# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-18T15:33:50+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 = 69 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
"2237103","7.5396","0.0006","17.4173","0.0014","8.2726","0.0012","90","","118.138","0.007","90","","957.96","0.19","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[aqua(glycine-κ<i>O</i>)lithium]-μ-glycine- κ^2^<i>O</i>:<i>O</i>'] bromide]","","- C4 H12 Br Li N2 O5 -","- C4 H12 Br Li N2 O5 -","- C16 H48 Br4 Li4 N8 O20 -","4","1","AA2077","Balakrishnan, T.; Ramamurthi, K.; Jeyakanthan, J.; Thamotharan, S.","<i>catena</i>-Poly[[[aqua(glycine-κ<i>O</i>)lithium]-μ-glycine-κ^2^<i>O</i>:<i>O</i>'] bromide]","Acta Crystallographica Section E","2013","69","1","m60","m61","10.1107/S1600536812050660","","","0.71073","MoKα","","0.0286","0.021","","","0.0497","0.0512","","","","","","0.961","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237104","10.4163","0.0008","24.2608","0.0018","8.0796","0.0006","90","","96.437","0.002","90","","2028.9","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>rac</i>-Ethyl 2-hydroxy-2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-3,4,5,6,7,8-hexahydro- 2<i>H</i>-chromene-3-carboxylate","","- C21 H25 N O7 -","- C21 H25 N O7 -","- C84 H100 N4 O28 -","4","1","AA2078","Maharramov, Abel M.; Ismiev, Arif I.; Rashidov, Bahruz A.; Askerov, Rizvan K.; Potekhin, Konstantin A.","<i>rac</i>-Ethyl 2-hydroxy-2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-3,4,5,6,7,8-hexahydro-2<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section E","2013","69","1","o99","","10.1107/S1600536812050581","","","0.71073","MoKα","","0.0576","0.0441","","","0.109","0.1184","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237105","12.1339","0.001","12.1339","0.001","30.057","0.002","90","","90","","90","","4425.3","0.6","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","(Biphenyl-2,2'-diyl)di-<i>tert</i>-butylphosphonium trifluoromethanesulfonate","","- C21 H26 F3 O3 P S -","- C21 H26 F3 O3 P S -","- C168 H208 F24 O24 P8 S8 -","8","1","AA2079","Muller, Alfred; Holzapfel, Cedric W.","(Biphenyl-2,2'-diyl)di-<i>tert</i>-butylphosphonium trifluoromethanesulfonate","Acta Crystallographica Section E","2013","69","1","o20","","10.1107/S1600536812049045","","","0.71073","MoKα","","0.1183","0.0538","","","","0.1174","","","","","","0.986","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237106","7.6491","0.0008","9.1729","0.001","13.3722","0.0014","102.355","0.009","98.777","0.009","98.093","0.009","891.05","0.17","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","6-Ethoxycarbonyl-5,7-dihydroxy-2,3-dihydro-1<i>H</i>- pyrido[3,2,1-<i>ij</i>]quinolinium tribromide","","- C15 H16 Br3 N O4 -","- C15 H16 Br3 N O4 -","- C30 H32 Br6 N2 O8 -","2","1","AA2080","Rybakov, Victor B.; Shishkina, Svitlana V.; Ukrainets, Igor V.; Golik, Nikolai Yu.; Chernenok, Igor N.","6-Ethoxycarbonyl-5,7-dihydroxy-2,3-dihydro-1<i>H</i>-pyrido[3,2,1-<i>ij</i>]quinolinium tribromide","Acta Crystallographica Section E","2013","69","1","o82","","10.1107/S1600536812049276","","","0.71073","MoKα","","0.19","0.0676","","","0.1749","0.2171","","","","","","0.895","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237107","28.317","0.002","9.4539","0.0005","13.7684","0.001","90","","111.017","0.009","90","","3440.7","0.4","297.5","","297.5","","","","","","","","","3","C 1 2 1","C 2y","5","methandrostenolone","17β-Hydroxy-17α-methylandrosta-1,4-dien-3-one","","- C20 H28 O2 -","- C20 H28 O2 -","- C160 H224 O16 -","8","2","BG2491","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrosta-1,4-dien-3-one","Acta Crystallographica Section E","2013","69","1","o60","","10.1107/S1600536812049860","","","0.7107","MoKα","","0.1191","0.0716","","","0.1649","0.1994","","","","","","1.027","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237108","16.1822","0.0007","13.5864","0.0007","7.5989","0.0002","90","","91.123","0.003","90","","1670.36","0.12","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorido{(<i>E</i>)-4-dimethylamino-<i>N</i>'-[(pyridin-2-yl)methylidene- κ<i>N</i>]benzohydrazide-κ<i>O</i>}zinc","","- C15 H16 Cl2 N4 O Zn -","- C15 H16 Cl2 N4 O Zn -","- C60 H64 Cl8 N16 O4 Zn4 -","4","1","BH2455","Chaur, Manuel N.","Dichlorido{(<i>E</i>)-4-dimethylamino-<i>N</i>'-[(pyridin-2-yl)methylidene-κ<i>N</i>]benzohydrazide-κ<i>O</i>}zinc","Acta Crystallographica Section E","2013","69","1","m27","","10.1107/S1600536812049355","","","0.71073","MoKα","","0.0462","0.0354","","","0.0803","0.0843","","","","","","1.056","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237109","9.7865","0.0015","9.8274","0.0015","12.1816","0.0019","99.405","0.002","94.976","0.002","101.657","0.002","1123.3","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","<i>rac</i>-(<i>S</i>,<i>S</i>)-Bis(1-ferrocenylbut-3-enyl) ether","","- C28 H30 Fe2 O -","- C28 H30 Fe2 O -","- C56 H60 Fe4 O2 -","2","1","BH2465","Xie, Hao-Jun; Zhao, Chun-Zheng; Sun, Jun; Chen, Si; Wang, Jian-Jun","<i>rac</i>-(<i>S</i>,<i>S</i>)-Bis(1-ferrocenylbut-3-enyl) ether","Acta Crystallographica Section E","2013","69","1","m16","","10.1107/S1600536812048064","","","0.71073","MoKα","","0.0315","0.0271","","","0.093","0.0998","","","","","","0.813","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237110","12.011","0.0005","9.1633","0.0004","13.6456","0.0006","90","","97.93","0.001","90","","1487.48","0.11","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorido{<i>N</i>-[5-methylthiophen-2-yl)methylidene]-2-(pyridin-2- yl)ethanamine-κ^2^<i>N</i>,<i>N</i>'}palladium(II)","","- C13 H14 Cl2 N2 Pd S -","- C13 H14 Cl2 N2 Pd S -","- C52 H56 Cl8 N8 Pd4 S4 -","4","1","BH2466","Radebe, Mduduzi P.; Onani, Martin O.; Motswainyana, William M.","Dichlorido{<i>N</i>-[(5-methylthiophen-2-yl)methylidene]-2-(pyridin-2-yl)ethanamine-κ^2^<i>N</i>,<i>N</i>'}palladium(II)","Acta Crystallographica Section E","2013","69","1","m20","","10.1107/S1600536812049240","","","0.71073","MoKα","","0.034","0.025","","","0.053","0.0563","","","","","","1.015","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237111","6.3601","0.0003","11.2012","0.0006","28.3043","0.0014","90","","90","","90","","2016.42","0.18","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-16-(4-Chlorobenzylidene)estrone","","- C25 H25 Cl O2 -","- C25 H25 Cl O2 -","- C100 H100 Cl4 O8 -","4","1","BH2467","Suresh, J.; Thenmozhi, H.; Jeyachandran, Veerappan; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","(<i>E</i>)-16-(4-Chlorobenzylidene)estrone","Acta Crystallographica Section E","2013","69","1","o111","","10.1107/S1600536812050349","","","0.71073","MoKα","","0.0611","0.0431","","","0.0913","0.0995","","","","","","1.02","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237112","12.98","0.003","7.6143","0.0017","12.189","0.003","90","","90.497","0.005","90","","1204.6","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-1-(4-methoxybenzyl)piperidin-2-one","","- C13 H17 N O3 -","- C13 H17 N O3 -","- C52 H68 N4 O12 -","4","1","BH2468","Pienaar, Daniel P.; Khorasani, Sanaz; de Koning, Charles B.; Michael, Joseph P.","3-Hydroxy-1-(4-methoxybenzyl)piperidin-2-one","Acta Crystallographica Section E","2013","69","1","o51","","10.1107/S1600536812049501","","","0.71073","MoKα","","0.054","0.0421","","","0.1165","0.1237","","","","","","1.08","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237113","17.352","0.004","13.07","0.003","13.444","0.003","90","","123.84","0.03","90","","2532.5","1.3","223.15","","223.15","","","","","","","","","6","C 1 c 1","C -2yc","9","","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-<i>O</i>)copper(II) butane-2,3-diol monosolvate","","- C28 H26 Cu N4 O6 S -","- C28 H26 Cu N4 O6 S -","- C112 H104 Cu4 N16 O24 S4 -","4","1","BQ2380","Zhong, Kai-Long; Cao, Guo-Qing","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-<i>O</i>)copper(II) butane-2,3-diol monosolvate","Acta Crystallographica Section E","2013","69","1","m40","m41","10.1107/S1600536812049951","","","0.71073","MoKα","","0.0561","0.0459","","","0.1226","0.1346","","","","","","0.992","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237114","13.3081","0.0015","25.196","0.003","16.0355","0.0018","90","","100.094","0.002","90","","5293.7","1.1","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Triphenyl[(triphenylphosphoranylidene)amino]phosphonium tetrakis(pentafluorophenyl)borate","","- C60 H30 B F20 N P2 -","- C60 H30 B F20 N P2 -","- C240 H120 B4 F80 N4 P8 -","4","1","BR2211","Vanýsek, Petr; Zheng, Chong","Triphenyl[(triphenylphosphoranylidene)amino]phosphonium tetrakis(pentafluorophenyl)borate","Acta Crystallographica Section E","2013","69","1","o87","","10.1107/S1600536812049914","","","0.71073","MoKα","","0.0464","0.0378","","","0.0985","0.104","","","","","","1.067","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237115","8.8988","0.0007","11.8668","0.001","7.595","0.0006","90","","107.5","0.001","90","","764.91","0.11","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(nitrato-κ<i>O</i>)bis(pyridine-κ<i>N</i>)manganese(II)","","- C10 H14 Mn N4 O8 -","- C10 H14 Mn N4 O8 -","- C20 H28 Mn2 N8 O16 -","2","0.5","BR2215","Alam, Naveed; Shahid, Muhammad; Rauf, M. Khawar","Diaquabis(nitrato-κ<i>O</i>)bis(pyridine-κ<i>N</i>)manganese(II)","Acta Crystallographica Section E","2013","69","1","m9","","10.1107/S1600536812049161","","","0.71073","MoKα","","0.0236","0.0227","","","0.0627","0.0635","","","","","","1.076","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237116","10.4832","0.0003","12.2221","0.0004","18.0044","0.0006","79.691","0.003","76.725","0.003","76.19","0.003","2161.41","0.12","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II) hexaoxido-μ-peroxido-disulfate(VI) <i>N</i>,<i>N</i>-dimethylformamide disolvate monohydrate","","- C42 H40 N8 Ni O11 S2 -","- C42 H40 N8 Ni O10.999 S2 -","- C84 H80 N16 Ni2 O21.998 S4 -","2","1","BR2216","Harvey, Miguel Angel; Suarez, Sebastián; Doctorovich, Fabio; Baggio, Ricardo","Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II) hexaoxido-μ-peroxido-disulfate(VI) <i>N</i>,<i>N</i>-dimethylformamide disolvate monohydrate","Acta Crystallographica Section E","2013","69","1","m63","m64","10.1107/S1600536812050775","","","0.71073","MoKα","","0.0941","0.0559","","","0.1588","0.1701","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237117","8.9327","0.0005","10.0068","0.0005","14.6379","0.0011","103.988","0.004","95.023","0.004","113.775","0.003","1136.41","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 27-oxo-15-oxa-2,20- diazahexacyclo[18.6.1.0^1,8^.0^2,6^.0^9,14^.0^21,26^]heptacosa- 9,11,13,21,23,25-hexaene-7-carboxylate","","- C27 H30 N2 O4 -","- C27 H30 N2 O4 -","- C54 H60 N4 O8 -","2","1","BT6853","Narayanan, Sibi; Srinivasan, Thothadri; Purushothaman, Santhanagopalan; Raghunathan, Raghavachary; Velmurugan, Devadasan","Ethyl 27-oxo-15-oxa-2,20-diazahexacyclo[18.6.1.0^1,8^.0^2,6^.0^9,14^.0^21,26^]heptacosa-9,11,13,21,23,25-hexaene-7-carboxylate","Acta Crystallographica Section E","2013","69","1","o23","o24","10.1107/S1600536812049082","","","0.71073","MoKα","","0.0588","0.0454","","","0.1161","0.125","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237118","6.0412","0.0003","19.587","0.0011","7.201","0.0004","90","","110.257","0.003","90","","799.38","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-(5-Chlorothiophen-2-yl)-1,2,3-selenadiazole","","- C6 H3 Cl N2 S Se -","- C6 H3 Cl N2 S Se -","- C24 H12 Cl4 N8 S4 Se4 -","4","1","BT6854","Sugumar, Paramasivam; Sankari, Subramaniyan; Manisankar, Paramasivam; Ponnuswamy, Mondikalipudur Nanjappa Gounder","4-(5-Chlorothiophen-2-yl)-1,2,3-selenadiazole","Acta Crystallographica Section E","2013","69","1","o65","","10.1107/S1600536812049549","","","0.71073","MoKα","","0.0529","0.039","","","0.1139","0.1214","","","","","","1.01","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237119","12.0263","0.0006","10.742","0.0004","13.0499","0.0008","90","","112.849","0.006","90","","1553.58","0.15","123","2","123","2","","","","","","","","6","P 1 21 1","P 2yb","4","","<i>catena</i>-Poly[[[<i>O</i>,<i>O</i>'-bis(2-methylphenyl) dithiophosphato- κ^2^<i>S</i>,<i>S</i>]lead(II)]-μ-<i>O</i>,<i>O</i>'-bis(2-methylphenyl) dithiophosphato-κ^3^<i>S</i>,<i>S</i>':<i>S</i>]","","- C28 H28 O4 P2 Pb S4 -","- C28 H28 O4 P2 Pb S4 -","- C56 H56 O8 P4 Pb2 S8 -","2","1","BT6859","Butcher, Ray J.; Ratnani, Raju; Öztürk Yildirim, Sema; Falola, Oluwaseun","<i>catena</i>-Poly[[[<i>O</i>,<i>O</i>'-bis(2-methylphenyl) dithiophosphato-κ^2^<i>S</i>,<i>S</i>]lead(II)]-μ-<i>O</i>,<i>O</i>'-bis(2-methylphenyl) dithiophosphato-κ^3^<i>S</i>,<i>S</i>':<i>S</i>]","Acta Crystallographica Section E","2013","69","1","m29","m30","10.1107/S1600536812047964","","","1.54184","CuKα","","0.0326","0.0303","","","0.0731","0.075","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237120","10.1311","0.0003","11.9582","0.0004","14.2633","0.0005","76.033","0.003","75.536","0.003","69.707","0.003","1546.42","0.09","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","Bis[1-benzyl-2-(1,3-thiazol-4-yl)-1<i>H</i>-benzimidazole- κ^2^<i>N</i>^2^,<i>N</i>^3^]dichloridocobalt(II)","","- C34 H26 Cl2 Co N6 S2 -","- C34 H26 Cl2 Co N6 S2 -","- C68 H52 Cl4 Co2 N12 S4 -","2","1","BT6860","Gueddar, Hicham; Bouhfid, Rachid; Essassi, El Mokhtar; El Brahmi, Nabil; El Ammari, Lahcen","Bis[1-benzyl-2-(1,3-thiazol-4-yl)-1<i>H</i>-benzimidazole-κ^2^<i>N</i>^2^,<i>N</i>^3^]dichloridocobalt(II)","Acta Crystallographica Section E","2013","69","1","m5","m6","10.1107/S1600536812048751","","","0.71073","MoKα","","0.0344","0.0304","","","0.0782","0.0802","","","","","","1.054","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237121","13.6739","0.001","7.3086","0.0006","13.388","0.0011","90","","111.184","0.004","90","","1247.54","0.17","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-2,4,6-Trimethyl-<i>N</i>-[(1<i>H</i>-pyrrol-2-yl)methylidene]aniline","","- C14 H16 N2 -","- C14 H16 N2 -","- C56 H64 N8 -","4","1","BT6872","Imhof, Wolfgang","(<i>E</i>)-2,4,6-Trimethyl-<i>N</i>-[(1<i>H</i>-pyrrol-2-yl)methylidene]aniline","Acta Crystallographica Section E","2013","69","1","o113","","10.1107/S160053681205057X","","","0.71073","MoKα","","0.1267","0.0515","","","0.1109","0.1265","","","","","","0.866","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237122","5.0881","0.0004","13.0313","0.0009","19.886","0.002","90","","94.194","0.007","90","","1315","0.19","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","<i>N</i>-(4-Chlorophenyl)-4-nitrobenzenesulfonamide","","- C12 H9 Cl N2 O4 S -","- C12 H9 Cl N2 O4 S -","- C48 H36 Cl4 N8 O16 S4 -","4","1","BT6873","Chaithanya, U.; Foro, Sabine; Gowda, B. Thimme","<i>N</i>-(4-Chlorophenyl)-4-nitrobenzenesulfonamide","Acta Crystallographica Section E","2013","69","1","o7","","10.1107/S1600536812049070","","","0.71073","MoKα","","0.0467","0.0407","","","0.0873","0.0915","","","","","","1.131","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237123","9.7214","0.0019","10.739","0.001","11.7367","0.001","114.069","0.004","99.021","0.006","95.425","0.006","1087.7","0.3","93","2","93","2","","","","","","","","4","P -1","-P 1","2","","2-(4-Methoxyphenyl)-1-pentyl-4,5-diphenyl-1<i>H</i>-imidazole","","- C27 H28 N2 O -","- C27 H28 N2 O -","- C54 H56 N4 O2 -","2","1","BT6874","Simpson, Jim; Mohamed, Shaaban K.; Marzouk, Adel A.; Talybov, Avtandil H.; Abdelhamid, Antar A.","2-(4-Methoxyphenyl)-1-pentyl-4,5-diphenyl-1<i>H</i>-imidazole","Acta Crystallographica Section E","2013","69","1","o5","o6","10.1107/S1600536812049100","","","0.71073","MoKα","","0.0713","0.048","","","0.1181","0.132","","","","","","1.057","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237124","10.024","0.0004","10.483","0.0005","12.4076","0.0005","105.385","0.004","94.669","0.003","93.096","0.003","1249.03","0.1","130","2","130","2","","","","","","","","4","P -1","-P 1","2","","2,2-Dimethyl-5-(2-nitrobenzylidene)-1,3-dioxane-4,6-dione","","- C13 H11 N O6 -","- C13 H11 N O6 -","- C52 H44 N4 O24 -","4","2","BT6875","García-Álvarez, Fernando; Romero, Nancy; Lobato-García, Carlos E.; Terán, Joel L.; Mendoza, Angel","2,2-Dimethyl-5-(2-nitrobenzylidene)-1,3-dioxane-4,6-dione","Acta Crystallographica Section