricaesium tetraselenidoarsenate(V) monohydrate","Acta Crystallographica Section E","2005","61","12","i280","i281","10.1107/S1600536805038055","","","0.71073","MoKα","","0.1276","0.068","","","0.1646","0.2014","","","","","","1.152","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2207688","14.1439","0.0002","9.9908","0.0002","23.2964","0.0004","90","","105.137","0.0009","90","","3177.76","0.1","160","1","160","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[tri-n-butyltin(IV)]-μ-2-{(E)-4-hydroxy-3-[(E)-4- methylphenyliminomethyl]phenyldiazenyl}benzoato-κ^2^O:O']","","- C33 H43 N3 O3 Sn -","- C33 H43 N3 O3 Sn -","- C132 H172 N12 O12 Sn4 -","4","1","WN2001","Linden, Anthony; Basu Baul, Tushar S.; Singh, Keisham S.","<i>catena</i>-Poly[[tri-<i>n</i>-butyltin(IV)]-μ-2-{(<i>E</i>)-4-hydroxy-3-[(<i>E</i>)-4-methylphenyliminomethyl]phenyldiazenyl}benzoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","12","m2711","m2713","10.1107/S1600536805038675","","","0.71073","MoKα","","0.0538","0.0367","","","0.0799","0.088","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2207689","7.7711","0.0016","9.7259","0.0019","9.825","0.004","90","","118.29","0.02","90","","653.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-1,4-bis(pyrimidin-2-ylsulfanyl)but-2-ene","","- C12 H12 N4 S2 -","- C12 H12 N4 S2 -","- C24 H24 N8 S4 -","2","0.5","WN6383","Zhang, Hai-Yue; Sun, Hua; Mu, Shi-Cheng; Wang, Jing-Kang; Chen, Wei","<i>trans</i>-1,4-Bis(pyrimidin-2-ylsulfanyl)but-2-ene","Acta Crystallographica Section E","2005","61","12","o4142","o4143","10.1107/S1600536805031296","","","0.71073","MoKα","","0.1297","0.094","","","0.2293","0.2548","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207690","5.1232","0.0008","9.5108","0.0015","15.566","0.003","85.297","0.003","81.159","0.003","86.289","0.003","745.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H12 N4 O5 -","- C15 H12 N4 O5 -","- C30 H24 N8 O10 -","2","1","WN6391","Yong-Tao Wang; Gui-Mei Tang; Da-Wei Qin","Cocrystal of 2,5-di-4-pyridyl-1,3,4-oxadiazole and malonic acid (1/1)","Acta Crystallographica Section E","2005","61","12","o3979","o3980","10.1107/S1600536805035208","","","0.71073","MoKα","","0.0854","0.0575","","","0.1579","0.1858","","","","","","1.005","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207691","10.3031","0.0016","10.7991","0.0017","17.207","0.003","90","","101.942","0.003","90","","1873.1","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Cyclopentyl-4-(4-fluorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinoline- 2,5-dione","","- C22 H26 F N O2 -","- C22 H26 F N O2 -","- C88 H104 F4 N4 O8 -","4","1","WN6393","Shujiang Tu; Xiaotong Zhu; Jinpeng Zhang; Jianing Xu; Qian Wang","1-Cyclopentyl-4-(4-fluorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinoline-2,5-dione","Acta Crystallographica Section E","2005","61","12","o4372","o4373","10.1107/S1600536805038936","","","0.71073","MoKα","","0.0837","0.0447","","","0.1011","0.1223","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207692","7.5862","0.0006","10.5414","0.0009","15.6452","0.0013","90","","102.913","0.001","90","","1219.49","0.17","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(5-(4-hydroxy-3-methoxyphenyl)-3-methyl-4,5-dihydropyrazol-1-yl)-ethanone","","- C13 H16 N2 O3 -","- C13 H16 N2 O3 -","- C52 H64 N8 O12 -","4","1","WN6396","Wang, Shi-Fan; zhu, Wei; Yang, Xian; Zhou, Li-Jun","1-[5-(4-Hydroxy-3-methoxyphenyl)-3-methyl-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]ethanone","Acta