E","2013","69","1","o50","","10.1107/S1600536812049677","","","0.71073","MoKα","","0.0421","0.0346","","","","0.0883","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237125","6.8019","0.0004","12.3042","0.0006","24.3971","0.0012","100.002","0.004","93.08","0.004","98.748","0.004","1980.67","0.18","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","(<i>Z</i>)-Ethyl 2-hydroxy-4-oxo-4-(1,4,5,6,8-pentamethoxynaphthalen-2-yl)but- 2-enoate","","- C21 H24 O9 -","- C21 H24 O9 -","- C84 H96 O36 -","4","2","BT6876","Pillay, Adushan; Khorasani, Sanaz; de Koning, Charles B.","(<i>Z</i>)-Ethyl 2-hydroxy-4-oxo-4-(1,4,5,6,8-pentamethoxynaphthalen-2-yl)but-2-enoate","Acta Crystallographica Section E","2013","69","1","o54","o55","10.1107/S1600536812049203","","","0.71073","MoKα","","0.1518","0.0526","","","0.0913","0.1177","","","","","","0.839","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237126","25.1853","0.0005","8.18108","0.00009","21.0978","0.0004","90","","119.772","0.003","90","","3773.28","0.16","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(2,4-Dichlorophenyl)-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro- 1<i>H</i>-pyrazol-4-yl)acetamide","","- C19 H17 Cl2 N3 O2 -","- C19 H17 Cl2 N3 O2 -","- C152 H136 Cl16 N24 O16 -","8","1","BT6879","Butcher, Ray J.; Mahan, Aneeka; Nayak, P. S.; Narayana, B.; Yathirajan, H. S.","2-(2,4-Dichlorophenyl)-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)acetamide","Acta Crystallographica Section E","2013","69","1","o39","","10.1107/S1600536812049628","","","1.54184","CuKα","","0.0367","0.0353","","","0.0941","0.0952","","","","","","1.049","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237127","8.6293","0.0005","20.1267","0.0011","19.5299","0.0011","90","","102.236","0.004","90","","3314.9","0.3","116","2","116","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-[4-(2-{5-<i>tert</i>-Butyl-2-chloro-3-[2-(3-pentyl-1,3-benzothiazol-2- ylidene)ethylidene]cyclohex-1-enyl}ethenyl)-3-cyano-5,5-dimethylfuran-2- ylidene]malononitrile","","- C36 H39 Cl N4 O S -","- C36 H39 Cl N4 O S -","- C144 H156 Cl4 N16 O4 S4 -","4","1","BX2431","Gainsford, Graeme J.; Ashraf, Mohamed; Kay, Andrew J.","2-[4-(2-{5-<i>tert</i>-Butyl-2-chloro-3-[2-(3-pentyl-1,3-benzothiazol-2-ylidene)ethylidene]cyclohex-1-enyl}ethenyl)-3-cyano-5,5-dimethylfuran-2-ylidene]malononitrile","Acta Crystallographica Section E","2013","69","1","o120","o121","10.1107/S1600536812050842","","","0.71073","MoKα","","0.1448","0.059","","","0.1305","0.1766","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2237128","8.5941","0.0002","12.1107","0.0004","12.6642","0.0003","70.537","0.002","73.495","0.002","73.898","0.002","1166.98","0.06","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-[3a-(4-Bromophenyl)-8b-hydroxy-6,8-dimethoxy-3-phenyl-2,3,3a,8b-tetrahydro-1<i>H</i>-cyclopenta[<i>b</i>]benzofuran-1-yl]formamide monohydrate","","- C26 H26 Br N O6 -","- C26 H26 Br N O6 -","- C52 H52 Br2 N2 O12 -","2","1","BX2432","Aubert, Emmanuel; Thuaud, Frédéric; Ribeiro, Nigel; Désaubry, Laurent; Espinosa, Enrique","<i>N</i>-[3a-(4-Bromophenyl)-8b-hydroxy-6,8-dimethoxy-3-phenyl-2,3,3a,8b-tetrahydro-1<i>H</i>-cyclopenta[<i>b</i>]benzofuran-1-yl]formamide monohydrate","Acta Crystallographica Section E","2013","69","1","o52","o53","10.1107/S1600536812049641","","","1.54184","CuKα","","0.0278","0.0274","","","0.0735","0.0736","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237129","16.9888","0.0006","5.4501","0.0002","19.735","0.0008","90","","90","","90","","1827.28","0.12","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","6-Phenyloxane-2,4-dione","","- C11 H10 O3 -","- C11 H10 O3 -","- C88 H80 O24 -","8","1","BX2433","Slater, Kara A.; Andersh, Brad; Flint, Edward B.; Ferrence, Gregory M.","6-Phenyloxane-2,4-dione","Acta Crystallographica Section E","2013","69","1","o69","","10.1107/S1600536812049781","","","0.71073","MoKα","","0.0721","0.0465","","","","0.1136","","","","","","1.058","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237130","7.9657","0.0005","11.347","0.0007","23.513","0.002","90","","90","","90","","2125.3","0.3","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Glycine‒phthalic acid (1/1)","2-Azaniumylethanoate‒phthalic acid (1/1)","","- C10 H11 N O6 -","- C10 H11 N O6 -","- C80 H88 N8 O48 -","8","1","CV5360","Balakrishnan, T.; Ramamurthi, K.; Thamotharan, S.","Glycine‒phthalic acid (1/1)","Acta Crystallographica Section E","2013","69","1","o57","","10.1107/S160053681204977X","","","0.71073","MoKα","","0.0446","0.0342","","","0.086","0.0903","","","","","","1.005","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237131","29.7208","0.0016","16.0089","0.0004","16.5105","0.0006","90","","106.705","0.005","90","","7524.1","0.6","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(<i>E</i>)-5-(3-Cyano-2-(dicyanomethylene)-1-oxaspiro[4.5]dec-3-en-4-yl)-3- (1-methylpyridin-4(1<i>H</i>)-ylidene)pent-4-en-1-yl 3,5-bis(benzyloxy)benzoate","","- C45 H40 N4 O5 -","- C45 H40 N4 O5 -","- C360 H320 N32 O40 -","8","1","CV5370","Gainsford, Graeme J.; Clarke, David J.; Kay, Andrew J.","(<i>E</i>)-5-[3-Cyano-2-(dicyanomethylene)-1-oxaspiro[4.5]dec-3-en-4-yl]-3-(1-methyl-1,4-dihydropyridin-4-ylidene)pent-4-en-1-yl 3,5-bis(benzyloxy)benzoate","Acta Crystallographica Section E","2013","69","1","o103","o104","10.1107/S1600536812050532","","","1.54184","CuKα","","0.0817","0.0484","","","0.1205","0.1436","","","","","","1.024","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237132","9.4719","0.0003","10.5057","0.0003","11.811","0.0004","96.824","0.003","108.953","0.004","98.312","0.003","1082.51","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","1-{2-Benzyloxy-2-[4-(morpholin-4-yl)phenyl]ethyl}-1<i>H</i>-benzimidazole","","- C26 H27 N3 O2 -","- C26 H27 N3 O2 -","- C52 H54 N6 O4 -","2","1","CV5371","Özel Güven, Özden; Çapanlar, Seval; Adler, Philip D. F.; Coles, Simon J.; Hökelek, Tuncer","1-{2-Benzyloxy-2-[4-(morpholin-4-yl)phenyl]ethyl}-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2013","69","1","o147","o148","10.1107/S1600536812051306","","","0.71073","MoKα","","0.0705","0.0511","","","0.1248","0.135","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237133","15.714","0.0001","8.721","0.0002","22.995","0.0004","90","","104.794","0.001","90","","3046.81","0.09","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2,6-Dichloroaniline‒4-(2,6-dichloroanilino)pent-3-en-2-one (1/2)","","- C28 H27 Cl6 N3 O2 -","- C28 H27 Cl6 N3 O2 -","- C112 H108 Cl24 N12 O8 -","4","0.5","FB2272","Venter, Gertruida J. S.; Steyl, Gideon; Roodt, Andreas","2,6-Dichloroaniline‒4-(2,6-dichloroanilino)pent-3-en-2-one (1/2)","Acta Crystallographica Section E","2013","69","1","o34","o35","10.1107/S1600536812049227","","","0.71073","MoKα","","0.0327","0.0272","","","","0.0765","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237134","13.059","0.004","5.3567","0.0016","19.175","0.006","90","","104.586","0.005","90","","1298.1","0.7","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-2-(4-Chlorophenoxy)-<i>N</i>'-(pyridin-4-ylmethylidene)acetohydrazide","","- C14 H12 Cl N3 O2 -","- C14 H12 Cl N3 O2 -","- C56 H48 Cl4 N12 O8 -","4","1","FB2275","Rao, Xiao-jin; Wu, Wen-Shi; Li, Chuan-hui; Huang, Yu-min","(<i>E</i>)-2-(4-Chlorophenoxy)-<i>N</i>'-(pyridin-4-ylmethylidene)acetohydrazide","Acta Crystallographica Section E","2013","69","1","o28","","10.1107/S1600536812045989","","","0.71073","MoKα","","0.0475","0.0411","","","0.1004","0.1038","","","","","","1.048","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237135","11.479","0.0004","14.0461","0.0005","14.3702","0.0007","90","","90","","90","","2316.98","0.16","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-Nitrophenyl 2-chlorobenzoate","","- C13 H8 Cl N O4 -","- C13 H8 Cl N O4 -","- C104 H64 Cl8 N8 O32 -","8","1","FF2092","Iqbal, Asma; Akhter, Toheed; Masood Siddiqi, Humaira; Akhter, Zareen; Bolte, Michael","4-Nitrophenyl 2-chlorobenzoate","Acta Crystallographica Section E","2013","69","1","o96","","10.1107/S1600536812050362","","","0.71073","MoKα","","0.048","0.0441","","","0.1026","0.1049","","","","","","1.135","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237136","9.633","0.0006","13.8174","0.0007","15.4828","0.0008","66.151","0.005","78.949","0.005","75.397","0.005","1814.56","0.19","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Bis(ethanamidinium) (1,10-phenanthroline-2,9-dicarboxylato)manganate(II) heptahydrate","","- C32 H40 Mn N8 O15 -","- C32 H40 Mn N8 O15 -","- C64 H80 Mn2 N16 O30 -","2","1","FI2126","Miao, Yan-Li; Wang, Hong-Bo; Song, Wen-Dong","Bis(ethanamidinium) (1,10-phenanthroline-2,9-dicarboxylato)manganate(II) heptahydrate","Acta Crystallographica Section E","2013","69","1","m10","m11","10.1107/S1600536812048350","","","1.54178","CuKα","","0.0444","0.0373","","","0.0994","0.1019","","","","","","0.951","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237137","4.7438","0.0008","13.889","0.002","21.201","0.003","70.89","0.02","89.55","0.03","88.66","0.03","1319.5","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Potassium bis(dioxovanadyl) phosphate","","- K O8 P V2 -","- K O8 P V2 -","- K8 O64 P8 V16 -","8","4","FI2128","Ezzine Yahmed, Safa; Ayed, Meriem; Zid, Mohamed Faouzi; Driss, Ahmed","β-K(VO~2~)~2~(PO~4~)","Acta Crystallographica Section E","2013","69","1","i2","","10.1107/S1600536812049884","","","0.71073","MoKα","","0.0374","0.0295","","","0.0819","0.0862","","","","","","1.083","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237138","23.4154","0.0008","15.5832","0.0006","16.1012","0.0006","90","","93.926","0.002","90","","5861.3","0.4","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Hexa-μ~2~-acetato-hexa-<i>n</i>-butylhexa-μ~3~-oxido-tin(IV) toluene monosolvate","","- C43 H80 O18 Sn6 -","- C43 H80 O18 Sn6 -","- C172 H320 O72 Sn24 -","4","0.5","FJ2609","Reichelt, Martin; Reuter, Hans","Hexa-μ~2~-acetato-hexa-<i>n</i>-butylhexa-μ~3~-oxido-tin(IV) toluene monosolvate","Acta Crystallographica Section E","2013","69","1","m4","","10.1107/S160053681204888X","","","0.71073","MoKα","","0.0277","0.0202","","","0.0423","0.0458","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237139","11.0564","0.0004","9.5942","0.0003","33.4312","0.0012","90","","91.684","0.002","90","","3544.8","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>-(Diphenylcarbamoyl)- <i>N</i>,<i>N</i>',<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethylguanidinium tetraphenylborate","","- C43 H45 B N4 O -","- C43 H45 B N4 O -","- C172 H180 B4 N16 O4 -","4","1","FK2067","Tiritiris, Ioannis","<i>N</i>-(Diphenylcarbamoyl)-<i>N</i>,<i>N</i>',<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethylguanidinium tetraphenylborate","Acta Crystallographica Section E","2013","69","1","o98","","10.1107/S1600536812050507","","","0.71073","MoKα","","0.0533","0.0426","","","0.1126","0.1208","","","","","","1.064","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237140","5.7534","0.0004","16.1336","0.0008","18.198","0.0013","90","","99.371","0.006","90","","1666.65","0.19","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[Anilino(phenyl)methyl]cycloheptanone","","- C20 H23 N O -","- C20 H23 N O -","- C80 H92 N4 O4 -","4","1","FY2069","Eftekhari-Sis, Bagher; Mohajer, Sahar; Zirak, Maryam; Mozaffarnia, Sakineh; Büyükgüngör, Orhan","2-[Anilino(phenyl)methyl]cycloheptanone","Acta Crystallographica Section E","2013","69","1","o109","","10.1107/S1600536812050659","","","0.71073","MoKα","","0.0861","0.0477","","","0.12","0.1355","","","","","","1.014","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237141","9.0723","0.0015","8.481","0.0014","13.135","0.002","90","","101.221","0.002","90","","991.3","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorophosphinic bis(2-chloroethyl)amide","","- C4 H8 Cl4 N O P -","- C4 H8 Cl4 N O P -","- C16 H32 Cl16 N4 O4 P4 -","4","1","FY2076","Song, Erqun; Song, Yang","Dichlorophosphinic bis(2-chloroethyl)amide","Acta Crystallographica Section E","2013","69","1","o33","","10.1107/S1600536812049586","","","0.71073","MoKα","","0.036","0.0285","","","0.0841","0.0899","","","","","","1.045","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237142","23.1111","0.0006","4.7863","0.0001","10.4262","0.0002","90","","97.071","0.001","90","","1144.54","0.04","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(4-Iodoanilino)-2-methylene-4-oxobutanoic acid","","- C11 H10 I N O3 -","- C11 H10 I N O3 -","- C44 H40 I4 N4 O12 -","4","1","GK2533","Nayak, Prakash S.; Narayana, Badiadka; Yathirajan, Hemmige S.; Gerber, Thomas; van Brecht, Benjamin; Betz, Richard","4-(4-Iodoanilino)-2-methylene-4-oxobutanoic acid","Acta Crystallographica Section E","2013","69","1","o83","","10.1107/S160053681205012X","","","0.71073","MoKα","","0.0202","0.0178","","","0.045","0.0468","","","","","","1.055","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237143","13.1537","0.0006","31.0875","0.0013","8.3175","0.0003","90","","90","","90","","3401.2","0.2","200","2","200","2","","","","","","","","4","A b a 2","A 2 -2ab","41","","7-[(Morpholin-4-yl)(phenyl)methyl]quinolin-8-ol","","- C20 H20 N2 O2 -","- C20 H20 N2 O2 -","- C160 H160 N16 O16 -","8","","GK2537","Novina, J. Josephine; Vasuki, G.; Muthukumar, C.; Sabastiyan, A.; Crochet, A.; Fromm, K. M.","7-[(Morpholin-4-yl)(phenyl)methyl]quinolin-8-ol","Acta Crystallographica Section E","2013","69","1","o45","","10.1107/S1600536812049343","","","1.54186","CuKα","","0.0291","0.0277","","","0.073","0.0739","","","","","","1.064","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237144","4.476","0.0009","13.654","0.003","12.4","0.003","90","","97.16","0.03","90","","751.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Chloro-2,4,5-trifluorobenzoic acid","","- C7 H2 Cl F3 O2 -","- C7 H2 Cl F3 O2 -","- C28 H8 Cl4 F12 O8 -","4","1","GK2539","Quan, Jing; Sun, Hong-Shun","3-Chloro-2,4,5-trifluorobenzoic acid","Acta Crystallographica Section E","2013","69","1","o30","","10.1107/S1600536812049446","","","0.71073","MoKα","","0.1162","0.0522","","","0.1109","0.1317","","","","","","1.003","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237145","13.0079","0.0005","9.9079","0.0004","17.0469","0.0009","90","","103.674","0.004","90","","2134.75","0.17","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-[(<i>E</i>)-(4-Benzyloxybenzylidene)amino]-1,5-dimethyl-2-phenyl- 1<i>H</i>-pyrazol-3(2<i>H</i>)-one","","- C25 H23 N3 O2 -","- C25 H23 N3 O2 -","- C100 H92 N12 O8 -","4","1","GK2544","Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Nayak, Prakash S.; Sarojini, B. K.; Narayana, B.","A second monoclinic polymorph of 4-[(<i>E</i>)-(4-benzyloxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2013","69","1","o115","","10.1107/S1600536812050891","","","0.71073","MoKα","","0.0995","0.0547","","","0.1256","0.1535","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237146","8.87","0.0005","12.8918","0.0007","13.1062","0.0007","84.389","0.004","84.62","0.004","70.771","0.005","1405.28","0.14","290.73","0.1","290.73","0.1","","","","","","","","3","P -1","-P 1","2","ethyl-3-(9-anthracenyl)acrylate","Ethyl (<i>E</i>)-3-(anthracen-9-yl)prop-2-enoate","","- C19 H16 O2 -","- C19 H16 O2 -","- C76 H64 O8 -","4","2","GK2545","Bugenhagen, Bernhard; Al Jasem, Yosef; al Hindawi, Bassam; Al Rawashdeh, Nathir; Thiemann, Thies","Ethyl (<i>E</i>)-3-(anthracen-9-yl)prop-2-enoate","Acta Crystallographica Section E","2013","69","1","o130","o131","10.1107/S1600536812051033","","","1.5418","CuKα","","0.0634","0.0571","","","0.1662","0.1708","","","","","","1.097","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237147","4.5553","0.0006","18.001","0.003","10.7488","0.0013","90","","93.645","0.008","90","","879.6","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(Prop-2-ynyl)-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","","- C10 H8 N2 O -","- C10 H8 N2 O -","- C40 H32 N8 O4 -","4","1","GK2546","Ouzidan, Younès; Kandri Rodi, Youssef; Ouazzani Chahdi, Fouad; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen","1-(Prop-2-ynyl)-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","1","o119","","10.1107/S160053681205088X","","","0.71073","MoKα","","0.0425","0.0351","","","0.0943","0.1008","","","","","","1.046","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237148","13.7746","0.0003","7.4918","0.0002","18.7016","0.0007","90","","106.013","0.003","90","","1855.06","0.1","292","2","292","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[2-(1,3-Benzothiazol-2-ylmethoxy)-5-bromophenyl](4-chlorophenyl)methanone","","- C21 