Crystallographica Section E","2005","61","12","o3985","o3986","10.1107/S160053680503518X","","","0.71073","MoKα","","0.0629","0.0495","","","0.1335","0.1413","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207693","15.376","0.0003","11.5504","0.0002","26.0798","0.0005","90","","90","","90","","4631.75","0.15","273","2","273","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Diethyl 2-(3,4-dicyanophenyl)-2-[(2-naphthyl)methyl]malonate","","- C26 H22 N2 O4 -","- C26 H22 N2 O4 -","- C208 H176 N16 O32 -","8","2","WN6398","Sema Öztürk Yıldırım; Mehmet Akkurt; M. Kasım Şener; Makbule Burkut Koçak; H.-K. Fun","Diethyl 2-(3,4-dicyanophenyl)-2-[(2-naphthyl)methyl]malonate","Acta Crystallographica Section E","2005","61","12","o4101","o4103","10.1107/S1600536805036494","","","0.71073","MoKα","","0.1193","0.0533","","","0.0973","0.1181","","","","","","1.011","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2207694","7.165","0.002","16.345","0.002","13.963","0.003","90","","90","","90","","1635.2","0.6","295","2","295","2","","","","","","","","3","P n a 21","P 2c -2n","33","","10-(3-Methoxybenzylidene)anthrone","","- C22 H16 O2 -","- C22 H16 O2 -","- C88 H64 O8 -","4","1","WN6399","Wei Zhou; Xue-Feng Liu; Wei-Xiao Hu; Chun-Nian Xia","10-(3-Methoxybenzylidene)anthrone","Acta Crystallographica Section E","2005","61","12","o4263","o4265","10.1107/S1600536805038195","","","0.71073","MoKα","","0.1304","0.0534","","","0.1464","0.1841","","","","","","1.051","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207695","14.343","0.002","9.1271","0.0017","12.2913","0.0018","90","","99.46","0.006","90","","1587.2","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis{[2-hydroxy-κO-1,1-bis(hydroxymethyl)ethylamino-κN]acetato-κO}copper(II)","","- C12 H24 Cu N2 O10 -","- C12 H24 Cu N2 O10 -","- C48 H96 Cu4 N8 O40 -","4","1","WW6396","Gao, En-Jun; Ding, Li-Na; Chen, Mao-Sheng; Sun, Ya-Guang; He, Ling-Ling","Bis{[2-hydroxy-κ<i>O</i>-1,1-bis(hydroxymethyl)ethylamino-κ<i>N</i>]acetato-κ<i>O</i>}copper(II)","Acta Crystallographica Section E","2005","61","12","m2720","m2721","10.1107/S1600536805038602","","","0.71073","MoKα","","0.0585","0.0415","","","0.1062","0.1176","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207696","12.77","0.003","8.4986","0.0017","14.568","0.003","90","","100.162","0.006","90","","1556.2","0.6","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-poly[cadmium(II)-μ-1,2-bis(imidazol-1-yl)ethane-κ^2^N^3^:N^3'^- di-μ-1,5-dicyanamido-κ^4^N^1^:N^5^]","","- C12 H10 Cd N10 -","- C12 H10 Cd N10 -","- C48 H40 Cd4 N40 -","4","0.5","WW6418","Zhang, Yong; Wang, Zhao-Hui; Zhang, Yu-Ping; Li, Bao-Long","A novel triple-stranded cadmium(II) polymer chain: <i>catena</i>-poly[cadmium(II)-μ-1,2-bis(imidazol-1-yl)ethane-κ^2^<i>N</i>^3^:<i>N</i>^3'^-di-μ-1,5-dicyanamido-κ^4^<i>N</i>^1^:<i>N</i>^5^]","Acta Crystallographica Section E","2005","61","12","m2722","m2725","10.1107/S1600536805038626","","","0.71073","MoKα","","0.0216","0.0199","","","0.0527","0.0541","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207697","8.3939","0.001","15.8376","0.0019","9.9983","0.0012","90","","109.821","0.002","90","","1250.4","0.3","292","2","292","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Methyl 2-benzyloxy-6-(2-methyl-1,3-dioxolan-2-yl)benzoate monohydrate","","- C12 H16 O6 -","- C12 H16 O6 -","- C48 H64 O24 -","4","1","WW6435","Li, Yuanxiang","Methyl 2-benzyloxy-6-(2-methyl-1,3-dioxolan-2-yl)benzoate monohydrate","Acta Crystallographica Section