H13 Br Cl N O2 S -","- C21 H13 Br Cl N O2 S -","- C84 H52 Br4 Cl4 N4 O8 S4 -","4","1","GO2078","Nayak, Susanta K.; Venugopala, K. N.; Govender, Thavendran; Kruger, Hendrik G.; Maguire, Glenn E. M.","[2-(1,3-Benzothiazol-2-ylmethoxy)-5-bromophenyl](4-chlorophenyl)methanone","Acta Crystallographica Section E","2013","69","1","o70","","10.1107/S1600536812049756","","","0.7107","MoKα","","0.0789","0.0444","","","0.085","0.0961","","","","","","1.069","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237149","18.371","0.003","10.4844","0.0015","18.467","0.003","90","","90","","90","","3556.9","1","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(±)-3-Benzyloxy-1-(4-methoxybenzyl)piperidine-2-thione","","- C20 H23 N O2 S -","- C20 H23 N O2 S -","- C160 H184 N8 O16 S8 -","8","1","GO2079","Pienaar, Daniel P.; Khorasani, Sanaz; de Koning, Charles B.; Michael, Joseph P.","(±)-3-Benzyloxy-1-(4-methoxybenzyl)piperidine-2-thione","Acta Crystallographica Section E","2013","69","1","o21","","10.1107/S1600536812048854","","","0.71073","MoKα","","0.0674","0.0374","","","0.0871","0.0981","","","","","","1.011","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237150","13.251","0.006","6.185","0.003","16.38","0.008","90","","113.153","0.007","90","","1234.3","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(<i>E</i>)-2-Hydroxy-3-methoxybenzylidene]-<i>N</i>- methylhydrazinecarbothioamide","","- C11 H15 N3 O2 S -","- C11 H15 N3 O2 S -","- C44 H60 N12 O8 S4 -","4","1","GW2126","Shankara, B. S.; Shashidhar, N.; Patil, Yogesh Prakash; Krishna, P. Murali; Nethaji, Munirathinam","2-[(<i>E</i>)-2-Hydroxy-3-methoxybenzylidene]-<i>N</i>-methylhydrazinecarbothioamide","Acta Crystallographica Section E","2013","69","1","o61","","10.1107/S1600536812049847","","","0.71073","MoKα","","0.0949","0.0641","","","0.1576","0.1796","","","","","","1.055","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237151","9.3497","0.0003","14.1736","0.0004","18.6086","0.0006","94.462","0.002","96.562","0.001","101.129","0.001","2391.12","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')iron(II) bis(1,1,3,3-tetracyano-2-ethoxypropenide) hemihydrate","","- C54 H35 Fe N14 O2.5 -","- C54 H35 Fe N14 O2.5 -","- C108 H70 Fe2 N28 O5 -","2","1","HB6994","Setifi, Zouaoui; Setifi, Fatima; Ng, Seik Weng; Oudahmane, Abdelghani; El-Ghozzi, Malika; Avignant, Daniel","Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')iron(II) bis(1,1,3,3-tetracyano-2-ethoxypropenide) hemihydrate","Acta Crystallographica Section E","2013","69","1","m12","m13","10.1107/S1600536812048611","","","0.71073","MoKα","","0.0922","0.0487","","","0.112","0.134","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2237152","12.6752","0.001","28.578","0.002","8.5659","0.0006","90","","90","","90","","3102.8","0.4","293","2","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","6-Phenylbenzo[<i>d</i>]naphtho[2,3-<i>b</i>]thiophene","","- C22 H14 S -","- C22 H14 S -","- C176 H112 S8 -","8","1","HB6995","Silambarasan, V.; Srinivasan, T.; Sivasakthikumaran, R.; Mohanakrishnan, A. K.; Velmurugan, D.","6-Phenylbenzo[<i>d</i>]naphtho[2,3-<i>b</i>]thiophene","Acta Crystallographica Section E","2013","69","1","o36","","10.1107/S1600536812049471","","","0.71073","MoKα","","0.0612","0.0429","","","0.1071","0.1179","","","","","","1.032","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237153","9.9851","0.0003","10.0086","0.0002","11.3676","0.0003","102.35","0.001","97.108","0.001","95.29","0.002","1092.94","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","(2<i>E</i>,2'<i>E</i>)-1,1'-Bis(6-chloro-2-methyl-4-phenylquinolin-3- yl)-3,3'-(1,4-phenylene)diprop-2-en-1-one ethyl acetate disolvate","","- C52 H46 Cl2 N2 O6 -","- C52 H46 Cl2 N2 O6 -","- C52 H46 Cl2 N2 O6 -","1","0.5","HB7004","Kedjadja, Allaoua; Merdes, Rachid; Bouacida, Sofiane; Roisnel, Thierry; Belfaitah, Ali","(2<i>E</i>,2'<i>E</i>)-1,1'-Bis(6-chloro-2-methyl-4-phenylquinolin-3-yl)-3,3'-(1,4-phenylene)diprop-2-en-1-one ethyl acetate disolvate","Acta Crystallographica Section E","2013","69","1","o37","o38","10.1107/S1600536812049422","","","0.71073","MoKα","","0.0592","0.0483","","","0.1312","0.1402","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237154","10.2348","0.0004","16.4046","0.0007","22.3632","0.0009","90","","90","","90","","3754.7","0.3","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Chlorido[1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione- κ<i>S</i>]bis(triphenylphosphane-κ<i>P</i>)copper(I) acetronitrile monosolvate","","- C40 H36 Cl Cu N4 P2 S -","- C40 H36 Cl Cu N4 P2 S -","- C160 H144 Cl4 Cu4 N16 P8 S4 -","4","1","HB7008","Wani, Kofsoh; Pakawatchai, Chaveng; Saithong, Saowanit","Chlorido[1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione-κ<i>S</i>]bis(triphenylphosphane-κ<i>P</i>)copper(I) acetronitrile monosolvate","Acta Crystallographica Section E","2013","69","1","m34","m35","10.1107/S1600536812049537","","","0.71073","MoKα","","0.0427","0.0377","","","0.0838","0.0859","","","","","","1.11","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237155","7.81","0.0016","8.397","0.0017","14.51","0.003","90","","98.01","0.03","90","","942.3","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-Methoxy-3-(methoxymethyl)benzaldehyde","","- C10 H12 O3 -","- C10 H12 O3 -","- C40 H48 O12 -","4","1","HB7010","Zhang, Jing-Chao; Sun, Jun; Zhang, Juan; Liu, Guang-Lin; Guo, Cheng","4-Methoxy-3-(methoxymethyl)benzaldehyde","Acta Crystallographica Section E","2013","69","1","o112","","10.1107/S1600536812050350","","","0.71073","MoKα","","0.1335","0.0629","","","0.139","0.1652","","","","","","1.005","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237156","21.1079","0.0005","8.1358","0.0001","9.0793","0.0002","90","","100.833","0.001","90","","1531.4","0.05","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[4-(Morpholin-4-ylmethyl)phenyl]benzonitrile","","- C18 H18 N2 O -","- C18 H18 N2 O -","- C72 H72 N8 O4 -","4","1","HB7014","Meti, Gangadhar Y.; Kamble, R. R; Ravi, A. J.; Arunkashi, H. K.; Devarajegowda, H. C.","2-[4-(Morpholin-4-ylmethyl)phenyl]benzonitrile","Acta Crystallographica Section E","2013","69","1","o129","","10.1107/S1600536812050957","","","0.71073","MoKα","","0.042","0.0328","","","0.0778","0.0832","","","","","","1.029","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237157","9.6016","0.0019","15.701","0.003","26.722","0.005","90","","90","","90","","4028.5","1.3","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Poly[[tetraaquadi-μ~4~-fumarato-μ~2~-oxalato-dierbium(III)] tetrahydrate]","","- C10 H20 Er2 O20 -","- C10 H20 Er2 O20 -","- C80 H160 Er16 O160 -","8","0.25","HG5272","Yang, Qing-Feng; Wang, Xiao-Zhong; Xue, Ping","Poly[[tetraaquadi-μ~4~-fumarato-μ~2~-oxalato-dierbium(III)] tetrahydrate]","Acta Crystallographica Section E","2013","69","1","m52","","10.1107/S160053681205026X","","","0.71073","MoKα","","0.0204","0.0182","","","0.0443","0.0453","","","","","","1.108","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237158","5.5097","0.0004","19.9357","0.0011","24.4597","0.0016","90","","90","","90","","2686.6","0.3","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-<i>O</i>-Acetyl-3,4,6-tri-<i>O</i>-benzyl-2-<i>C</i>-bromomethyl- 2-deoxy-α-<i>D</i>-glucopyranose","","- C30 H33 Br O6 -","- C30 H33 Br O6 -","- C120 H132 Br4 O24 -","4","1","HG5273","Kinfe, Henok H.; Makolo, Felix L.; Phasha, Zanele H.","1-<i>O</i>-Acetyl-3,4,6-tri-<i>O</i>-benzyl-2-<i>C</i>-bromomethyl-2-deoxy-α-<small>D</small>-glucopyranose","Acta Crystallographica Section E","2013","69","1","o73","","10.1107/S1600536812048453","","","1.54178","CuKα","","0.0469","0.0414","","","","0.0963","","","","","","1.04","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237159","7.705","0.003","8.348","0.003","12.465","0.005","84.92","0.01","72.913","0.009","86.272","0.011","762.7","0.5","123.15","","123","2","","","","","","","","7","P -1","-P 1","2","","1-(2-Chlorobenzoyl)-3-(2-trifluoromethylphenyl)thiourea","","- C15 H10 Cl F3 N2 O S -","- C15 H10 Cl F3 N2 O S -","- C30 H20 Cl2 F6 N4 O2 S2 -","2","1","HG5276","Rauf, M. Khawar; Ebihara, Masahiro; Badshah, Amin","1-(2-Chlorobenzoyl)-3-(2-trifluoromethylphenyl)thiourea","Acta Crystallographica Section E","2013","69","1","o16","","10.1107/S1600536812048829","","","0.7107","MoKα","","0.0341","0.0313","","","0.0731","0.0747","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237160","20.3442","0.0011","12.108","0.0008","14.95","0.0008","90","","93.837","0.005","90","","3674.3","0.4","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(2,6-Dichlorophenyl)-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro- 1<i>H</i>-pyrazol-4-yl)acetamide","","- C19 H17 Cl2 N3 O2 -","- C19 H17 Cl2 N3 O2 -","- C152 H136 Cl16 N24 O16 -","8","1","HG5277","Butcher, Ray J.; Mahan, Aneeka; Nayak, P. S.; Narayana, B.; Yathirajan, H. S.","2-(2,6-Dichlorophenyl)-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)acetamide","Acta Crystallographica Section E","2013","69","1","o46","o47","10.1107/S160053681204963X","","","1.54184","CuKα","","0.0766","0.0616","","","0.164","0.1845","","","","","","1.051","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237161","11.578","0.0007","11.762","0.0007","16.545","0.0011","81.26","0.007","71.55","0.007","62.95","0.006","1903.4","0.2","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","Tris[4-(dimethylamino)pyridinium] hexakis(thiocyanato-κ<i>N</i>)ferrate(III) monohydrate","","- C27 H35 Fe N12 O S6 -","- C27 H35 Fe N12 O S6 -","- C54 H70 Fe2 N24 O2 S12 -","2","1","HP2051","Wöhlert, Susanne; Jess, Inke; Näther, Christian","Tris[4-(dimethylamino)pyridinium] hexakis(thiocyanato-κ<i>N</i>)ferrate(III) monohydrate","Acta Crystallographica Section E","2013","69","1","m33","","10.1107/S1600536812049574","","","0.71073","MoKα","","0.0827","0.0424","","","0.0914","0.1038","","","","","","0.951","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237162","9.2768","0.0007","11.4347","0.0003","12.9774","0.0003","90","","92.961","0.003","90","","1374.77","0.11","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis({1-[(1-iminoethyl)imino]ethyl}azanido- κ^2^<i>N</i>^1^,<i>N</i>^5^)nickel(II) methanol monosolvate","","- C9 H20 N6 Ni O -","- C9 H20 N6 Ni O -","- C36 H80 N24 Ni4 O4 -","4","1","HY2604","Xie, Yong-Qiang; Li, Jun-Jian; Guo, Ying; Zhang, You-Ming; Wei, Tai-Bao","Bis({1-[(1-iminoethyl)imino]ethyl}azanido-κ^2^<i>N</i>^1^,<i>N</i>^5^)nickel(II) methanol monosolvate","Acta Crystallographica Section E","2013","69","1","m3","","10.1107/S1600536812046958","","","0.71073","MoKα","","0.046","0.0286","","","0.0701","0.082","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237163","9.0209","0.0003","9.6544","0.0003","10.92","0.0003","87.093","0.002","86.974","0.001","85.793","0.002","946.1","0.05","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","[2,6-Bis(5-ethoxy-1,3-oxazol-2-yl)-4-methoxyphenyl- κ^3^<i>N</i>,<i>C</i>^1^,<i>N</i>']bromidopalladium(II)","","- C17 H17 Br N2 O5 Pd -","- C17 H17 Br N2 O5 Pd -","- C34 H34 Br2 N4 O10 Pd2 -","2","1","HY2606","Nan, Wen-Hui; Tan, Jian-Ping; Luo, Qun-Li","[2,6-Bis(5-ethoxy-1,3-oxazol-2-yl)-4-methoxyphenyl-κ^3^<i>N</i>,<i>C</i>^1^,<i>N</i>']bromidopalladium(II)","Acta Crystallographica Section E","2013","69","1","m31","m32","10.1107/S1600536812049197","","","0.71073","MoKα","","0.0431","0.0355","","","0.1063","0.1133","","","","","","1.083","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237164","8.1468","0.0009","17.3814","0.0015","13.6369","0.0013","90","","95.724","0.009","90","","1921.4","0.3","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Dibromido(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(dimethyl sulfoxide-κ<i>O</i>)cadmium","","- C16 H18 Br2 Cd N2 O S -","- C16 H18 Br2 Cd N2 O S -","- C64 H72 Br8 Cd4 N8 O4 S4 -","4","1","HY2608","Moghanlou, Khadijeh","Dibromido(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(dimethyl sulfoxide-κ<i>O</i>)cadmium","Acta Crystallographica Section E","2013","69","1","m49","","10.1107/S1600536812050106","","","0.71073","MoKα","","0.1104","0.0571","","","0.1131","0.1274","","","","","","0.942","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237165","8.454","0.002","9.934","0.003","13.778","0.004","97.534","0.004","95.281","0.004","110.603","0.004","1061.8","0.5","110","","110","","","","","","","","","5","P -1","-P 1","2","","(2-Amino-7-methyl-4-oxidopteridine-6-carboxylato- κ^3^<i>O</i>^4^,<i>N</i>^5^,<i>O</i>^6^)aqua(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')cobalt(II) trihydrate","","- C20 H21 Co N7 O7 -","- C20 H21 Co N7 O7 -","- C40 H42 Co2 N14 O14 -","2","1","HY2609","Baisya, Siddhartha S.; Sen, Samir; Roy, Parag S.","(2-Amino-7-methyl-4-oxidopteridine-6-carboxylato-κ^3^<i>O</i>^4^,<i>N</i>^5^,<i>O</i>^6^)aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II) trihydrate","Acta Crystallographica Section E","2013","69","1","m70","m71","10.1107/S1600536812051185","","","0.71073","MoKα","","0.0626","0.0567","","0.129","0.1257","0.129","","","","","","1.0289","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237166","18.0951","0.0011","22.4608","0.0014","23.4293","0.0014","90","","104.782","0.003","90","","9207.2","1","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(η^6^-<i>p</i>-Cymene)(1,3-dimesityl-2,3-dihydro-1<i>H</i>-imidazol-2- ylidene)bis(pentafluorobenzoato-κ<i>O</i>)ruthenium(II) dichloromethane disolvate","","- C47 H42 Cl4 F10 N2 O4 Ru -","- C47 H42 Cl4 F10 N2 O4 Ru -","- C376 H336 Cl32 F80 N16 O32 Ru8 -","8","2","IM2412","Dorst, Konstantin; Frey, Wolfgang; Wang, Dongren; Buchmeiser, Michael","(η^6^-<i>p</i>-Cymene)(1,3-dimesityl-2,3-dihydro-1<i>H</i>-imidazol-2-ylidene)bis(pentafluorobenzoato-κ<i>O</i>)ruthenium(II) dichloromethane disolvate","Acta Crystallographica Section E","2013","69","1","m28","","10.1107/S1600536812049513","","","0.71073","MoKα","","0.0822","0.0585","","","0.1514","0.1643","","","","","","1.093","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237167","7.6989","0.001","12.737","0.004","13.74","0.004","90","","90","","90","","1347.4","0.6","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","morphine","(5α,6α)-7,8-Didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol","","- C17 H19 N O3 -","- C17 H19 N O3 -","- C68 H76 N4 O12 -","4","1","IM2413","Gelbrich, Thomas; Braun, Doris E.; Griesser, Ulrich J.","Stable polymorph of morphine","Acta Crystallographica Section E","2013","69","1","o2","","10.1107/S1600536812048945","","","1.5418","CuKα","","0.0992","0.0681","","","0.1246","0.1405","","","","","","1.014","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237168","5.43804","0.00019","12.4222","0.0004","14.1684","0.0004","90","","100.269","0.003","90","","941.78","0.05","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-(3-Chlorophenyl)imidazo[2,1-<i>b</i>][1,3,4]thiadiazole","","- C10 H6 Cl N3 S -","- C10 H6 Cl N3 S -","- C40 H24 Cl4 N12 S4 -","4","1","IM2414","Praveen, A.S.; Jasinski, Jerry P.; Krauss, Shannon T.; Yathirajan, H. S.; Narayana, B.","6-(3-Chlorophenyl)imidazo[2,1-<i>b</i>][1,3,4]thiadiazole","Acta Crystallographica Section E","2013","69","1","o66","","10.1107/S1600536812049793","","","1.54184","CuKα","","0.0403","0.0362","","","0.0956","0.0998","","","","","","1.059","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237169","7.2508","0.0007","12.1372","0.0012","12.3509","0.0012","90","","102.278","0.002","90","","1062.07","0.18","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis[4-(1<i>H</i>-imidazol-2-yl)pyridine-κ<i>N</i>]bis(nitrato- κ<i>O</i>)cadmium","","- C16 H18 Cd N8 O8 -","- C16 H18 Cd N8 O8 -","- C32 H36 Cd2 N16 O16 -","2","0.5","IM2415","Zhang, Chuan-Yue; Wang, Tao; Jin, Chuan-Ming","Diaquabis[4-(1<i>H</i>-imidazol-2-yl)pyridine-κ<i>N</i>]bis(nitrato-κ<i>O</i>)cadmium","Acta Crystallographica Section E","2013","69","1","m67","","10.1107/S1600536812050908","","","0.71073","MoKα","","0.0376","0.0347","","","0.0827","0.0843","","","","","","1.104","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237170","10.882","0.005","12.063","0.005","17.41","0.007","90","","90","","90","","2285.4","1.7","93","1","93","1","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","<i>cis</i>-Bis(2,2'-bipyridine- κ^2^<i>N</i>,<i>N</i>')carbonylchloridoruthenium(II) hexafluoridophosphate","","- C21 H16 Cl F6 N4 O P Ru -","- C21 H16 Cl F6 N4 O P Ru -","- C84 H64 Cl4 F24 N16 O4 P4 Ru4 -","4","1","IS5220","Takase, Tsugiko; Mun, Bisa; Oyama, Dai","<i>cis</i>-Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')carbonylchloridoruthenium(II) hexafluoridophosphate","Acta Crystallographica Section E","2013","69","1","m1","m2","10.1107/S1600536812048246","","","0.71075","MoKα","","","0.0319","","","","0.0618","","","","","","1.083","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237171","7.1282","0.0006","12.1466","0.001","26.363","0.002","90","","90","","90","","2282.6","0.3","100","2","100","2","","","","","","","","4","P b c n","-P 2n 2ab","60","1,1'-bis(tert-butyldimethylsilyl)ferrocene","1,1'-Bis(<i>tert</i>-butyldimethylsilyl)ferrocene","","- C22 H38 Fe Si2 -","- C22 H38 Fe Si2 -","- C88 H152 Fe4 Si8 -","4","0.5","IS5223","Abri, Abdolreza; Soltani, Behzad; Ziegler, Christopher J.; Engle, James T.; Kia, Reza","1,1'-Bis(<i>tert</i>-butyldimethylsilyl)ferrocene","Acta Crystallographica Section E","2013","69","1","m46","","10.1107/S1600536812049069","","","0.71073","MoKα","","0.0288","0.0262","","","0.0654","0.0672","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237172","11.9477","0.0009","17.6585","0.0012","17.0422","0.0013","90","","104.939","0.0008","90","","3474","0.4","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,1,3,3-Tetra-<i>tert</i>-butyl-2,2-diisopropyl-4,4-diphenylcyclotetrasilane","","- C34 H60 Si4 -","- C34 H60 Si4 -","- C136 H240 Si16 -","4","0.5","IS5224","Kuribara, Takayoshi; Kyushin, Soichiro","1,1,3,3-Tetra-<i>tert</i>-butyl-2,2-diisopropyl-4,4-diphenylcyclotetrasilane","Acta Crystallographica Section E","2013","69","1","o149","","10.1107/S160053681205074X","","","0.71073","MoKα","","0.0488","0.0483","","","0.0952","0.0954","","","","","","1.236","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237173","6.675","0.0009","11.6952","0.0014","14.7283","0.0018","90","","90","","90","","1149.8","0.3","100","1","100","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","8-Hydroxy-5,7-dimethylquinolin-1-ium hydrogen sulfate","","- C11 H13 N O5 S -","- C11 H13 N O5 S -","- C44 H52 N4 O20 S4 -","4","1","IS5225","Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Arshad, Suhana; Razak, Ibrahim Abdul","8-Hydroxy-5,7-dimethylquinolin-1-ium hydrogen sulfate","Acta Crystallographica Section E","2013","69","1","o42","o43","10.1107/S1600536812049483","","","0.71073","MoKα","","0.0427","0.0393","","","0.101","0.1028","","","","","","1.05","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237174","6.799","0.0005","9.2215","0.0006","10.2123","0.0007","103.82","0.001","95.629","0.001","105.517","0.001","590.04","0.07","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","8-Hydroxy-5,7-dimethylquinolin-1-ium chloride dihydrate","","- C11 H16 Cl N O3 -","- C11 H16 Cl N O3 -","- C22 H32 Cl2 N2 O6 -","2","1","IS5226","Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Arshad, Suhana; Razak, Ibrahim Abdul","8-Hydroxy-5,7-dimethylquinolin-1-ium chloride dihydrate","Acta Crystallographica Section E","2013","69","1","o44","","10.1107/S1600536812049495","","","0.71073","MoKα","","0.0302","0.0282","","","0.0903","0.0922","","","","","","1.079","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237175","9.519","0.0019","9.812","0.002","12.726","0.003","110.3","0.03","104.89","0.03","96.81","0.03","1048.7","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(Furfurylamino)triphenylphosphonium bromide","","- C23 H21 Br N O P -","- C23 H21 Br N O P -","- C46 H42 Br2 N2 O2 P2 -","2","1","IS5227","Martínez de León, Carla; Tlahuext, Hugo; Flores-Parra, Angelina; Duarte-Hernández, Angélica María; Grévy, Jean-Michel","(Furfurylamino)triphenylphosphonium bromide","Acta Crystallographica Section E","2013","69","1","o118","","10.1107/S1600536812050805","","","0.71073","MoKα","","0.046","0.0379","","","0.1192","0.1286","","","","","","1.024","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237176","5.0843","0.0001","8.0771","0.0001","11.1928","0.0002","90","","91.214","0.001","90","","459.545","0.013","100","1","100","1","","","","","","","","4","P 1 21 1","P 2yb","4","","2,3-Diaminopyridinium hydrogen malonate","","- C8 H11 N3 O4 -","- C8 H11 N3 O4 -","- C16 H22 N6 O8 -","2","1","IS5228","Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Arshad, Suhana; Razak, Ibrahim Abdul","2,3-Diaminopyridinium hydrogen malonate","Acta Crystallographica Section E","2013","69","1","o92","o93","10.1107/S1600536812050386","","","0.71073","MoKα","","0.0389","0.0367","","","0.0914","0.0936","","","","","","1.07","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237177","9.6315","0.0005","10.8713","0.0006","12.1481","0.0007","90","","104.093","0.001","90","","1233.71","0.12","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-5-methylpyridinium 4-methylbenzoate","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C56 H64 N8 O8 -","4","1","IS5229","Thanigaimani, Kaliyaperumal; Farhadikoutenaei, Abbas; Arshad, Suhana; Razak, Ibrahim Abdul","2-Amino-5-methylpyridinium 4-methylbenzoate","Acta Crystallographica Section E","2013","69","1","o94","o95","10.1107/S1600536812050374","","","0.71073","MoKα","","0.0527","0.0433","","","0.1175","0.1248","","","","","","1.034","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237178","8.2781","0.0002","21.4763","0.0005","15.537","0.0004","90","","98.448","0.002","90","","2732.24","0.12","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[2,7-Dimethoxy-8-(4-methoxybenzoyl)naphthalen-1-yl](4-methoxyphenyl)methanone chloroform monosolvate","","- C29 H25 Cl3 O6 -","- C29 H25 Cl3 O6 -","- C116 H100 Cl12 O24 -","4","1","IS5230","Sasagawa, Kosuke; Sakamoto, Rei; Kusakabe, Taro; Okamoto, Akiko; Yonezawa, Noriyuki","[2,7-Dimethoxy-8-(4-methoxybenzoyl)naphthalen-1-yl](4-methoxyphenyl)methanone chloroform monosolvate","Acta Crystallographica Section E","2013","69","1","o146","","10.1107/S1600536812050799","","","1.54187","CuKα","","0.0389","0.0348","","","0.1038","0.1069","","","","","","1.104","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237179","9.851","0.0006","10.7707","0.0008","12.2123","0.0007","90","","102.335","0.002","90","","1265.84","0.14","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-5-methylpyridinium 4-chlorobenzoate","","- C13 H13 Cl N2 O2 -","- C13 H13 Cl N2 O2 -","- C52 H52 Cl4 N8 O8 -","4","1","IS5231","Thanigaimani, Kaliyaperumal; Farhadikoutenaei, Abbas; Arshad, Suhana; Razak, Ibrahim Abdul","2-Amino-5-methylpyridinium 4-chlorobenzoate","Acta Crystallographica Section E","2013","69","1","o134","o135","10.1107/S1600536812051021","","","0.71073","MoKα","","0.0798","0.0468","","","0.1207","0.1391","","","","","","1.039","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237180","9.004","0.007","5.767","0.005","12.617","0.01","90","","90.415","0.016","90","","655.1","0.9","100","1","100","1","","","","","","","","5","P 1 21 1","P 2yb","4","2-Amino-5-methylpyridinium 5-chlorosalicylate","2-Amino-5-methylpyridinium 2-hydroxy-5-chlorobenzoate","","- C13 H13 Cl N2 O3 -","- C13 H13 Cl N2 O3 -","- C26 H26 Cl2 N4 O6 -","2","1","IS5232","Thanigaimani, Kaliyaperumal; Farhadikoutenaei, Abbas; Arshad, Suhana; Razak, Ibrahim Abdul","2-Amino-5-methylpyridinium 2-hydroxy-5-chlorobenzoate","Acta Crystallographica Section E","2013","69","1","o132","o133","10.1107/S160053681205101X","","","0.71073","MoKα","","0.1005","0.0733","","","0.1743","0.2012","","","","","","1.014","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237181","16.0451","0.0003","4.7575","0.0001","19.7143","0.0004","90","","107.66","0.001","90","","1433.96","0.05","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Anilinium-3-carboxylate 3-carboxyanilinium nitrate","","- C14 H15 N3 O7 -","- C14 H15 N3 O7 -","- C56 H60 N12 O28 -","4","0.5","KJ2215","Ahmad, Saeed; Hussain, Sajjad; Sharif, Shahzad; Khan, Islam Ullah; Tahir, Muhammad Nawaz","Anilinium-3-carboxylate 3-carboxyanilinium nitrate","Acta Crystallographica Section E","2013","69","1","o29","","10.1107/S1600536812049392","","","0.71073","MoKα","","0.0406","0.037","","","0.0981","0.1009","","","","","","1.066","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237182","11.1751","0.0003","7.4623","0.0002","37.283","0.0008","90","","91.57","0.002","90","","3107.93","0.14","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4,4'-propane-2,2-diyldiantipyrine antipyrine","1,5-Dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one‒ 4,4'-(propane-2,2-diyl)bis[1,5-dimethyl-2-phenyl-1<i>H</i>- pyrazol-3(2<i>H</i>)-one] (1/1)","","- C36 H40 N6 O3 -","- C36 H40 N6 O3 -","- C144 H160 N24 O12 -","4","1","KJ2216","Lyczko, Krzysztof","1,5-Dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one‒4,4'-(propane-2,2-diyl)bis[1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one] (1/1)","Acta Crystallographica Section E","2013","69","1","o127","o128","10.1107/S160053681205091X","","","1.54178","CuKα","","0.0449","0.0395","","","0.0946","0.0985","","","","","","1.026","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237183","4.6273","0.0001","15.8565","0.0003","6.1719","0.0002","90","","95.598","0.002","90","","450.69","0.02","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Poly[(μ~4~-3-carboxypyrazine-2-carboxylato)(μ~4~-nitrato)dilithium]","","- C6 H3 Li2 N3 O7 -","- C6 H3 Li2 N3 O7 -","- C12 H6 Li4 N6 O14 -","2","1","KP2442","Starosta, Wojciech; Leciejewicz, Janusz","Poly[(μ~4~-3-carboxypyrazine-2-carboxylato)(μ~4~-nitrato)dilithium]","Acta Crystallographica Section E","2013","69","1","m62","","10.1107/S1600536812050738","","","0.71073","MoKα","","0.0398","0.0359","","","0.0804","0.0835","","","","","","1.101","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237184","16.8785","0.0005","5.4202","0.0002","19.6107","0.0006","90","","91.469","0.002","90","","1793.49","0.1","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2-[(3-Oxo-1-benzofuran-6-yl)oxy]acetonitrile","","- C11 H8 O3 -","- C11 H8 O3 -","- C88 H64 O24 -","8","1","LD2084","Kinfe, Henok H.; Belay, Yonas H.; Phasha, Zanele H.","2-[(3-Oxo-1-benzofuran-6-yl)oxy]acetonitrile","Acta Crystallographica Section E","2013","69","1","o74","","10.1107/S1600536812048441","","","1.54178","CuKα","","0.032","0.0301","","","","0.0758","","","","","","1.044","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237185","22.7845","0.0008","14.337","0.0005","9.8442","0.0003","90","","90.783","0.001","90","","3215.42","0.19","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Cyano-<i>N</i>-ethylspiro[chromene-2,4'-piperidine]-1'-carboxamide","","- C17 H19 N3 O2 -","- C17 H19 N3 O2 -","- C136 H152 N24 O16 -","8","2","LD2085","Rajalakshmi, P.; Srinivasan, N.; Krishnakumar, R. V.","4-Cyano-<i>N</i>-ethylspiro[chromene-2,4'-piperidine]-1'-carboxamide","Acta Crystallographica Section E","2013","69","1","o138","","10.1107/S1600536812051124","","","0.71073","MoKα","","0.0775","0.0495","","","0.1459","0.1769","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237186","10.2716","0.0004","20.0353","0.0007","14.379","0.0006","90","","97.047","0.001","90","","2936.8","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>rac</i>-5''-(4-Fluorobenzylidene)-1'-(4-fluorophenyl)-1''-methyl- 1',2',3',5',6',7',8',8a'-octahydrodispiro[acenaphthylene-1,3'-indolizine- 2',3''-piperidine]-2,4''(1<i>H</i>)-dione","","- C37 H32 F2 N2 O2 -","- C37 H32 F2 N2 O2 -","- C148 H128 F8 N8 O8 -","4","1","LD2088","Suresh, J.; Nagalakshmi, R. A.; Sivakumar, S.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","<i>rac</i>-5''-(4-Fluorobenzylidene)-1'-(4-fluorophenyl)-1''-methyl-1',2',3',5',6',7',8',8a'-octahydrodispiro[acenaphthylene-1,3'-indolizine-2',3''-piperidine]-2,4''(1<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","1","o140","o141","10.1107/S1600536812051094","","","0.71073","MoKα","","0.0827","0.046","","","0.1058","0.1261","","","","","","1.011","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237187","17.4656","0.0004","10.1883","0.0002","12.3465","0.0003","90","","106.806","0.002","90","","2103.16","0.08","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2,7,7-trimethyl-4-(1-methyl-1<i>H</i>-indol-3-yl)-5-oxo-1,4,5,6,7,8- hexahydroquinoline-3-carboxylate","","- C24 H28 N2 O3 -","- C24 H28 N2 O3 -","- C96 H112 N8 O12 -","4","1","LH5560","Öztürk Yildirim, Sema; Butcher, Ray J.; Gündüz, Miyase Gözde; El-Khouly, Ahmed; Şimşek, Rahime; Şafak, Cihat","Ethyl 2,7,7-trimethyl-4-(1-methyl-1<i>H</i>-indol-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","Acta Crystallographica Section E","2013","69","1","o40","o41","10.1107/S1600536812047976","","","1.54184","CuKα","","0.0536","0.0443","","","0.1172","0.1254","","","","","","1.028","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237188","8.5736","0.0007","9.5668","0.0008","9.675","0.0007","73.348","0.005","87.388","0.005","83.619","0.006","755.49","0.11","100","2","100","2","","","","","","","","4","P -1","-P 1","2","RS137:C13H9PO2HPh","(9<i>H</i>-Fluoren-9-yl)(phenyl)phosphinic acid","","- C19 H15 O2 P -","- C19 H15 O2 P -","- C38 H30 O4 P2 -","2","1","LH5563","Burrow, Robert A.; Siqueira da Silva, Rubia M.","(9<i>H</i>-Fluoren-9-yl)(phenyl)phosphinic acid","Acta Crystallographica Section E","2013","69","1","o1","","10.1107/S160053681204891X","","","0.71073","MoKα","","0.0621","0.0438","","","0.1019","0.1115","","","","","","1.028","","","","has coordinates,has Fobs","204117","2020-10-21","18:00:00",""
"2237189","13.0315","0.0003","13.3638","0.0002","19.3489","0.0005","96.358","0.002","99.229","0.001","116.191","0.001","2921.16","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Chlorido{<i>N</i>-[2-(diphenylphosphanyl)benzylidene]-2,6- diisopropylaniline-κ<i>P</i>}gold(I) chloroform 0.25-solvate","","- C31.25 H32.25 Au Cl1.75 N P -","- C31.25 H32.25 Au Cl1.75 N P -","- C125 H129 Au4 Cl7 N4 P4 -","4","2","LH5564","Chiririwa, Haleden; Davis, Wade L.","Chlorido{<i>N</i>-[2-(diphenylphosphanyl)benzylidene]-2,6-diisopropylaniline-κ<i>P</i>}gold(I) chloroform 0.25-solvate","Acta Crystallographica Section E","2013","69","1","m39","","10.1107/S1600536812049975","","","0.71073","MoKα","","0.0447","0.0304","","","0.059","0.065","","","","","","1.086","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237190","5.75357","0.00019","16.0368","0.0005","8.3114","0.0003","90","","95.34","0.003","90","","763.56","0.04","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Diphenylmethyl benzoate","","- C20 H16 O2 -","- C20 H16 O2 -","- C40 H32 O4 -","2","1","LH5566","Kaur, Manpreet; Jasinski, Jerry P.; Keeley, Amanda C.; Yathirajan, H. S.; Siddegowda, M. S.","Diphenylmethyl benzoate","Acta Crystallographica Section E","2013","69","1","o81","","10.1107/S1600536812050064","","","1.54184","CuKα","","0.0374","0.0351","","","0.092","0.0944","","","","","","1.064","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237191","10.4828","0.0003","14.8973","0.0004","14.2059","0.0003","90","","101.609","0.002","90","","2173.09","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(4-Hydroxy-3-methoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10- decahydroacridine-1,8-dione","","- C24 H29 N O4 -","- C24 H29 N O4 -","- C96 H116 N4 O16 -","4","1","LH5567","Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Patil, D. R.; Patil, P. P.; Deshmukh, Madhukar B.","9-(4-Hydroxy-3-methoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2013","69","1","o100","","10.1107/S1600536812050568","","","0.71073","MoKα","","0.0869","0.0544","","","0.1028","0.1157","","","","","","1.019","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237192","11.0505","0.0003","12.8264","0.0003","13.8548","0.0003","90","","100.215","0.002","90","","1932.63","0.08","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","9-(3-Fluorophenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10- decahydroacridine-1,8-dione","","- C23 H26 F N O2 -","- C23 H26 F N O2 -","- C92 H104 F4 N4 O8 -","4","1","LH5569","Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Patil, D. R.; Jagadale, S. D.; Deshmukh, Madhukar B.","9-(3-Fluorophenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2013","69","1","o101","","10.1107/S1600536812050556","","","0.71073","MoKα","","0.0606","0.0443","","","0.1075","0.1175","","","","","","1.03","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237193","24.2434","0.0006","9.603","0.0002","15.2426","0.0004","90","","93.96","0.002","90","","3540.15","0.15","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Amino-7,7-dimethyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8- hexahydroquinoline-3-carbonitrile","","- C19 H18 F3 N3 O -","- C19 H18 F3 N3 O -","- C152 H144 F24 N24 O8 -","8","1","LH5570","Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Patil, D. R.; Mulik, A. G.; Deshmukh, Madhukar B.","2-Amino-7,7-dimethyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile","Acta Crystallographica Section E","2013","69","1","o105","","10.1107/S1600536812050684","","","0.71073","MoKα","","0.0852","0.0573","","","0.1291","0.1431","","","","","","1.034","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237194","7.906","0.003","7.385","0.002","14.036","0.005","90","","102.025","0.005","90","","801.5","0.5","93","","93","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-(Prop-2-yn-1-yloxy)benzaldehyde","","- C10 H8 O2 -","- C10 H8 O2 -","- C40 H32 O8 -","4","1","LH5571","Doi, Ikue; Okuno, Tsunehisa","4-(Prop-2-yn-1-yloxy)benzaldehyde","Acta Crystallographica Section E","2013","69","1","o125","","10.1107/S1600536812050866","","","0.71075","MoKα","","","0.0368","","","","0.1009","","","","","","1.058","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237195","8.2332","0.001","10.573","0.0013","12.6673","0.0015","104.774","0.001","108.061","0.002","91.152","0.001","1007.8","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis[μ-2-(methoxycarbonyl)benzoato- κ^2^<i>O</i>^1^:<i>O</i>^1'^]bis[(acetonitrile- κ<i>N</i>)copper(II)](<i>Cu</i>—<i>Cu</i>)","","- C40 H34 Cu2 N2 O16 -","- C40 H34 Cu2 N2 O16 -","- C40 H34 Cu2 N2 O16 -","1","0.5","LR2089","Wang, Jing-lin; Wang, Cai-rong; Wang, Zhi-jun; Yang, Bin-sheng","Tetrakis[μ-2-(methoxycarbonyl)benzoato-κ^2^<i>O</i>^1^:<i>O</i>^1'^]bis[(acetonitrile-κ<i>N</i>)copper(II)](<i>Cu</i>—<i>Cu</i>)","Acta Crystallographica Section E","2013","69","1","m19","","10.1107/S1600536812049410","","","0.71073","MoKα","","0.0486","0.0366","","","0.0949","0.1051","","","","","","1.066","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237196","10.3524","0.0018","10.3524","0.0018","26.14","0.006","90","","90","","120","","2426.2","0.8","150","2","150","2","","","","","","","","6","P 32","P 32","145","","Tris(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cobalt(II) bis(hexafluoridophosphate)","","- C30 H24 Co F12 N6 P2 -","- C30 H24 Co F12 N6 P2 -","- C90 H72 Co3 F36 N18 P6 -","3","1","LR2090","Menteş, Ayfer; Singh, Kuldip","Tris(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cobalt(II) bis(hexafluoridophosphate)","Acta Crystallographica Section E","2013","69","1","m58","","10.1107/S1600536812050234","","","0.71073","MoKα","","0.0597","0.049","","","0.0841","0.0883","","","","","","0.935","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237197","9.99077","0.00019","9.99077","0.00019","14.5063","0.0004","90","","90","","90","","1447.95","0.06","123","2","123","2","","","","","","","","4","P 43 2 2","P 4cw 2c","95","","2,2,7,7-Tetramethyl-1,2,3,4,5,6,7,8-octahydroacridine-1,8-dione","","- C17 H21 N O2 -","- C17 H21 N O2 -","- C68 H84 N4 O8 -","4","0.5","MW2098","Öztürk Yildirim, Sema; Butcher, Ray J.; Şimsek, Rahime; El-Khouly, Ahmed; Şafak, Cihat","2,2,7,7-Tetramethyl-1,2,3,4,5,6,7,8-octahydroacridine-1,8-dione","Acta Crystallographica Section E","2013","69","1","o88","o89","10.1107/S1600536812048957","","","1.54184","CuKα","","0.0472","0.0431","","","0.116","0.1219","","","","","","1.09","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237198","6.276","0.003","10.202","0.005","11.411","0.005","94.541","0.007","93.305","0.006","96.918","0.007","721.4","0.6","123.15","","123","2","","","","","","","","6","P -1","-P 1","2","1-(2-Chlorobenzoyl)-3-(3-methoxyphenyl)thiourea","1-(2-Chlorobenzoyl)-3-(3-methoxyphenyl)thiourea","","- C15 H13 Cl N2 O2 S -","- C15 H13 Cl N2 O2 S -","- C30 H26 Cl2 N4 O4 S2 -","2","1","MW2100","Rauf, M. Khawar; Ebihara, Masahiro; Badshah, Amin","1-(2-Chlorobenzoyl)-3-(3-methoxyphenyl)thiourea","Acta Crystallographica Section E","2013","69","1","o19","","10.1107/S1600536812048830","","","0.7107","MoKα","","0.0377","0.0354","","","0.0864","0.0877","","","","","","1.086","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237199","13.7136","0.0004","5.5026","0.0004","16.5563","0.0005","90","","92.665","0.003","90","","1247.99","0.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6,12-Bis(hexyloxy)-5<i>H</i>,11<i>H</i>-indolo[3,2-<i>b</i>]carbazole","","- C30 H36 N2 O2 -","- C30 H36 N2 O2 -","- C60 H72 N4 O4 -","2","0.5","NC2301","Wrobel, Norma; Witulski, Bernhard; Schollmeyer, Dieter; Detert, Heiner","6,12-Bis(hexyloxy)-5<i>H</i>,11<i>H</i>-indolo[3,2-<i>b</i>]carbazole","Acta Crystallographica Section E","2013","69","1","o116","o117","10.1107/S1600536812050611","","","1.54178","CuKα","","0.0652","0.0569","","","0.1719","0.1806","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237200","4.4969","0.0002","7.9507","0.0006","11.0679","0.0008","73.854","0.006","84.788","0.005","80.903","0.005","374.87","0.04","190","2","190","2","","","","","","","","3","P -1","-P 1","2","","4-[4-(4-Formylphenoxy)butoxy]benzaldehyde","","- C18 H18 O4 -","- C18 H18 O4 -","- C18 H18 O4 -","1","0.5","NG5308","Balić, Tomislav; Marković, Berislav; Balić, Ivana","Triclinic polymorph of 4-[4-(4-formylphenoxy)butoxy]benzaldehyde","Acta Crystallographica Section E","2013","69","1","o126","","10.1107/S1600536812050994","","","0.7107","MoKα","","0.0491","0.0429","","","0.1186","0.1232","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237201","6.979","0.0003","9.9975","0.0008","13.8202","0.0011","77.899","0.001","78.956","0.002","78.507","0.002","912.58","0.11","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","(<i>E</i>)-2-Hydroxy-4-methoxy-3-(3-methylbut-2-enyl)-6-styrylbenzoic acid","","- C21 H22 O4 -","- C21 H22 O4 -","- C42 H44 O8 -","2","1","NG5309","Ji, Xingyue; Jin, Jie; Zheng, Guanghui; Li, Zhuorong","(<i>E</i>)-2-Hydroxy-4-methoxy-3-(3-methylbut-2-enyl)-6-styrylbenzoic acid","Acta Crystallographica Section E","2013","69","1","o91","","10.1107/S1600536812050258","","","0.71073","MoKα","","0.1022","0.052","","","0.12","0.1515","","","","","","1.063","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237202","6.4065","0.0002","13.1474","0.0004","13.3466","0.0004","70.718","0.003","81.7","0.003","80.134","0.003","1040.75","0.06","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","2-(Adamantan-1-yl)-1,3-bis(4-methylphenyl)propan-2-ol","","- C27 H34 O -","- C27 H34 O -","- C54 H68 O2 -","2","1","NK2194","Babjaková, Eva; Bartoš, Peter; Vícha, Robert","2-(Adamantan-1-yl)-1,3-bis(4-methylphenyl)propan-2-ol","Acta Crystallographica Section E","2013","69","1","o108","","10.1107/S1600536812050647","","","0.71073","MoKα","","0.0451","0.0348","","","0.0909","0.0943","","","","","","1.072","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237203","19.174","0.0012","5.5026","0.0003","8.9956","0.0005","90","","90","","90","","949.1","0.09","173","2","173","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","1-(2-Hydroxy-4,5-dimethoxyphenyl)ethanone","","- C10 H12 O4 -","- C10 H12 O4 -","- C40 H48 O16 -","4","1","NK2196","Scalzullo, Stefania M.; Khorasani, Sanaz; Michael, Joseph P.","1-(2-Hydroxy-4,5-dimethoxyphenyl)ethanone","Acta Crystallographica Section E","2013","69","1","o139","","10.1107/S1600536812051057","","","0.71073","MoKα","","0.0383","0.0318","","","0.082","0.085","","","","","","1.058","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237204","14.6042","0.0008","12.1781","0.0007","5.607","0.0003","90","","90","","90","","997.21","0.1","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","1-(4-Nitrophenyl)-1<i>H</i>-imidazol-3-ium chloride","","- C9 H8 Cl N3 O2 -","- C9 H8 Cl N3 O2 -","- C36 H32 Cl4 N12 O8 -","4","1","NR2034","Ibrahim, Halliru; Bala, Muhammad D.","1-(4-Nitrophenyl)-1<i>H</i>-imidazol-3-ium chloride","Acta Crystallographica Section E","2013","69","1","o114","","10.1107/S1600536812050878","","","0.71073","MoKα","","0.0311","0.029","","","0.0735","0.0758","","","","","","1.089","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237205","13.019","0.002","13.687","0.003","13.875","0.003","108.371","0.004","94.768","0.004","102.691","0.004","2257.9","0.8","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","Hexakis{μ~3~-2-[(1,3- dimethylimidazolidene)amino]benzenethiolato}dicopper(II)tetracopper(I) bis(hexafluoridophosphate) acetonitrile disolvate dichloromethane disolvate","","- C72 H94 Cl4 Cu6 F12 N20 P2 S6 -","- C72 H94 Cl4 Cu6 F12 N20 P2 S6 -","- C72 H94 Cl4 Cu6 F12 N20 P2 S6 -","1","0.5","NR2037","Neuba, Adam; Flörke, Ulrich; Henkel, Gerald","The mixed-valent copper thiolate complex hexakis{μ~3~-2-[(1,3-dimethylimidazolidene)amino]benzenethiolato}dicopper(II)tetracopper(I) bis(hexafluoridophosphate) acetonitrile disolvate dichloromethane disolvate","Acta Crystallographica Section E","2013","69","1","m54","m55","10.1107/S1600536812050428","","","0.71073","MoKα","","0.0648","0.0481","","","0.1275","0.1384","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237206","10.0222","0.0002","17.148","0.0003","21.2925","0.0004","90","","92.042","0.001","90","","3657.02","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzyltriphenylphosphonium dichloridotriphenylstannate(IV)","","- C43 H37 Cl2 P Sn -","- C43 H37 Cl2 P Sn -","- C172 H148 Cl8 P4 Sn4 -","4","1","PK2448","Traore, Bocar; Boye, Mouhamadou Sembene; Sidibe, Mamadou; Diop, Libasse; Guionneau, Philippe","Benzyltriphenylphosphonium dichloridotriphenylstannate(IV)","Acta Crystallographica Section E","2013","69","1","m42","","10.1107/S1600536812049689","","","0.71073","MoKα","","0.0779","0.0394","","","0.0863","0.1017","","","","","","1.025","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237207","9.53","0.0019","9.924","0.002","12.449","0.003","69.05","0.03","80.59","0.03","88.75","0.03","1083.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-{(<i>Z</i>)-1-(2,4-Dichlorophenyl)-1-[2-(4-methylphenoxy)ethoxy]prop- 1-en-2-yl}-1<i>H</i>-imidazol-3-ium nitrate","","- C21 H21 Cl2 N3 O5 -","- C21 H21 Cl2 N3 O5 -","- C42 H42 Cl4 N6 O10 -","2","1","PV2548","Guo, Song; Hu, Yong-hong; Luan, Yuan-yuan; Wang, Lu-lu; Yang, Wen-ge","1-{(<i>Z</i>)-1-(2,4-Dichlorophenyl)-1-[2-(4-methylphenoxy)ethoxy]prop-1-en-2-yl}-1<i>H</i>-imidazol-3-ium nitrate","Acta Crystallographica Section E","2013","69","1","o27","","10.1107/S1600536812046181","","","0.71073","MoKα","","0.0688","0.0477","","","0.1403","0.1583","","","","","","1.006","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237208","21.983","0.002","7.8173","0.0006","11.7489","0.001","90","","116.158","0.002","90","","1812.2","0.3","296","2","296","2","","","","","","","","3","C 1 c 1","C -2yc","9","","[2-(3,4-Dimethylbenzoyl)phenyl](4-methoxyphenyl)methanone","","- C23 H20 O3 -","- C23 H20 O3 -","- C92 H80 O12 -","4","1","PV2606","Jagadeesan, G.; Sethusankar, K.; Sivasakthikumaran, R.; Mohanakrishnan, Arasambattu K.","[2-(3,4-Dimethylbenzoyl)phenyl](4-methoxyphenyl)methanone","Acta Crystallographica Section E","2013","69","1","o26","","10.1107/S1600536812047654","","","0.71073","MoKα","","0.0976","0.0505","","","0.1364","0.1729","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237209","9.1046","0.0012","13.205","0.0018","13.3427","0.0018","98.854","0.003","105.147","0.003","105.494","0.003","1448.3","0.3","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","Triethylammonium 4-(3,5-dinitrobenzamido)-<i>N</i>-(3,5-dinitrobenzoyl)benzenesulfonamidate","","- C26 H27 N7 O12 S -","- C26 H27 N7 O12 S -","- C52 H54 N14 O24 S2 -","2","1","PV2607","Waris, Ghulam; Siddiqi, Humaira Masood; Flörke, Ulrich; Hussain, Rizwan; Butt, M. Saeed","Triethylammonium 4-(3,5-dinitrobenzamido)-<i>N</i>-(3,5-dinitrobenzoyl)benzenesulfonamidate","Acta Crystallographica Section E","2013","69","1","o97","","10.1107/S1600536812050180","","","0.71073","MoKα","","0.0669","0.0411","","","0.0767","0.0837","","","","","","0.885","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237210","10.4784","0.0005","10.2624","0.0004","21.0937","0.001","90","","95.35","0.003","90","","2258.4","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 8,13-dioxa-21-azapentacyclo[18.5.1.0^2,7^.0^14,19^.0^21,25^]hexacosa- 2(7),3,5,14,16,18-hexaene-26-carboxylate","","- C26 H31 N O4 -","- C26 H31 N O4 -","- C104 H124 N4 O16 -","4","1","PV2608","Narayanan, Sibi; Srinivasan, Thothadri; Purushothaman, Santhanagopalan; Raghunathan, Raghavachary; Velmurugan, Devadasan","Ethyl 8,13-dioxa-21-azapentacyclo[18.5.1.0^2,7^.0^14,19^.0^21,25^]hexacosa-2(7),3,5,14,16,18-hexaene-26-carboxylate","Acta Crystallographica Section E","2013","69","1","o25","","10.1107/S1600536812049094","","","0.71073","MoKα","","0.1087","0.0571","","","0.1487","0.1802","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237211","7.6496","0.0011","13.0693","0.0019","11.1617","0.0017","90","","106.475","0.003","90","","1070.1","0.3","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-{[(Dimethylamino)methylidene]amino}-5-nitrobenzonitrile","","- C10 H10 N4 O2 -","- C10 H10 N4 O2 -","- C40 H40 N16 O8 -","4","1","PV2610","Saad, Syed Muhammad; Haider, Syed Moazzam; Perveen, Shahnaz; Khan, Khalid M.; Yousuf, Sammer","2-{[(Dimethylamino)methylidene]amino}-5-nitrobenzonitrile","Acta Crystallographica Section E","2013","69","1","o75","","10.1107/S1600536812048866","","","0.71073","MoKα","","0.0665","0.0462","","","0.1219","0.1344","","","","","","1.042","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237212","7.167","0.003","8","0.004","11.252","0.005","81.625","0.014","74.58","0.012","83.979","0.015","613.8","0.5","123.15","","123","2","","","","","","","","6","P -1","-P 1","2","","1-(2-Chlorobenzoyl)-3-(pyrimidin-2-yl)thiourea","","- C12 H9 Cl N4 O S -","- C12 H9 Cl N4 O S -","- C24 H18 Cl2 N8 O2 S2 -","2","1","PV2612","Rauf, M. Khawar; Yaseen, Samad; Ebihara, Masahiro; Badshah, Amin","1-(2-Chlorobenzoyl)-3-(pyrimidin-2-yl)thiourea","Acta Crystallographica Section E","2013","69","1","o84","","10.1107/S1600536812050118","","","0.7107","MoKα","","0.0374","0.0342","","","0.0805","0.0821","","","","","","1.074","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237213","10.90063","0.00008","20.37357","0.00017","11.88385","0.00009","90","","104.355","0.0008","90","","2556.82","0.04","100","0.1","100","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","Narciclasine hemihydrate","(2<i>S</i>,3<i>R</i>,4<i>S</i>,4a<i>R</i>)-2,3,4,7-Tetrahydroxy-3,4,4a,5- tetrahydro[1,3]dioxolo[4,5-<i>j</i>]phenanthridin-6(2<i>H</i>)-one hemihydrate","","- C14 H14 N O7.5 -","- C14 H13.75 N O7.5 -","- C112 H110 N8 O60 -","8","4","RK2387","Jucov, Evgheni; Kornienko, Alexander; Masi, Marco; Evidente, Antonio; Antipin, Mikhail","(2<i>S</i>,3<i>R</i>,4<i>S</i>,4a<i>R</i>)-2,3,4,7-Tetrahydroxy-3,4,4a,5-tetrahydro[1,3]dioxolo[4,5-<i>j</i>]phenanthridin-6(2<i>H</i>)-one hemihydrate","Acta Crystallographica Section E","2013","69","1","o9","o10","10.1107/S1600536812048763","","","1.5418","CuKα","","0.0475","0.0474","","","0.1212","0.1215","","","","","","1.045","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237214","7.6232","0.001","9.4004","0.0009","11.8031","0.0012","80.121","0.008","71.555","0.01","74.732","0.01","770.44","0.16","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","2-[1-(2-Hydroxy-6-methoxyphenyl)ethylidene]-<i>N</i>- methylhydrazinecarbothioamide acetonitrile monosolvate","","- C13 H18 N4 O2 S -","- C13 H18 N4 O2 S -","- C26 H36 N8 O4 S2 -","2","1","RK2388","Anderson, Brian J.; Keeler, Alexander M.; O'Rourke, Kelly A.; Krauss, Shannon T.; Jasinski, Jerry P.","2-[1-(2-Hydroxy-6-methoxyphenyl)ethylidene]-<i>N</i>-methylhydrazinecarbothioamide acetonitrile monosolvate","Acta Crystallographica Section