E","2005","61","12","o4225","o4226","10.1107/S1600536805036676","","","0.71073","MoKα","","0.0583","0.0446","","","0.1319","0.1555","","","","","","1.138","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207698","12.4808","0.0015","12.0528","0.0015","20.146","0.003","90","","107.031","0.004","90","","2897.6","0.7","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Bromo-1'-ethyl-4-(1-ethyl-3,3-dimethyl-2,3-dimethyl-1H-indolin-2- ylidenemethyl)-3',3'-dimethylspiro[3,4-dihydro-2H-1-benzopyran-2,2'(3'H)- 1H-indoline]","","- C33 H37 Br N2 O -","- C33 H37 Br N2 O -","- C132 H148 Br4 N8 O4 -","4","1","WW6438","Zhang, Feng; Jin, Dan; Zhang, Yong; Zhang, De-Chun","6-Bromo-1'-ethyl-4-(1-ethyl-3,3-dimethyl-1<i>H</i>-indolin-2-ylidenemethyl)-3',3'-dimethylspiro[3,4-dihydro-2<i>H</i>-1-benzopyran-2,2'(3'<i>H</i>)-1'<i>H</i>-indoline], a dicondensed spiropyran","Acta Crystallographica Section E","2005","61","12","o4085","o4087","10.1107/S160053680503624X","","","0.7107","MoKα","","0.0748","0.0568","","","0.117","0.1244","","","","","","1.154","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207699","15.744","0.003","10.956","0.002","15.094","0.003","90","","114.74","0.03","90","","2364.6","1","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-3-carboxylatophenoxyacetato)bis[aquabis(1H-benzimidazole)dicadmium(II)] dihydrate","","- C46 H44 Cd2 N8 O14 -","- C46 H44 Cd2 N8 O14 -","- C92 H88 Cd4 N16 O28 -","2","0.5","WW6441","Zhao, Hui; Huo, Li-Hua; Gao, Shan; Zhao, Jing-Gui","Bis(μ-3-carboxylatophenoxyacetato)bis[aquabis(1<i>H</i>-benzimidazole)cadmium(II)] dihydrate","Acta Crystallographica Section E","2005","61","12","m2686","m2688","10.1107/S1600536805036895","","","0.71073","MoKα","","0.0667","0.0459","","","0.0979","0.1051","","","","","","1.044","","","","has coordinates,has Fobs","194538","2020-10-21","18:00:00",""
"2207700","12.2603","0.0011","15.2255","0.0012","12.323","0.0011","90","","108.462","0.0011","90","","2181.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Di-tert-butylphosphino)cobaltocenium hexafluorophosphate","","- C18 H27 Co F6 P2 -","- C18 H27 Co F6 P2 -","- C72 H108 Co4 F24 P8 -","4","1","XU6062","Ren, Yong; Yu, Guang-Ao; Liu, Sheng-Hua","(Di-<i>tert</i>-butylphosphino)cobaltocenium hexafluorophosphate","Acta Crystallographica Section E","2005","61","12","m2714","m2715","10.1107/S1600536805038596","","","0.71073","MoKα","","0.081","0.06","","","0.167","0.184","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207701","8.5489","0.0016","9.1426","0.0018","15.213","0.003","90.7","0.003","102.656","0.003","107.516","0.003","1102.4","0.4","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","1-Chloromercurio-2-{(2-chlorophenyl)[(3-chlorophenyl)imino]methyl}ferrocene","","- C23 H16 Cl3 Fe Hg N -","- C23 H16 Cl3 Fe Hg N -","- C46 H32 Cl6 Fe2 Hg2 N2 -","2","1","XU6064","Hong-Xing Wang; Hui-Chao Zhou; Hong-Fei Wu; Ying-Jie Li; Feng-Ying Geng","1-Chloromercurio-2-{(2-chlorophenyl)[(3-chlorophenyl)imino]methyl}ferrocene","Acta Crystallographica Section E","2005","61","12","m2570","m2571","10.1107/S1600536805036287","","","0.71073","MoKα","","0.05","0.035","","","0.085","0.094","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207702","7.4046","0.0009","9.6272","0.0011","12.5769","0.0017","81.988","0.005","74.517","0.004","89.581","0.007","855.16","0.18","295","1","295","1","","","","","","","","5","P -1","-P 1","2","","Di-μ-pyridine-2,5-dicarboxylato-1κ^2^N,O^2^:2κO^5^;1κO^5^:2κ^2^N,O^2^- bis[aqua(2,2'-bipyridine-κ^2^N,N')cadmium(II)] dihydrate","","- C34 