E","2013","69","1","o11","","10.1107/S1600536812048799","","","1.54184","CuKα","","0.0674","0.0627","","","0.1618","0.1702","","","","","","1.058","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237215","14.1344","0.001","6.542","0.0005","11.3748","0.0008","90","","90","","90","","1051.8","0.13","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","(<i>Z</i>)-1-Chloro-1-[2-(2-nitrophenyl)hydrazinylidene]propan-2-one","","- C9 H8 Cl N3 O3 -","- C9 H8 Cl N3 O3 -","- C36 H32 Cl4 N12 O12 -","4","0.5","RN2108","Morjan, Rami Y.; Abu Thaher, Bassam A.; Schollmeyer, Dieter; Awadallah, Adel M.; Gardiner, John M.","(<i>Z</i>)-1-Chloro-1-[2-(2-nitrophenyl)hydrazinylidene]propan-2-one","Acta Crystallographica Section E","2013","69","1","o72","","10.1107/S1600536812049938","","","0.71073","MoKα","","0.0659","0.0442","","","0.1064","0.1207","","","","","","1.054","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237216","5.1486","0.0002","15.1631","0.0006","16.4206","0.0007","90","","90.562","0.003","90","","1281.87","0.09","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Cytosinium orotate dihydrate","4-Amino-2-oxo-1,2-dihydropyrimidin-3-ium 2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate dihydrate","","- C9 H13 N5 O7 -","- C9 H13 N5 O7 -","- C36 H52 N20 O28 -","4","1","RZ5024","Portalone, Gustavo","Cytosinium orotate dihydrate","Acta Crystallographica Section E","2013","69","1","o14","o15","10.1107/S1600536812049057","","","0.71069","MoKα","","0.0593","0.0459","","","0.1189","0.1252","","","","","","1.127","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237217","8.2197","0.0005","15.863","0.001","11.0108","0.0006","90","","93.45","0.006","90","","1433.09","0.15","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>N</i>-(2,3-Dichlorophenyl)-2-nitrobenzenesulfonamide","","- C12 H8 Cl2 N2 O4 S -","- C12 H8 Cl2 N2 O4 S -","- C48 H32 Cl8 N8 O16 S4 -","4","1","RZ5027","Chaithanya, U.; Foro, Sabine; Gowda, B. Thimme","<i>N</i>-(2,3-Dichlorophenyl)-2-nitrobenzenesulfonamide","Acta Crystallographica Section E","2013","69","1","o76","","10.1107/S1600536812048076","","","0.71073","MoKα","","0.0516","0.0366","","","0.0852","0.092","","","","","","1.012","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237218","19","0.003","7.3502","0.0016","11.0825","0.0016","90","","92.06","0.008","90","","1546.7","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-({4-[(4-Nitrophenyl)diazenyl]phenyl}imino)diethanol","","- C16 H18 N4 O4 -","- C16 H18 N4 O4 -","- C64 H72 N16 O16 -","4","1","RZ5028","Duangthongyou, Tanwawan; Suwanruji, Potjanart; Suesat, Jantip; Achiwawanich, Supakit","2,2'-({4-[(4-Nitrophenyl)diazenyl]phenyl}imino)diethanol","Acta Crystallographica Section E","2013","69","1","o22","","10.1107/S1600536812049239","","","0.71073","MoKα","","0.0845","0.0436","","","0.1159","0.1523","","","","","","0.926","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237219","7.244","0.0007","10.2832","0.001","11.1622","0.0011","72.475","0.002","83.663","0.002","70.429","0.002","747.05","0.13","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>-(2,5-Dimethoxyphenyl)-6-nitroquinazolin-4-amine","","- C16 H14 N4 O4 -","- C16 H14 N4 O4 -","- C32 H28 N8 O8 -","2","1","RZ5029","Saad, Syed Muhammad; Khan, Imran; Perveen, Shahnaz; Khan, Khalid M.; Yousuf, Sammer","<i>N</i>-(2,5-Dimethoxyphenyl)-6-nitroquinazolin-4-amine","Acta Crystallographica Section E","2013","69","1","o8","","10.1107/S1600536812048878","","","0.71073","MoKα","","0.0513","0.0415","","","0.1104","0.1197","","","","","","1.048","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237220","11.519","0.007","11.021","0.006","32.386","0.018","90","","91.112","0.01","90","","4111","4","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","4,6-Dimethylpyrimidin-2-amine","","- C6 H9 N3 -","- C6 H9 N3 -","- C144 H216 N72 -","24","3","RZ5030","Fu, Wei-Wei; Liu, Yang; Huang, Geng; Zhu, Xiao-Ming","4,6-Dimethylpyrimidin-2-amine","Acta Crystallographica Section E","2013","69","1","o32","","10.1107/S1600536812049458","","","0.71073","MoKα","","0.1047","0.0619","","","0.153","0.1754","","","","","","1.011","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237221","15.763","0.003","29.579","0.006","11.368","0.002","90","","90.83","0.03","90","","5299.8","1.7","150","2","150","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[tetrakis(hexamethylphosphoramide-κ<i>O</i>)bis(nitrato- κ^2^<i>O</i>,<i>O</i>')erbium(III)] [silver(I)-di-μ-sulfido-tungstate(VI)-di-μ-sulfido]]","","- C24 H72 Ag Er N14 O10 P4 S4 W -","- C24 H72 Ag Er N14 O10 P4 S4 W -","- C96 H288 Ag4 Er4 N56 O40 P16 S16 W4 -","4","1","RZ5031","Wei, Hongyang; Zhang, Jinfang; Zhang, Chi","<i>catena</i>-Poly[[tetrakis(hexamethylphosphoramide-κ<i>O</i>)bis(nitrato-κ^2^<i>O</i>,<i>O</i>')erbium(III)] [silver(I)-di-μ-sulfido-tungstate(VI)-di-μ-sulfido]]","Acta Crystallographica Section E","2013","69","1","m43","m44","10.1107/S1600536812049987","","","0.71073","MoKα","","0.0527","0.0465","","","0.0879","0.0922","","","","","","1.083","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237222","7.5657","0.0006","10.8711","0.0007","11.5419","0.0007","90","","90","","90","","949.29","0.11","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-Methoxybenzamidinium bromide","","- C8 H11 Br N2 O -","- C8 H11 Br N2 O -","- C32 H44 Br4 N8 O4 -","4","1","RZ5032","Irrera, Simona; Portalone, Gustavo","4-Methoxybenzamidinium bromide","Acta Crystallographica Section E","2013","69","1","o56","","10.1107/S1600536812049872","","","0.71069","MoKα","","0.0356","0.0273","","","0.0527","0.0547","","","","","","1.089","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237223","8.1989","0.0005","10.4442","0.0006","20.8877","0.0013","90","","90","","90","","1788.63","0.19","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>R</i>,<i>R</i>)-1-Acetyl-1'-(2,4,6-trinitrophenyl)-2,2'-bipyrrolidine","","- C16 H19 N5 O7 -","- C16 H19 N5 O7 -","- C64 H76 N20 O28 -","4","1","RZ5033","Eichstaedt, Katarzyna; Olszewska, Teresa; Gdaniec, Maria","(<i>R</i>,<i>R</i>)-1-Acetyl-1'-(2,4,6-trinitrophenyl)-2,2'-bipyrrolidine","Acta Crystallographica Section E","2013","69","1","o144","o145","10.1107/S1600536812051161","","","0.71073","MoKα","","0.0585","0.0432","","","0.0838","0.0896","","","","","","1.062","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237224","7.0835","0.0005","10.4059","0.0007","12.8461","0.0008","73.91","0.003","89.756","0.004","73.436","0.004","869.16","0.1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2-Hydroxy-4-(prop-2-ynyloxy)benzaldehyde","","- C10 H8 O3 -","- C10 H8 O3 -","- C40 H32 O12 -","4","2","SJ5285","Selvarani, V.; Neelakantan, M.A.; Silambarasan, V.; Velmurugan, D.","2-Hydroxy-4-(prop-2-ynyloxy)benzaldehyde","Acta Crystallographica Section E","2013","69","1","o64","","10.1107/S1600536812049598","","","0.71073","MoKα","","0.0716","0.044","","","0.1144","0.1324","","","","","","1.049","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237225","7.9711","0.0001","17.4106","0.0003","13.5265","0.0002","90","","99.237","0.002","90","","1852.89","0.05","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,3-Diethyl-2-sulfanylidene-5-(2,4,5-trimethoxybenzylidene)-1,3-diazinane-4,6-dione","","- C18 H22 N2 O5 S -","- C18 H22 N2 O5 S -","- C72 H88 N8 O20 S4 -","4","1","SJ5286","Asiri, Abdullah M.; Arshad, Muhammad Nadeem; Zia-ur-Rehman, Muhammad; Sobahi, Tariq R.","1,3-Diethyl-2-sulfanylidene-5-(2,4,5-trimethoxybenzylidene)-1,3-diazinane-4,6-dione","Acta Crystallographica Section E","2013","69","1","o49","","10.1107/S1600536812049707","","","1.54184","CuKα","","0.0505","0.0413","","","0.1121","0.1205","","","","","","1.047","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237226","15.825","0.003","7.619","0.0013","15.082","0.004","90","","118.179","0.002","90","","1602.9","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[μ-<i>N</i>^1^,<i>N</i>^2^-Bis(pyridin-2-yl)hydrazine-1,2- dicarbothioamidato]bis[chloridocopper(II)]","","- C12 H10 Cl2 Cu2 N6 S2 -","- C12 H10 Cl2 Cu2 N6 S2 -","- C48 H40 Cl8 Cu8 N24 S8 -","4","0.5","SU2393","Liu, Yang; Zhang, Bingguang; Deng, Kejian","[μ-<i>N</i>^1^,<i>N</i>^2^-Bis(pyridin-2-yl)hydrazine-1,2-dicarbothioamidato]bis[chloridocopper(II)]","Acta Crystallographica Section E","2013","69","1","m45","","10.1107/S1600536812048659","","","0.71073","MoKα","","0.0265","0.0242","","","0.0661","0.0675","","","","","","1.068","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237227","15.416","0.003","11.474","0.003","17.094","0.004","90","","97.14","0.02","90","","3000.2","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-Azido-κ^2^<i>N</i>^1^:<i>N</i>^1^-μ-chlorido-bis[(2-chloro-3- dimethylamino-1-phenylprop-1-en-1-yl-κ^2^<i>C</i>^1^,<i>N</i>)palladium(II)] chloroform monosolvate","","- C23 H27 Cl6 N5 Pd2 -","- C23 H27 Cl6 N5 Pd2 -","- C92 H108 Cl24 N20 Pd8 -","4","1","SU2528","Mafud, Ana C.; Oliviera, Milene A. R.; Gambardella, Maria T. P.","μ-Azido-κ^2^<i>N</i>^1^:<i>N</i>^1^-μ-chlorido-bis[(2-chloro-3-dimethylamino-1-phenylprop-1-en-1-yl-κ^2^<i>C</i>^1^,<i>N</i>)palladium(II)] chloroform monosolvate","Acta Crystallographica Section E","2013","69","1","m15","","10.1107/S1600536812047927","","","0.71073","MoKα","","0.2376","0.0634","","","","0.1697","","","","","","0.932","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237228","6.2529","0.0007","11.0931","0.001","27.64","0.002","90","","90","","90","","1917.2","0.3","290","2","290","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(Benzyl isocyanide-κ<i>C</i>^1^)chlorido(2-chloro-3-dimethylamino-1-phenylprop- 1-en-1-yl-κ^2^<i>C</i>^1^,<i>N</i>)palladium(II)","","- C19 H20 Cl2 N2 Pd -","- C19 H20 Cl2 N2 Pd -","- C76 H80 Cl8 N8 Pd4 -","4","1","SU2529","Mafud, Ana C.; Oliviera, Milene A. R.; Gambardella, Maria T. P.","(Benzyl isocyanide-κ<i>C</i>^1^)chlorido(2-chloro-3-dimethylamino-1-phenylprop-1-en-1-yl-κ^2^<i>C</i>^1^,<i>N</i>)palladium(II)","Acta Crystallographica Section E","2013","69","1","m36","","10.1107/S1600536812049768","","","0.71073","MoKα","","0.0891","0.0389","","","","0.0854","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237229","8.726","0.0002","14.293","0.0003","18.108","0.0005","106.712","0.001","96.49","0.001","97.667","0.001","2116.27","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>,<i>N</i>-Diethylanilinium 5-(2,4-dinitrophenyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate","","- C20 H21 N5 O7 -","- C20 H21 N5 O7 -","- C80 H84 N20 O28 -","4","2","SU2535","Kalaivani, Doraisamyraja; Mangaiyarkarasi, Govindan","<i>N</i>,<i>N</i>-Diethylanilinium 5-(2,4-dinitrophenyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate","Acta Crystallographica Section E","2013","69","1","o3","o4","10.1107/S160053681204874X","","","0.71073","MoKα","","0.0616","0.0423","","","0.1087","0.1221","","","","","","1.022","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237230","6.6211","0.0004","12.6668","0.0007","18.3413","0.0011","90","","90.698","0.004","90","","1538.14","0.16","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2,7,7,12,12,17,17-Octamethyl-21,22,23,24-tetrathia-2,7,12,17- tetragermapentacyclo[16.2.1.1^3,6^.1^8,11^.1^13,16^]tetracosa- 3,5,8,10,13,15,18,20-octaene","","- C24 H32 Ge4 S4 -","- C24 H32 Ge4 S4 -","- C48 H64 Ge8 S8 -","2","0.5","SU2536","Carel, Guillaume; Mallet-Ladeira, Sonia; Rima, Ghassoub; Madec, David; Castel, Annie","2,2,7,7,12,12,17,17-Octamethyl-21,22,23,24-tetrathia-2,7,12,17-tetragermapentacyclo[16.2.1.1^3,6^.1^8,11^.1^13,16^]tetracosa-3,5,8,10,13,15,18,20-octaene","Acta Crystallographica Section E","2013","69","1","m37","","10.1107/S1600536812049720","","","0.71073","MoKα","","0.0568","0.0304","","","0.0568","0.0643","","","","","","1.013","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237231","16.8362","0.0009","8.1692","0.0004","14.44","0.0008","90","","98","0.003","90","","1966.72","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","14-Ethoxy-4,6-dimethyl-9-phenyl-8,12-dioxa-4,6- diazatetracyclo[8.8.0.0^2,7^.0^13,18^]octadeca-2(7),13,15,17-tetraene- 3,5,11-trione","","- C23 H20 N2 O6 -","- C23 H20 N2 O6 -","- C92 H80 N8 O24 -","4","1","SU2537","Jagadeesan, G.; Kannan, D.; Bakthadoss, M.; Aravindhan, S.","14-Ethoxy-4,6-dimethyl-9-phenyl-8,12-dioxa-4,6-diazatetracyclo[8.8.0.0^2,7^.0^13,18^]octadeca-2(7),13,15,17-tetraene-3,5,11-trione","Acta Crystallographica Section E","2013","69","1","o80","","10.1107/S160053681205009X","","","0.71073","MoKα","","0.0706","0.0455","","","0.1161","0.13","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237232","7.92185","0.00014","20.6794","0.0004","14.213","0.0003","90","","106.043","0.001","90","","2237.68","0.08","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(8-Benzoyl-2,7-diethoxynaphthalen-1-yl)(phenyl)methanone","","- C28 H24 O4 -","- C28 H24 O4 -","- C112 H96 O16 -","4","1","SU2538","Isogai, Atsumi; Tsumuki, Takehiro; Murohashi, Shun; Okamoto, Akiko; Yonezawa, Noriyuki","(8-Benzoyl-2,7-diethoxynaphthalen-1-yl)(phenyl)methanone","Acta Crystallographica Section E","2013","69","1","o71","","10.1107/S1600536812049963","","","1.54187","CuKα","","0.0374","0.0348","","","0.0886","0.0905","","","","","","1.05","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237233","7.697","0.0007","7.7339","0.0007","15.7254","0.0013","84.541","0.002","81.314","0.002","78.717","0.001","905.4","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis[(1<i>RS</i>,2<i>RS</i>)-4,4'-(1-azaniumyl-2-hydroxyethane-1,2- diyl)dipyridinium] tris[tetrachloridopalladate(II)]","","- C24 H32 Cl12 N6 O2 Pd3 -","- C24 H32 Cl12 N6 O2 Pd3 -","- C24 H32 Cl12 N6 O2 Pd3 -","1","0.5","SU2540","Campos-Gaxiola, Jose J.; Baez-Castro, Alberto; Cruz-Enriquez, Adriana; Hopfl, Herbert; Parra-Hake, Miguel","Bis[(1<i>RS</i>,2<i>RS</i>)-4,4'-(1-azaniumyl-2-hydroxyethane-1,2-diyl)dipyridinium] tris[tetrachloridopalladate(II)]","Acta Crystallographica Section E","2013","69","1","m65","m66","10.1107/S1600536812050817","","","0.71073","MoKα","","0.0349","0.0317","","","0.0748","0.0766","","","","","","1.072","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237234","10.51","0.002","15.63","0.003","23.28","0.005","104.69","0.03","90.2","0.03","109.58","0.03","3468.9","1.