H30 Cd2 N6 O12 -","- C34 H30 Cd2 N6 O12 -","- C34 H30 Cd2 N6 O12 -","1","0.5","XU6069","Shu-Min Zhao; Tian-Xing Wu; Qing-Sen Yu","Di-μ-pyridine-2,5-dicarboxylato-1κ^2^<i>N</i>,<i>O</i>^2^:2κ<i>O</i>^5^;1κ<i>O</i>^5^:2κ^2^<i>N</i>,<i>O</i>^2^-bis[aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cadmium(II)] dihydrate","Acta Crystallographica Section E","2005","61","12","m2505","m2506","10.1107/S1600536805034914","","","0.71073","MoKα","","0.047","0.044","","","0.125","0.128","","","","","","1.21","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207703","16.6996","0.0008","19.5711","0.0006","22.968","0.0011","90","","90","","90","","7506.6","0.6","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","A heterobimetallic zinc(II)/uranium(IV) complex with the Schiff base 2-amino-N,N'-bis(3-hydroxysalicylidene)benzylamine tetrahydrofuran solvate","","- C40 H41 N3 O9 U Zn -","- C40 H41 N3 O9 U Zn -","- C320 H328 N24 O72 U8 Zn8 -","8","1","XU6075","Salmon, Lionel; Thuéry, Pierre; Ephritikhine, Michel","A heterobimetallic zinc(II)/uranium(IV) complex with the Schiff base 2-amino-<i>N</i>,<i>N</i>'-bis(3-hydroxysalicylidene)benzylamine","Acta Crystallographica Section E","2005","61","12","m2607","m2609","10.1107/S1600536805035488","","","0.71073","MoKα","","0.118","0.048","","","0.066","0.083","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207704","9.6256","0.0015","15.676","0.003","13.502","0.002","90","","97.223","0.002","90","","2021.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[Dimethyl 5,6,7,8,15,16-hexahydro-6,7-dioxo-5,8,14,17- tetraazadibenzo[a,g]cyclotetradeca-3,9,13,17-tetraene-13,18-dicarboxylato- κ^4^N,N',N''',N'''']copper(II)","","- C22 H18 Cu N4 O6 -","- C22 H18 Cu N4 O6 -","- C88 H72 Cu4 N16 O24 -","4","1","XU6076","He, Jun-Hong; Yue, Lei; Li, Xiao-Zeng; Zhang, Wen-Qin; Liu, Bao-Lin","[Dimethyl 5,6,7,8,15,16-hexahydro-6,7-dioxo-5,8,14,17-tetraazadibenzo[<i>a</i>,<i>g</i>]cyclotetradeca-3,9,13,17-tetraene-13,18-dicarboxylato-κ^4^<i>N</i>,<i>N</i>',<i>N</i>''',<i>N</i>'''']copper(II)","Acta Crystallographica Section E","2005","61","12","m2709","m2710","10.1107/S160053680503833X","","","0.71073","MoKα","","0.061","0.037","","","0.092","0.105","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207705","7.6164","0.0015","15.542","0.003","15.186","0.003","90","","94.6","0.03","90","","1791.8","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(1,10-phenanthroline-κ^2^N,N')zinc(II)]-μ-3- carboxylatophenoxyacetato-κ^2^O,O':κ^2^O'',O''']","","- C21 H14 N2 O5 Zn -","- C21 H14 N2 O5 Zn -","- C84 H56 N8 O20 Zn4 -","4","1","XU6077","Deng, Zhao-Peng; Gao, Shan; Huo, Li-Hua; Zhao, Jing-Gui","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II)]-μ-3-carboxylatophenoxyacetato-κ^2^<i>O</i>,<i>O</i>':κ^2^<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2005","61","12","m2520","m2522","10.1107/S1600536805035750","","","0.71073","MoKα","","0.046","0.034","","","0.082","0.088","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207706","11.766","0.003","6.7824","0.0019","14.429","0.004","90","","100.099","0.004","90","","1133.6","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquabis(2,3-dimethylpyrazine 1,4-dioxide-κO)bis(thiocyanato- κN)manganese(II) dihydrate","","- C14 H24 Mn N6 O8 S2 -","- C14 H24 Mn N6 O8 S2 -","- C28 H48 Mn2 N12 O16 S4 -","2","0.5","XU6079","Wu, Chang-Ju; Zhang, Xia; Liu, Lian-Dong; Shi, Jing-Min","Diaquabis(2,3-dimethylpyrazine 1,4-dioxide-κ<i>O</i>)bis(thiocyanato-κ<i>N</i>)manganese(II) dihydrate","Acta Crystallographica Section E","2005","61","12","m2590","m2591","10.1107/S1600536805036524","","","0.71073","MoKα","","0.057","0.044","","","0.105","0.112","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207707","7.8468","0.0016","8.8428","0.0018","9.6395","0.0019","70.08","0.03","75.26","0.03","88.53","0.03","606.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[bromomercury(II)]-di-μ-bromo-κ^4^Br:Br-[bromomercury(II)]- μ-1,4-bis(benzylsulfanyl)butane-κ^2^S:S']","","- C9 H11 Br2 Hg S -","- C9 H11 Br2 Hg S -","- C18 H22 Br4 Hg2 S2 -","2","1","XU6080","Che, Guang-Bo; Liu, Chun-Bo; Cui, Yun-Cheng; Li, Chuan-Bi","<i>catena</i>-Poly[[bromomercury(II)]-di-μ-bromo-κ^4^<i>Br</i>:<i>Br</i>-[bromomercury(II)]-μ-1,4-bis(benzylsulfanyl)butane-κ^2^<i>S</i>:<i>S</i>']","Acta Crystallographica Section E","2005","61","12","m2704","m2705","10.1107/S1600536805038754","","","0.71073","MoKα","","0.055","0.043","","","0.115","0.122","","","","","","1.102","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207708","8.443","0.0005","11.2269","0.0007","15.8025","0.001","99.098","0.001","91.778","0.001","103.189","0.001","1436.53","0.15","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","Bis(2,2'-bipyridine-κ^2^N,N')chlorocopper(II) 3-carboxybenzenesulfonate trihydrate","","- C27 H27 Cl Cu N4 O8 S -","- C27 H27 Cl Cu N4 O8 S -","- C54 H54 Cl2 Cu2 N8 O16 S2 -","2","1","XU6081","Cai, Lei; Xiao, Hong-Ping; Zhu, Long-Guan","Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')chlorocopper(II) 3-carboxybenzenesulfonate trihydrate","Acta Crystallographica Section E","2005","61","12","m2546","m2547","10.1107/S1600536805036044","","","0.71073","MoKα","","0.055","0.051","","","0.127","0.13","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","199607","2020-10-21","18:00:00",""
"2207709","14.408","0.002","14.408","","21.63","0.004","90","","90","","120","","3888.6","0.9","295","2","295","2","","","","","","","","5","P 65","P 65","170","","catena-Poly[[[tris(pyridine-κN)copper(II)]-μ-3-carboxylatophenoxyacetato- κ^2^O^3^:O'] trihydrate]","","- C24 H27 Cu N3 O8 -","- C24 H27 Cu N3 O8 -","- C144 H162 Cu6 N18 O48 -","6","1","XU6084","Gao, Shan; Ng, Seik Weng","<i>catena</i>-Poly[[[tris(pyridine-κ<i>N</i>)copper(II)]-μ-3-carboxylatophenoxyacetato-κ^2^<i>O</i>^3^:<i>O</i>'] trihydrate]","Acta Crystallographica Section E","2005","61","12","m2696","m2698","10.1107/S1600536805038316","","","0.71073","MoKα","","0.097","0.073","","","0.138","0.146","","","","","","1.242","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207710","10.8426","0.0011","10.722","0.0011","14.7728","0.0016","100.564","0.002","103.537","0.002","111.743","0.002","1479.9","0.3","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","Hexakis[μ~2~-4-(N-n-butylimino)pentan-2-onato]trimagnesium(II)","","- C54 H96 Mg3 N6 O6 -","- C54 H96 Mg3 N6 O6 -","- C54 H96 Mg3 N6 O6 -","1","0.5","YA6262","Matthews, J.S.; Ouattara, T. S.; Butcher, R. J.","Hexakis[μ~2~-4-(<i>N</i>-<i>n</i>-butylimino)pentan-2-onato]trimagnesium(II)","Acta Crystallographica Section E","2005","61","12","m2598","m2600","10.1107/S1600536805033830","","","0.71073","MoKα","","0.128","0.068","","","0.14","0.164","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207711","9.7231","0.0019","15.992","0.002","25.143","0.003","90","","95.23","0.03","90","","3893.3","1","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diethanol(2-hydroxy-2,2-diphenylacetato)pyridinecopper(II)","","- C42 H44 Cu N2 O8 -","- C42 H44 