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","[(L){Rh(COD)}~2~][PF~6~]~2~ (L = bis{4,5-bis(1-methylene-3- methylimidazolidene)}benzo-18-crown-6; COD = 1,5-cyclooctadiene)","(μ-3,3',3'',3'''-{[2,5,8,15,18,21- Hexaoxatricyclo[20.4.0.0^9,14^]hexacosa-1(22),9,11,13,23,25-hexaene- 11,12,24,25-tetrayl]tetrakis(methylene)}tetrakis(1-methyl-1<i>H</i>-imidazol- 2-yl))bis[(η^4^-cycloocta-1,4-diene)rhodium(I)] bis(hexafluoridophosphate) acetonitrile sesquisolvate dihydrate","","- C59 H74.5 F12 N9.5 O8 P2 Rh2 -","- C59 H74.5 F12 N9.5 O8 P2 Rh2 -","- C118 H149 F24 N19 O16 P4 Rh4 -","2","1","TK5170","Shrestha, Sumi; Bhadbhade, Mohan; Gimbert-Suriñach, Carolina; Colbran, Stephen B.","A dimer of bis(N-heterocyclic carbene)rhodium(I) centres spanned by a dibenzo-18-crown-6 bridge from synchrotron radiation","Acta Crystallographica Section E","2013","69","1","m47","m48","10.1107/S160053681204901X","","","0.71073","Synchrotron","","0.0582","0.0509","","","0.1588","0.1642","","","","","","1.333","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237235","12.3393","0.0004","15.1238","0.0006","14.6988","0.0004","90","","95.037","0.003","90","","2732.45","0.16","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-<i>tert</i>-butyl-<i>N</i>-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)- 2-(pyrimidin-2-yl)pyrimidin-4-yl]benzene-1-sulfonamide monohydrate","","- C27 H31 N5 O7 S -","- C27 H31 N5 O7 S -","- C108 H124 N20 O28 S4 -","4","1","TK5176","Kaur, Manpreet; Jasinski, Jerry P.; Keeley, Amanda C.; Yathirajan, H. S.; Betz, Richard; Gerber, Thomas; Butcher, Ray J.","Bosentan monohydrate","Acta Crystallographica Section E","2013","69","1","o12","o13","10.1107/S1600536812048969","","","1.54184","CuKα","","0.07","0.055","","","0.1529","0.1631","","","","","","1.034","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237236","10.695","0.003","44.458","0.014","4.4437","0.0011","90","","99.004","0.009","90","","2086.8","1","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","1-[4-({4-[(<i>E</i>)-(2-Hydroxynaphthalen-1- yl)methylideneamino]phenyl}sulfanyl)phenyl]ethanone","","- C25 H19 N O2 S -","- C25 H19 N O2 S -","- C100 H76 N4 O8 S4 -","4","1","TK5178","Hebbachi, Rabihe; Mousser, Hénia; Mousser, Abdelhamid","1-[4-({4-[(<i>E</i>)-(2-Hydroxynaphthalen-1-yl)methylideneamino]phenyl}sulfanyl)phenyl]ethanone","Acta Crystallographica Section E","2013","69","1","o67","o68","10.1107/S1600536812049835","","","0.71073","MoKα","","0.06","0.0459","","","0.1156","0.1245","","","","","","0.983","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237237","5.0314","0.0001","5.0314","0.0001","58.701","0.003","90","","90","","90","","1486.01","0.09","100","0.1","100","0.1","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","<i>N</i>,<i>N</i>'-(Pyridine-2,6-diyl)dibenzamide","","- C19 H15 N3 O2 -","- C19 H15 N3 O2 -","- C76 H60 N12 O8 -","4","0.5","TK5180","Mahboubi Anarjan, Parisa; Noshiranzadeh, Nader; Bikas, Rahman; Woińska, Magdalena; Wozniak, Krzysztof","<i>N</i>,<i>N</i>'-(Pyridine-2,6-diyl)dibenzamide","Acta Crystallographica Section E","2013","69","1","o102","","10.1107/S1600536812050167","","","0.71073","MoKα","","0.0516","0.0441","","","0.0866","0.0895","","","","","","1.226","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237238","12.5585","0.0005","5.7181","0.0002","17.4153","0.0007","90","","95.277","0.002","90","","1245.31","0.08","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(4-Methylbenzyl)-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","","- C15 H14 N2 O -","- C15 H14 N2 O -","- C60 H56 N8 O4 -","4","1","TK5182","Belaziz, Dounia; Kandri Rodi, Youssef; Ouazzani Chahdi, Fouad; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen","1-(4-Methylbenzyl)-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","1","o122","","10.1107/S1600536812050726","","","0.71073","MoKα","","0.0781","0.0444","","","0.106","0.1219","","","","","","1.02","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237239","5.6252","0.0002","22.5957","0.0008","7.5777","0.0003","90","","109.498","0.004","90","","907.93","0.06","135","0.1","135","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-3-Dimethylamino-1-(1,3-thiazol-2-yl)prop-2-en-1-one","","- C8 H10 N2 O S -","- C8 H10 N2 O S -","- C32 H40 N8 O4 S4 -","4","1","VM2183","You, Xin-Yu; Shi, Yao-Jie; Yu, Luo-Ting","(<i>E</i>)-3-Dimethylamino-1-(1,3-thiazol-2-yl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","1","o18","","10.1107/S1600536812048817","","","0.7107","MoKα","","0.0434","0.0347","","","0.0856","0.0902","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237240","8.9501","0.0002","12.4741","0.0003","17.6994","0.0005","93.057","0.001","91.658","0.001","108.024","0.001","1874.25","0.08","190","2","190","2","","","","","","","","5","P -1","-P 1","2","","3-{3,5-Bis[(2-butoxyethoxy)carbonyl]-2,6-dimethyl-1,4-dihydropyridin-4-yl}- 1-[(3,4,5-trimethoxybenzoyl)methyl]pyridinium bromide","","- C37 H51 Br N2 O10 -","- C37 H51 Br N2 O10 -","- C74 H102 Br2 N4 O20 -","2","1","VM2184","Bisenieks, Imants; Mishnev, Anatoly; Bruvere, Imanta; Vigante, Brigita","3-{3,5-Bis[(2-butoxyethoxy)carbonyl]-2,6-dimethyl-1,4-dihydropyridin-4-yl}-1-[(3,4,5-trimethoxybenzoyl)methyl]pyridinium bromide","Acta Crystallographica Section E","2013","69","1","o58","o59","10.1107/S1600536812049896","","","0.71073","MoKα","","0.0855","0.0556","","","0.1138","0.127","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237241","18.117","0.004","12.987","0.003","12.881","0.003","90","","121.46","0.03","90","","2585.2","1.3","223.15","","223.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato- κ^2^<i>O</i>,<i>O</i>')cobalt(II) propane-1,2-diol monosolvate","","- C27 H24 Co N4 O6 S -","- C27 H24 Co N4 O6 S -","- C108 H96 Co4 N16 O24 S4 -","4","0.5","VN2062","Zhong, Kai-Long","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ^2^<i>O</i>,<i>O</i>')cobalt(II) propane-1,2-diol monosolvate","Acta Crystallographica Section E","2013","69","1","m26","","10.1107/S1600536812049616","","","0.71073","MoKα","","0.0668","0.0516","","","0.1221","0.1288","","","","","","0.946","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237242","5.8044","0.0006","10.5062","0.001","18.9887","0.0019","97.307","0.001","94.163","0.001","91.695","0.001","1144.7","0.2","103","2","103","2","","","","","","","","7","P -1","-P 1","2","","<i>catena</i>-Poly[[tris(acetonitrile-κ<i>N</i>)praseodymium(III)]tris(μ- trifluoromethanesulfonato-κ^2^<i>O</i>:<i>O</i>')]","","- C9 H9 F9 N3 O9 Pr S3 -","- C9 H9 F9 N3 O9 Pr S3 -","- C18 H18 F18 N6 O18 Pr2 S6 -","2","1","VN2063","Apostolidis, Christos; Walter, Olaf","<i>catena</i>-Poly[[tris(acetonitrile-κ<i>N</i>)praseodymium(III)]tris(μ-trifluoromethanesulfonato-κ^2^<i>O</i>:<i>O</i>')]","Acta Crystallographica Section E","2013","69","1","m21","","10.1107/S1600536812049525","","","0.71073","MoKα","","0.0441","0.0355","","","0.0739","0.0764","","","","","","1.162","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237243","21.1611","0.0004","22.1298","0.0004","22.602","0.0004","112.345","0.001","101.135","0.001","96.757","0.001","9389.9","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Carbonyl{3,3'-di-<i>tert</i>-butyl-5,5'-dimethoxy-2,2'-bis[(4,4,5,5- tetramethyl-1,3,2-dioxaphospholan-2-yl)oxy]biphenyl- κ^2^<i>P</i>,<i>P</i>'}hydrido(triphenylphosphane-κ<i>P</i>)rhodium(I) diethyl ether trisolvate","","- C105 H114 O12 P3 Rh -","- C95 H89 O9.5 P3 Rh -","- C380 H356 O38 P12 Rh4 -","4","2","WM2697","Selent, Detlef; Spannenberg, Anke; Börner, Armin","Carbonyl{3,3'-di-<i>tert</i>-butyl-5,5'-dimethoxy-2,2'-bis[(4,4,5,5-tetramethyl-1,3,2-dioxaphospholan-2-yl)oxy]biphenyl-κ^2^<i>P</i>,<i>P</i>'}hydrido(triphenylphosphane-κ<i>P</i>)rhodium(I) diethyl ether trisolvate","Acta Crystallographica Section E","2013","69","1","m14","","10.1107/S1600536812049124","","","0.71073","MoKα","","0.0779","0.0532","","","0.141","0.1523","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237244","8.32","0.0003","8.32","0.0003","5.0239","0.0002","90","","90","","90","","347.77","0.02","293","","293","","","","","","","","","4","P 4 b m","P 4 -2ab","100","Strontium fresnoite","Distrontium oxidotitanium disilicate","","- O8 Si2 Sr2 Ti -","- O8 Si2 Sr2 Ti -","- O16 Si4 Sr4 Ti2 -","2","0.25","WM2699","Bell, Anthony M. T.; Henderson, C. Michael B.","Sr‒fresnoite determined from synchrotron X-ray powder diffraction data","Acta Crystallographica Section E","2013","69","1","i1","","10.1107/S1600536812048921","powder diffraction","","0.207549","Synchrotron","","","","","","","","","","5.5739","","","","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2237245","6.2104","0.00015","6.93014","0.00016","26.7851","0.0007","90","","90","","90","","1152.8","0.05","140","2","140","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Potassium (1<i>R</i>,4<i>R</i>,5<i>S</i>,8<i>S</i>)-4,5,8-trihydroxy-3-oxo-2,6-dioxabicyclo[3.3.0]octane-4-sulfonate dihydrate","","- C6 H11 K O11 S -","- C6 H11 K O11 S -","- C24 H44 K4 O44 S4 -","4","1","WM2701","Haines, Alan H.; Hughes, David L.","Potassium (1<i>R</i>,4<i>R</i>,5<i>S</i>,8<i>S</i>)-4,5,8-trihydroxy-3-oxo-2,6-dioxabicyclo[3.3.0]octane-4-sulfonate dihydrate","Acta Crystallographica Section E","2013","69","1","m7","m8","10.1107/S1600536812048672","","","0.71073","Mo-Kα","","0.0178","0.0177","","","0.0475","0.0476","","","","","","1.126","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237246","11.1523","0.0006","11.212","0.0006","13.9255","0.0007","90","","102.827","0.003","90","","1697.79","0.16","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,5-Bis[(pyridin-4-yl)methoxy]benzoic acid","","- C19 H16 N2 O4 -","- C19 H16 N2 O4 -","- C76 H64 N8 O16 -","4","1","WM2702","Lin, Hong; Zhang, Yi-Ping","3,5-Bis[(pyridin-4-yl)methoxy]benzoic acid","Acta Crystallographica Section E","2013","69","1","o77","","10.1107/S1600536812049550","","","0.71073","MoKα","","0.06","0.0459","","","0.1196","0.1315","","","","","","1.042","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237247","19.0497","0.0009","8.0534","0.0005","17.7883","0.0011","90","","92.368","0.006","90","","2726.7","0.3","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(4,4'-sulfanediyldipyridinium) tetrachloridonickelate(II) dichloride","","- C20 H20 Cl6 N4 Ni S2 -","- C20 H20 Cl6 N4 Ni S2 -","- C80 H80 Cl24 N16 Ni4 S8 -","4","0.5","WM2703","Werner, Julia; Jess, Inke; Näther, Christian","Bis(4,4'-sulfanediyldipyridinium) tetrachloridonickelate(II) dichloride","Acta Crystallographica Section E","2013","69","1","m59","","10.1107/S1600536812050623","","","0.71073","MoKα","","0.0611","0.0374","","","0.0754","0.0839","","","","","","0.991","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237248","7.0816","0.0003","6.6863","0.0002","11.7382","0.0005","90","","101.005","0.004","90","","545.58","0.04","200","1","200","1","","","","","","","","6","P 1 21/m 1","-P 2yb","11","caesium 4-amino-3,5,6-trichloropicolinate monohydrate","Poly[(μ~6~-4-amino-3,5,6-trichloropyridine-2-carboxylato)aquacaesium]","","- C6 H4 Cl3 Cs N2 O3 -","- C6 H4 Cl3 Cs N2 O3 -","- C12 H8 Cl6 Cs2 N4 O6 -","2","0.5","WM2705","Smith, Graham","Poly[(μ~6~-4-amino-3,5,6-trichloropyridine-2-carboxylato)aquacaesium]","Acta Crystallographica Section E","2013","69","1","m22","m23","10.1107/S1600536812049562","","","0.71073","MoKα","","0.0216","0.0207","","","0.0521","0.0526","","","","","","0.979","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237249","14.758","0.0005","6.706","0.0002","20.6845","0.0007","90","","96.969","0.002","90","","2031.96","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>cis</i>-Bis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')bis(nitrito- κ<i>N</i>)cobalt(III) (ethylenediamine-κ^2^<i>N</i>,<i>N</i>')tetrakis(nitrito- κ<i>N</i>)cobaltate(III) monohydrate","","- C6 H26 Co2 N12 O13 -","- C6 H26 Co2 N12 O13 -","- C24 H104 Co8 N48 O52 -","4","1","WM2706","Burrow, Robert A.; de Vicenti, Juliano R.","Redetermination of <i>cis</i>-bis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')bis(nitrito-κ<i>N</i>)cobalt(III) (ethylenediamine-κ^2^<i>N</i>,<i>N</i>')tetrakis(nitrito-κ<i>N</i>)cobaltate(III) monohydrate","Acta Crystallographica Section E","2013","69","1","m56","m57","10.1107/S1600536812050325","","","0.71073","MoKα","","0.0527","0.0352","","","0.0786","0.0867","","","","","","1.067","","","","has coordinates,has Fobs","204117","2020-10-21","18:00:00",""
"2237250","10.2022","0.0015","8.7975","0.0013","10.93","0.0016","90","","106.323","0.002","90","","941.5","0.2","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Rubidium ytterbium(III) tetrakis(polyphosphate)","","- O12 P4 Rb Yb -","- O12 P4 Rb Yb -","- O48 P16 Rb4 Yb4 -","4","1","WM2707","Zhu, Jing; Chen, Hui","RbYb(PO~3~)~4~","Acta Crystallographica Section E","2013","69","1","i3","","10.1107/S1600536812050969","","","0.71073","MoKα","","0.065","0.0432","","","0.072","0.0778","","","","","","1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237251","7.7202","0.0003","9.2462","0.0004","18.0294","0.0008","90","","99.935","0.002","90","","1267.68","0.09","299","2","299","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-Methoxy-11<i>H</i>-benzo[<i>b</i>]fluoren-11-one","","- C18 H12 O2 -","- C18 H12 O2 -","- C72 H48 O8 -","4","1","XU5629","Fang, Sin-Kai; Chang, Che-Wei; Tsai, Hsing-Yang; Luo, Ming-Hui; Chen, Kew-Yu","1-Methoxy-11<i>H</i>-benzo[<i>b</i>]fluoren-11-one","Acta Crystallographica Section E","2013","69","1","o79","","10.1107/S1600536812050076","","","0.71073","MoKα","","0.1138","0.0834","","","0.2092","0.2499","","","","","","1.105","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237252","9.8186","0.001","9.8201","0.0009","11.3352","0.0013","81.47","0.008","76.308","0.009","75.042","0.009","1021.46","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-2-Phenyl-<i>N</i>-tosylnon-2-en-4-ynamide","","- C22 H23 N O3 S -","- C22 H23 N O3 S -","- C44 H46 N2 O6 S2 -","2","1","XU5655","Meng, Xiang-Zhen; Wan, Xin-Jun","(<i>E</i>)-2-Phenyl-<i>N</i>-tosylnon-2-en-4-ynamide","Acta Crystallographica Section E","2013","69","1","o78","","10.1107/S1600536812048489","","","0.71073","MoKα","","0.0798","0.0477","","","0.0819","0.0957","","","","","","1","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237253","11.466","0.002","8.2439","0.0016","15.559","0.003","90","","97.82","0.03","90","","1457","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>,2,4,6-Pentamethylanilinium hexafluorophosphate","","- C11 H18 F6 N P -","- C11 H18 F6 N P -","- C44 H72 F24 N4 P4 -","4","1","XU5658","Zhang, Yuan","<i>N</i>,<i>N</i>,2,4,6-Pentamethylanilinium hexafluorophosphate","Acta Crystallographica Section E","2013","69","1","o31","","10.1107/S1600536812049379","","","0.71073","MoKα","","0.1123","0.0632","","","0.158","0.1862","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237254","9.3109","0.0019","11.431","0.002","24.718","0.005","90","","90","","90","","2630.8","0.9","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","Butan-1-aminium tetrachloridoferrate(III)‒18-crown-6 (1/1)","Butan-1-aminium tetrachloridoferrate(III)‒1,4,7,10,13,16- hexaoxacyclooctadecane (1/1)","","- C16 H36 Cl4 Fe N O6 -","- C16 H36 Cl4 Fe N O6 -","- C64 H144 Cl16 Fe4 N4 O24 -","4","0.5","XU5660","Zhang, Yuan","Butan-1-aminium tetrachloridoferrate(III)‒18-crown-6 (1/1)","Acta Crystallographica Section E","2013","69","1","m38","","10.1107/S160053681204994X","","","0.71073","MoKα","","0.15","0.0788","","","0.1965","0.234","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237255","10.9115","0.0004","7.0127","0.0002","12.5984","0.0005","90","","97.819","0.004","90","","955.06","0.06","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,5-Bis(piperidin-1-yl)-9,10-anthraquinone","","- C24 H26 N2 O2 -","- C24 H26 N2 O2 -","- C48 H52 N4 O4 -","2","0.5","XU5662","Niedziałkowski, Paweł; Wnuk, Elżbieta; Wcisło, Anna; Trzybiński, Damian","1,5-Bis(piperidin-1-yl)-9,10-anthraquinone","Acta Crystallographica Section E","2013","69","1","o110","","10.1107/S1600536812050313","","","0.71073","MoKα","","0.0622","0.0412","","","0.0931","0.1015","","","","","","1.043","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237256","11.2439","0.0002","17.3325","0.0004","19.7575","0.0004","90","","105.778","0.002","90","","3705.36","0.14","130","2","130","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-{(<i>E</i>)-[5-(2-Nitrophenyl)furan-2-yl]methylidene}-2,2-diphenylhydrazine","","- C23 H17 N3 O3 -","- C23 H17 N3 O3 -","- C184 H136 N24 O24 -","8","1","XU5663","Flores-Alamo, Marcos; Cabrera-Vivas, Blanca M.; Meléndrez-Luevano, Ruth; Hernández P., Julio M.; Ruiz-Azuara, Lena","1-{(<i>E</i>)-[5-(2-Nitrophenyl)furan-2-yl]methylidene}-2,2-diphenylhydrazine","Acta Crystallographica Section E","2013","69","1","o90","","10.1107/S1600536812050246","","","1.54184","CuKα","","0.0407","0.0367","","","0.0934","0.0969","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237257","24.604","0.003","18.877","0.003","24.816","0.003","90","","94.763","0.003","90","","11486","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Hexakis(μ~3~-2-hydroxynaphthalene-1-carboxaldehyde thiosemicarbazonato-κ^3^<i>N</i>^2^:<i>S</i>:<i>S</i>)hexasilver(I) <i>N</i>,<i>N</i>'-dimethylformamide tetrasolvate","","- C84 H88 Ag6 N22 O10 S6 -","- C84 H88 Ag6 N22 O10 S6 -","- C336 H352 Ag24 N88 O40 S24 -","4","0.5","YK2079","Sun, Qiaozhen; Chai, Liyuan; Liu, Hui; Wang, Junke","Hexakis(μ~3~-2-hydroxynaphthalene-1-carboxaldehyde thiosemicarbazonato-κ^3^<i>N</i>^2^:<i>S</i>:<i>S</i>)hexasilver(I) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","Acta Crystallographica Section E","2013","69","1","m50","m51","10.1107/S1600536812050155","","","0.71073","MoKα","","0.06","0.0459","","","0.1372","0.1446","","","","","","1.078","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237258","13.4559","0.0004","10.3917","0.0002","17.2641","0.0004","90","","111.751","0.001","90","","2242.16","0.1","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Chlorido{[(<i>E</i>)-2-(diphenylphosphanyl)benzylidene](furan-2- ylmethyl)amine-κ<i>P</i>}gold(I)","","- C24 H20 Au Cl N O P -","- C24 H20 Au Cl N O P -","- C96 H80 Au4 Cl4 N4 O4 P4 -","4","1","YK2081","Chiririwa, Haleden; Davis, Wade L.","Chlorido{[(<i>E</i>)-2-(diphenylphosphanyl)benzylidene](furan-2-ylmethyl)amine-κ<i>P</i>}gold(I)","Acta Crystallographica Section