Cu N2 O8 -","- C168 H176 Cu4 N8 O32 -","4","0.5","YA6268","Zhu, Li-Na; Gao, Shan; Huo, Li-Hua; Zhao, Hui","Diethanol(2-hydroxy-2,2-diphenylacetato)pyridinecopper(II)","Acta Crystallographica Section E","2005","61","12","m2646","m2648","10.1107/S1600536805037281","","","0.71073","MoKα","","0.044","0.037","","","0.111","0.115","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207712","7.4595","0.0008","13.754","0.001","9.723","0.001","90","","108.914","0.001","90","","943.7","0.16","295","2","295","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dimethyl(1,10-phenanthroline)(pyridine-2,6-dicarboxylato)tin","","- C21 H17 N3 O4 Sn -","- C21 H17 N3 O4 Sn -","- C42 H34 N6 O8 Sn2 -","2","0.5","YA6270","Ji-Kun Li; Ru-Fen Zhang; Chun-Lin Ma","Dimethyl(1,10-phenanthroline)(pyridine-2,6-dicarboxylato)tin(IV)","Acta Crystallographica Section E","2005","61","12","m2694","m2695","10.1107/S1600536805037748","","","0.71073","MoKα","","0.028","0.025","","","0.058","0.059","","","","","","1.053","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2238957","8.4996","0.0006","20.1067","0.0014","11.774","0.0008","90","","103.544","0.001","90","","1956.2","0.2","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis(μ-4-sulfamoylbenzoato)bis[chloro(di-2-pyridylamine)copper(II)] dihydrate","","- C34 H34 Cl2 Cu2 N8 O10 S2 -","- C34 H34 Cl2 Cu2 N8 O10 S2 -","- C68 H68 Cl4 Cu4 N16 O20 S4 -","2","0.5","BD6014","Li, Xin-Hua","Bis(μ-4-sulfamoylbenzoato)bis[chloro(di-2-pyridylamine)copper(II)] dihydrate","Acta Crystallographica Section E Structure Reports Online","2005","61","12","m2623","","10.1107/S1600536805036858","","","0.71073","MoKα","","0.0402","0.0355","","","0.0883","0.0911","","","","","","1.054","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2240921","9.685","","9.685","","9.685","","90","","90","","120","","786.737","","","","","","","","","","","","","4","R 3 :H","R 3","146","","Cs4 Sr Sn3 Se9","","- Cs4 Se9 Sn3 Sr -","- Cs4 Se9 Sn3 Sr -","- Cs12 Se27 Sn9 Sr3 -","3","0.333333","","Van Almsick, T.; Sheldrick, W. S.","Tetracesium strontium catena-nona-selenidotristannate(IV)","Acta Crystallographica Section E","2005","61","11","i225","i227","10.1107/S1600536805031090","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9007983","11.852","","12.458","","6.3861","","90","","113.84","","90","","862.47","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Ca0.312 Fe2 Mg Na0.376 O12 P3 -","- Ca0.312 Fe2 Mg Na0.376 O12 P3 -","- Ca1.248 Fe8 Mg4 Na1.504 O48 P12 -","4","0.5","","Zid, M. F.; Driss, A.; Jouini, T.","(Na0.38,Ca0.31)MgFe2P3O12","Acta Crystallographica, Section E","2005","61","","i46","i48","10.1107/S1600536805006756","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007984","16.292","","7.2154","","13.68","","90","","90","","90","","1608.13","","","","","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- Cs2 O15 Si6 Th -","- Cs2 O15 Si6 Th -","- Cs8 O60 Si24 Th4 -","4","1","","Woodward, J. D.; Almond, P. M.; Albrecht-Schmitt T E","Caesium thorium silicate, Cs2ThSi6O15","Acta Crystallographica, Section E","2005","61","","i58","i60","10.1107/S1600536805008421","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007985","10.898","","21.521","","6.623","","90","","90","","90","","1553.33","","","","","","","","","","","","","4","C m c e","-C 2ac 2","64","","","","- As4 Fe3 K3 O16 -","- As4 Fe3 K3 O16 -","- As16 Fe12 K12 O64 -","4","0.25","","Ouerfelli, N.; Zid, M. F.; Jouini, T.","Compose a charpente bidimensionnelle K3Fe3(AsO4)4","Acta Crystallographica, Section E","2005","61","","i67","i69","10.1107/S1600536805008998","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007986","6.7964","","6.7964","","24.7282","","90","","90","","90","","1142.22","","","","","","","","","","","","","3","P 41","P 4w","76","","","Percleveite-(Ce)","- Ce2 O7 Si2 -","- Ce2 O7 Si2 -","- Ce16 O56 Si16 -","8","2","","Deng, B.; Ibers, J. A.","Dicerium disilicate, Ce2[Si2O7]","Acta Crystallographica, Section E","2005","61","","i76","i78","10.1107/S1600536805011049","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007987","10.188","","10.188","","10.188","","90","","90","","90","","1057.47","","","","","","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- H8 Mn2 N2 O12 S3 -","- H8 Mn2 N2 O12 S3 -","- H32 Mn8 N8 O48 S12 -","4","0.333333","","Zhang, X. M.; Hao, Z. M.; Ng, S. W.","Langbeinite-type (NH4)2Mn2(SO4)3","Acta Crystallographica, Section E","2005","61","","i82","i83","10.1107/S1600536805011736","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007988","6.9463","","7.2563","","15.0697","","90","","94.791","","90","","756.926","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Cd O3 Si -","- Cd O3 Si -","- Cd12 O36 Si12 -","12","3","","Weil, M.","Parawollastonite-type Cd3[Si3O9]","Acta Crystallographica, Section E","2005","61","","i102","i104","10.1107/S1600536805015278","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007989","10.568","","18.258","","5.025","","90","","90","","90","","969.576","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Co H8 O12 P2 Zn2 -","- Co H8 O12 P2 Zn2 -","- Co4 H32 O48 P8 Zn8 -","4","0.5","","Wu, W. Y.; Liang, X. Q.; Li, Y. Z.","CoZn2(PO4)2*4H2O, a cobalt-doped modification of hopeite","Acta Crystallographica, Section E","2005","61","","i105","i107","10.1107/S1600536805014078","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007990","10.562","","18.224","","5.0133","","90","","90","","90","","964.969","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- H8 Ni O12 P2 Zn2 -","- H8 Ni O12 P2 Zn2 -","- H32 Ni4 O48 P8 Zn8 -","4","0.5","","Wu, W. Y.; Liang, X. Q.; Li, Y. Z.","NiZn2(PO4)2*4H2O, a nickel-doped modification of hopeite","Acta Crystallographica, Section E","2005","61","","i108","i110","10.1107/S160053680501408X","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007991","5.672","","10.737","","16.742","","90","","90","","90","","1019.59","","150","2","150","2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- K Nb5 O13 -","- K Nb5 O13 -","- K4 Nb20 O52 -","4","0.5","MG6037","Kwak, J.; Yun, H.; Chae, H. K.","A new potassium niobate, KNb~5~O~13~","Acta Crystallographica Section E","2005","61","7","i132","i134","10.1107/S1600536805017897","","","0.71073","MoKα","","","0.0189","","","","0.0455","","","","","","1.185","","","","has coordinates","282068","2023-03-26","10:21:06",""
"9007994","10.5565","","10.5565","","7.7584","","90","","90","","120","","748.76","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","","- Ba5 Cl O12 V3 -","- Ba5 Cl O12 V3 -","- Ba10 Cl2 O24 V6 -","2","0.166667","","Roh, Y. H.; Hong, S. T.","Apatite-type Ba5(VO4)3Cl","Acta Crystallographica, Section E","2005","61","","i140","i142","10.1107/S1600536805018854","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007997","6.73","","22.302","","7.4309","","90","","113.827","","90","","1020.26","","","","","","","","","","","","Synthetic","5","C 1 2/c 1","-C 2yc","15","","","","- As2 Ca1.5 Na Nb2 O12 -","- As2 Ca1.5 Na Nb2 O12 -","- As8 Ca6 Na4 Nb8 O48 -","4","0.5","","Amor, R. B.; Zid, M. F.","NaCa1.5(NbO)2O2(AsO4)2","Acta Crystallographica, Section E","2005","61","","i228","i230","10.1107/S1600536805031429","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007998","8.3","","8.3","","22.469","","90","","90","","120","","1340.51","","","","","","","","","","","","Synthetic","6","R -3 :H","-R 3","148","","","","- Cr4 K0.31 Li4.998 Na0.69 O24 P6 -","- Cr4 K0.31 Li4.998 Na0.69 O24 P6 -","- Cr12 K0.93 Li14.994 Na2.07 O72 P18 -","3","0.166667","","Kouass, S.; Boughzala, H.","NASICON-type Li2.5K0.16Na0.34Cr2(PO4)3","Acta Crystallographica, Section E","2005","61","","i231","i233","10.1107/S1600536805022269","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9007999","7.2391","","10.658","","5.988","","90","","90","","90","","462","","","","","","","","","","","","Synthetic","3","P b c n","-P 2n 2ab","60","","","","- Mg O5 Te2 -","- Mg O5 Te2 -","- Mg4 O20 Te8 -","4","0.5","","Weil, M.","Redetermination of MgTe2O5","Acta Crystallographica, Section E","2005","61","","i237","i239","10.1107/S1600536805033751","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008000","7.481","","8.2693","","9.859","","90","","108.76","","90","","577.502","","","","120","","","","","","","","Synthetic","4","P 1 21 1","P 2yb","4","","","","- B8 Ca H4 O15 -","- B8 Ca H4 O15 -","- B16 Ca2 H8 O30 -","2","1","","Wiggin, S. B.; Weller, M. T.","Redetermination of CaB8O11(OH)4 at low temperature Note: T = 120 K","Acta Crystallographica, Section E","2005","61","","i243","i245","10.1107/S1600536805029296","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008001","5.7434","","12.6002","","5.7405","","90","","90","","90","","415.428","","","","","","","","","","","","Synthetic","3","C c c e :1","C 2 2 -1ac","68","","","","- Ca Cl2 O2 -","- Ca Cl2 O2 -","- Ca8 Cl16 O16 -","8","0.5","","Smolentsev, A. I.; Naumov, D. Y.","Calcium chlorite, Ca(ClO2)2, from X-ray powder diffraction data","Acta Crystallographica, Section E","2005","61","","i246","i248","10.1107/S160053680503415X","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008002","5.9799","","12.7519","","5.9787","","90","","90","","90","","455.906","","","","","","","","","","","","Synthetic","3","C c c e :1","C 2 2 -1ac","68","","","","- Cl2 O2 Sr -","- Cl2 O2 Sr -","- Cl16 O16 Sr8 -","8","0.5","","Smolentsev, A. I.; Naumov, D. Y.","Strontium chlorite, Sr(ClO2)2, from X-ray powder diffraction data","Acta Crystallographica, Section E","2005","61","","i249","i250","10.1107/S1600536805034161","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008005","9.766","","9.692","","9.811","","90","","102.53","","90","","906.514","","","","","","","","","","","","Synthetic","5","P 1 21/n 1","-P 2yn","14","","","","- Fe2 H5 Na O11 P2 -","- Fe2 H5 Na O11 P2 -","- Fe8 H20 Na4 O44 P8 -","4","1","","Gao, S.; Ng, S. W.","Sodium diiron(III) diphosphate hydroxide dihydrate","Acta Crystallographica, Section E","2005","61","","i268","i269","10.1107/S1600536805036226","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9013405","4.7586","","8.253","","10.758","","90","","92.845","","90","","421.975","","","","","","","","","","","","Synthetic","6","P 1 21/c 1","-P 2ybc","14","","","","- F2 Fe H4 K2 O8 P2 -","- F2 Fe H4 K2 O8 P2 -","- F4 Fe2 H8 K4 O16 P4 -","2","0.5","","Mi, J. X.; Wang, C. X.; Wei, Z. B.; Chen, F. J.; Xu, C. Y.; Mao, S. Y.","K2Fe[H(HPO4)2]F2","Acta Crystallographica, Section E","2005","61","","i143","i145","10.1107/S1600536805020635","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""