E","2013","69","1","m53","","10.1107/S1600536812050404","","","0.71073","MoKα","","0.0644","0.039","","","0.0878","0.0999","","","","","","1.072","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237259","7.3443","0.0015","10.847","0.002","12.475","0.003","106.66","0.03","103.53","0.02","92.79","0.03","918.5","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Methyl 4-(4-chlorophenyl)-8-iodo-2-methyl-6-oxo-1,6-dihydro-4<i>H</i>- pyrimido[2,1-<i>b</i>]quinazoline-3-carboxylate","","- C20 H15 Cl I N3 O3 -","- C20 H15 Cl I N3 O3 -","- C40 H30 Cl2 I2 N6 O6 -","2","1","YK2082","Nayak, Susanta K.; Venugopala, K. N.; Odhav, Bharti","Methyl 4-(4-chlorophenyl)-8-iodo-2-methyl-6-oxo-1,6-dihydro-4<i>H</i>-pyrimido[2,1-<i>b</i>]quinazoline-3-carboxylate","Acta Crystallographica Section E","2013","69","1","o123","o124","10.1107/S1600536812050787","","","0.71073","MoKα","","0.0317","0.0241","","","0.0572","0.0592","","","","","","1.085","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237260","10.7315","0.0017","23.605","0.004","7.6478","0.0012","90","","96.523","0.003","90","","1924.8","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aqua{2-(pyridin-2-yl)-<i>N</i>-[(pyridin-2-yl)methylidene]ethanamine- κ^3^<i>N</i>,<i>N</i>',<i>N</i>''}(sulfato-κ^2^<i>O</i>,<i>O</i>')copper(II) tetrahydrate","","- C13 H23 Cu N3 O9 S -","- C13 H23 Cu N3 O9 S -","- C52 H92 Cu4 N12 O36 S4 -","4","1","ZL2518","Tinguiano, Daniel; Sow, Mouhamadou Moustapha; Tamboura, Farba Bouyagui; Barry, Aliou Hamady; Gaye, Mohamed","Aqua{2-(pyridin-2-yl)-<i>N</i>-[(pyridin-2-yl)methylidene]ethanamine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''}(sulfato-κ^2^<i>O</i>,<i>O</i>')copper(II) tetrahydrate","Acta Crystallographica Section E","2013","69","1","m24","m25","10.1107/S1600536812049380","","","0.71073","MoKα","","0.0587","0.0371","","","0.0884","0.1032","","","","","","1.043","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2237261","13.7751","0.0006","24.5147","0.0011","18.0172","0.0008","90","","111.72","0.001","90","","5652.3","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis[μ-bis(diphenylphosphanyl)methane-κ^2^<i>P</i>:<i>P</i>'](μ-1- ethylthiourea-κ^2^<i>S</i>:<i>S</i>)bis[iodidocopper(I)] acetonitrile sesquisolvate","","- C56 H56.5 Cu2 I2 N3.5 P4 S -","- C56 H56.5 Cu2 I2 N3.5 P4 S -","- C224 H226 Cu8 I8 N14 P16 S4 -","4","1","ZL2525","Nimthong, Ruthairat; Wattanakanjana, Yupa; Pakawatchai, Chaveng","Bis[μ-bis(diphenylphosphanyl)methane-κ^2^<i>P</i>:<i>P</i>'](μ-1-ethylthiourea-κ^2^<i>S</i>:<i>S</i>)bis[iodidocopper(I)] acetonitrile sesquisolvate","Acta Crystallographica Section E","2013","69","1","m68","m69","10.1107/S1600536812050970","","","0.71073","MoKα","","0.0612","0.0458","","","0.0958","0.1006","","","","","","1.054","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237262","21.9467","0.0004","10.43729","0.00018","11.20623","0.00019","90","","90.0458","0.0015","90","","2566.94","0.08","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Diphenylmethyl-1-[(<i>E</i>)-3-phenylprop-2-en-1-yl]piperazin-1-ium (2<i>Z</i>)-3-carboxyprop-2-enoate","","- C30 H32 N2 O4 -","- C30 H32 N2 O4 -","- C120 H128 N8 O16 -","4","1","ZL2527","Kavitha, C. N.; Yildirim, Sema Ōztūrk; Jasinski, Jerry P.; Yathirajan, H. S.; Butcher, Ray J.","Cinnarizinium fumarate","Acta Crystallographica Section E","2013","69","1","o142","o143","10.1107/S1600536812051239","","","1.54184","CuKα","","0.0527","0.043","","","0.1119","0.1211","","","","","","1.024","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237263","18.0123","0.0015","7.0128","0.0006","15.4364","0.0013","90","","90","","90","","1949.9","0.3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","(3<i>E</i>,5<i>E</i>)-3,5-Bis(2-chlorobenzylidene)-1-propylpiperidin-4-one","","- C22 H21 Cl2 N O -","- C22 H21 Cl2 N O -","- C88 H84 Cl8 N4 O4 -","4","1","ZQ2188","Yang, Quanzhi; Chen, Lingzi; Weng, Bixia; Fan, Lei; Wu, Xiaoping","(3<i>E</i>,5<i>E</i>)-3,5-Bis(2-chlorobenzylidene)-1-propylpiperidin-4-one","Acta Crystallographica Section E","2013","69","1","o63","","10.1107/S1600536812049252","","","0.71073","MoKα","","0.0382","0.0346","","","0.0852","0.0882","","","","","","1.038","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237264","3.8583","0.0003","26.2739","0.0013","15.1147","0.001","90","","94.877","0.006","90","","1526.67","0.17","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","11,12-Dichlorodibenzo[<i>a</i>,<i>c</i>]phenazine","","- C20 H10 Cl2 N2 -","- C20 H10 Cl2 N2 -","- C80 H40 Cl8 N8 -","4","0.5","ZS2242","Imeri, Arta; Glagovich, Neil M.; Crundwell, Guy","11,12-Dichlorodibenzo[<i>a</i>,<i>c</i>]phenazine","Acta Crystallographica Section E","2013","69","1","o48","","10.1107/S1600536812049690","","","0.71073","MoKα","","0.0765","0.0388","","","0.0952","0.1035","","","","","","0.828","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237265","8.908","0.0003","10.755","0.0004","11.953","0.0006","63.446","0.001","89.364","0.002","73.408","0.001","972.6","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","aqua(4-cyanopyridine-κ<i>N</i>)(5,10,15,20-tetraphenylporphyrinato κ<i></i>^4^-<i>N</i>)magnesium","Aqua(4-cyanopyridine-κ<i>N</i>^4^)(5,10,15,20-tetraphenylporphyrinato- κ^4^<i>N</i>)magnesium","","- C50 H32 Mg N6 O -","- C50 H32 Mg N6 O -","- C50 H32 Mg N6 O -","1","0.5","ZS2246","Ezzayani, Khaireddine; Belkhiria, Mohamed Salah; Najmudin, Shabir; Bonifácio, Cecilia; Nasri, Habib","Aqua(4-cyanopyridine-κ<i>N</i>^4^)(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)magnesium","Acta Crystallographica Section E","2013","69","1","m17","m18","10.1107/S1600536812049434","","","0.71073","MoKα","","0.0449","0.039","","","0.099","0.1031","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2237266","11.926","0.003","6.5911","0.0014","8.991","0.002","90","","103.574","0.014","90","","687","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","rac-2,3-Dibromopropionamide","<i>rac</i>-2,3-Dibromopropionamide","","- C3 H5 Br2 N O -","- C3 H5 Br2 N O -","- C12 H20 Br8 N4 O4 -","4","1","BG2488","Köppen, Robert; Emmerling, Franziska; Koch, Matthias","<i>rac</i>-2,3-Dibromopropionamide","Acta Crystallographica Section E","2013","69","2","o151","","10.1107/S160053681205132X","","","0.71073","MoKα","","0.1967","0.0657","","","0.153","0.1841","","","","","","0.773","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237267","4.4054","0.0002","11.9881","0.0005","13.701","0.0005","90.057","0.001","91.803","0.001","97.743","0.001","716.62","0.05","200","2","200","2","","","","","","","","6","P -1","-P 1","2","3-Chloro-4-fluoroanilinium picrate","3-Chloro-4-fluoroanilinium 2,4,6-trinitrophenolate","","- C12 H8 Cl F N4 O7 -","- C12 H8 Cl F N4 O7 -","- C24 H16 Cl2 F2 N8 O14 -","2","1","BG2490","Sarojini, Balladka K.; Narayana, Badiadka; Yathirajan, Hemmige S.; Gerber, Thomas; van Brecht, Benjamin; Betz, Richard","3-Chloro-4-fluoroanilinium picrate","Acta Crystallographica Section E","2013","69","2","o240","","10.1107/S1600536813000718","","","0.71073","MoKα","","0.0459","0.0367","","","0.0881","0.0968","","","","","","1.063","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237268","5.2989","0.0017","9.024","0.003","23.268","0.007","90","","90","","90","","1112.6","0.6","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-(β-Carboxyethyl)-α-isoleucine","2-[(2-Carbamoylethyl)amino]-3-methylpentanoic acid","","- C9 H18 N2 O3 -","- C9 H18 N2 O3 -","- C36 H72 N8 O12 -","4","1","BG2493","Nehls, Irene; Hanebeck, Olaf; Becker, Roland; Emmerling, Franziska","<i>N</i>-(β-Carboxyethyl)-α-isoleucine","Acta Crystallographica Section E","2013","69","2","o172","o173","10.1107/S160053681205146X","","","0.71073","MoKα","","0.0582","0.043","","","0.1084","0.1144","","","","","","0.95","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237269","13.0943","0.0003","14.573","0.0003","19.9366","0.0005","90","","90","","90","","3804.37","0.15","298","2","298","2","","","","","","","","6","P 21 c n","P -2n 2a","33","","<i>cis</i>-Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(pyridin-4-amine- κ<i>N</i>^1^)ruthenium(II) bis(hexafluoridophosphate)","","- C34 H28 F12 N8 P2 Ru -","- C34 H28 F12 N8 P2 Ru -","- C136 H112 F48 N32 P8 Ru4 -","4","1","BG2495","Camilo, Mariana R.; Martins, Felipe T.; Malta, Valéria R. S.; Ellena, Javier; Carlos, Rose M.","<i>cis</i>-Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(pyridin-4-amine-κ<i>N</i>^1^)ruthenium(II) bis(hexafluoridophosphate)","Acta Crystallographica Section E","2013","69","2","m75","m76","10.1107/S1600536812051999","","","0.71073","MoKα","","","0.0529","","","","0.1506","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237270","10.829","0.0003","11.889","0.0003","16.102","0.0004","104.073","0.001","99.114","0.002","107.761","0.002","1853.32","0.09","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","<i>cis</i>-Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(pyridin-4-amine- κ<i>N</i>^1^)ruthenium(II) bis(hexafluoridophosphate) acetonitrile monosolvate","","- C32 H31 F12 N9 P2 Ru -","- C32 H31 F12 N9 P2 Ru -","- C64 H62 F24 N18 P4 Ru2 -","2","1","BG2496","Camilo, Mariana R.; Martins, Felipe T.; Malta, Valéria R. S.; Ellena, Javier; Carlos, Rose M.","<i>cis</i>-Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(pyridin-4-amine-κ<i>N</i>^1^)ruthenium(II) bis(hexafluoridophosphate) acetonitrile monosolvate","Acta Crystallographica Section E","2013","69","2","m77","m78","10.1107/S1600536812052002","","","0.71073","MoKα","","","0.0532","","","","0.148","","","","","","1.057","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237271","10.035","0.001","10.922","0.0011","12.25","0.0015","105.956","0.002","100.088","0.003","109.377","0.003","1164.1","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[μ~2~-iodido-diiodidobis(μ~3~-pyridine-2-thione- κ^3^<i>S</i>:<i>S</i>:<i>S</i>)(μ~2~-pyridine-2-thione- κ^2^<i>S</i>:<i>S</i>)tricopper(I)]","","- C15 H15 Cu3 I3 N3 S3 -","- C15 H15 Cu3 I3 N3 S3 -","- C30 H30 Cu6 I6 N6 S6 -","2","1","BH2469","Ke, Fang; Wu, Wen","<i>catena</i>-Poly[μ~2~-iodido-diiodidobis(μ~3~-pyridine-2-thione-κ^3^<i>S</i>:<i>S</i>:<i>S</i>)(μ~2~-pyridine-2-thione-κ^2^<i>S</i>:<i>S</i>)tricopper(I)]","Acta Crystallographica Section E","2013","69","2","m87","","10.1107/S1600536812052051","","","0.71073","MoKα","","0.0516","0.0404","","","0.1075","0.1154","","","","","","1.056","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237272","7.4154","0.0007","12.8896","0.001","19.649","0.002","90","","92.848","0.009","90","","1875.8","0.3","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-(4-nitrobenzyl)pyridinium 5-sulfosalicylate","4-(4-Nitrobenzyl)pyridinium 3-carboxy-4-hydroxybenzenesulfonate","","- C19 H16 N2 O8 S -","- C19 H16 N2 O8 S -","- C76 H64 N8 O32 S4 -","4","1","BH2470","Smith, Graham; Wermuth, Urs D.","4-(4-Nitrobenzyl)pyridinium 3-carboxy-4-hydroxybenzenesulfonate","Acta Crystallographica Section E","2013","69","2","o206","","10.1107/S1600536813000093","","","0.71073","MoKα","","0.1048","0.0705","","","0.1639","0.1726","","","","","","1.206","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237273","8.379","0.005","16.958","0.005","22.063","0.005","90","","96.605","0.005","90","","3114","2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5''-(4-Methoxybenzylidene)-1'-(4-methoxyphenyl)-1''-methyl- 1',2',3',5',6',7',8',8a'-octahydrodispiro[acenaphthylene-1,3'-indolizine- 2',3''-piperidine]-2,4''(1<i>H</i>)-dione","","- C39 H38 N2 O4 -","- C39 H38 N2 O4 -","- C156 H152 N8 O16 -","4","1","BH2471","Suresh, J.; Nagalakshmi, R. A.; Sivakumar, S.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","5''-(4-Methoxybenzylidene)-1'-(4-methoxyphenyl)-1''-methyl-1',2',3',5',6',7',8',8a'-octahydrodispiro[acenaphthylene-1,3'-indolizine-2',3''-piperidine]-2,4''(1<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","2","o256","o257","10.1107/S1600536813001177","","","0.71073","MoKα","","0.0947","0.0655","","","0.1667","0.1827","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237274","8.0265","0.0005","25.7011","0.0015","9.7763","0.0006","90","","90","","90","","2016.8","0.2","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Methyl 4'-(4-fluorophenyl)-1'-methyl-3'-nitromethyl-2-oxospiro[indoline-3,2'-pyrrolidine]-3'-carboxylate","","- C21 H20 F N3 O5 -","- C21 H20 F N3 O5 -","- C84 H80 F4 N12 O20 -","4","1","BH2472","Revathi, B. K.; Sathya, S.; Usha, G.; Murugan, G.; Bakthadoss, M.","Methyl 4'-(4-fluorophenyl)-1'-methyl-3'-nitromethyl-2-oxospiro[indoline-3,2'-pyrrolidine]-3'-carboxylate","Acta Crystallographica Section E","2013","69","2","o278","","10.1107/S1600536813001578","","","0.71073","MoKα","","0.0505","0.0471","","","0.128","0.1321","","","","","","1.128","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237275","7.2262","0.0005","13.5823","0.0009","17.9818","0.0012","90","","97.023","0.004","90","","1751.6","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-Chloro-1-methyl-4-[2-(3-phenylallylidene)hydrazinylidene]-3,4-dihydro-1<i>H</i>-2λ^6^,1-benzothiazine-2,2-dione","","- C18 H16 Cl N3 O2 S -","- C18 H16 Cl N3 O2 S -","- C72 H64 Cl4 N12 O8 S4 -","4","1","BQ2381","Shafiq, Muhammad; Tahir, M. Nawaz; Harrison, William T. A.; Khan, Islam Ullah; Shafique, Sidra","3-Chloro-1-methyl-4-[2-(3-phenylallylidene)hydrazinylidene]-3,4-dihydro-1<i>H</i>-2λ^6^,1-benzothiazine-2,2-dione","Acta Crystallographica Section E","2013","69","2","o165","","10.1107/S1600536812051513","","","0.71073","MoKα","","0.1177","0.0667","","","0.1748","0.2011","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237276","8.5253","0.0004","8.5253","0.0004","10.8039","0.0006","90","","90","","120","","680.03","0.06","296","2","296","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Tricalcium germanium bis(sulfate) hexahydroxide trihydrate","","- Ca3 Ge H12 O17 S2 -","- Ca3 Ge H12 O17 S2 -","- Ca6 Ge2 H24 O34 S4 -","2","0.0833333","BR2217","Origlieri, Marcus J.; Downs, Robert T.","Schaurteite, Ca~3~Ge(SO~4~)~2~(OH)~6~·3H~2~O","Acta Crystallographica Section E","2013","69","2","i6","","10.1107/S1600536812050945","","","0.71073","MoKα","","0.0307","0.0219","","","0.0426","0.045","","","","","","1.146","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2237277","5.7757","0.0012","5.7757","0.0012","10.87","0.002","90","","90","","90","","362.61","0.13","293","2","293","2","","","","","","","Pirquitas, Jujuy Province, Argentina","7","I -4","I -4","82","Pirquitasite","Disilver zinc tin tetrasulfide","Pirquitasite","- Ag1.87 Cd0.03 Cu0.13 Fe0.36 S4 Sn Zn0.61 -","- Ag1.87 Cd0.03 Cu0.13 Fe0.36 S4 Sn Zn0.61 -","- Ag3.74 Cd0.06 Cu0.26 Fe0.72 S8 Sn2 Zn1.22 -","2","0.25","BR2219","Schumer, Benjamin N.; Downs, Robert T.; Domanik, Kenneth J.; Andrade, Marcelo B.; Origlieri, Marcus J.","Pirquitasite, Ag~2~ZnSnS~4~","Acta Crystallographica Section E","2013","69","2","i8","i9","10.1107/S1600536813001013","","","0.71073","MoKα","","0.0276","0.0269","","","0.0692","0.0701","","","","","","1.172","","","","has coordinates,has Fobs","287703","2023-11-21","13:37:05",""
"2237278","7.5732","0.0013","10.3733","0.0016","18.673","0.002","90","","94.308","0.012","90","","1462.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichlorido(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')mercury(II)","","- C14 H12 Cl2 Hg N2 -","- C14 H12 Cl2 Hg N2 -","- C56 H48 Cl8 Hg4 N8 -","4","1","BR2220","Warad, Ismail; Al-Noaimi, Mousa; Haddad, Salim F.; Othman, Rema","Dichlorido(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')mercury(II)","Acta Crystallographica Section E","2013","69","2","m109","","10.1107/S1600536813001086","","","0.71073","MoKα","","0.0753","0.0514","","","0.1079","0.1276","","","","","","0.992","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237279","6.296","0.0004","16.6389","0.0008","19.9475","0.0011","90","","90","","90","","2089.7","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>P</i>,<i>P</i>-Bis[4-(dimethylamino)phenyl]-<i>N</i>,<i>N</i>- bis(propan-2-yl)phosphinic amide","","- C22 H34 N3 O P -","- C22 H34 N3 O P -","- C88 H136 N12 O4 P4 -","4","1","BT6869","Evans, Stephen J.; Renison, C. Alicia; Williams, D. Bradley G.; Muller, Alfred","<i>P</i>,<i>P</i>-Bis[4-(dimethylamino)phenyl]-<i>N</i>,<i>N</i>-bis(propan-2-yl)phosphinic amide","Acta Crystallographica Section E","2013","69","2","o195","","10.1107/S1600536812050398","","","0.71073","MoKα","","0.0832","0.0502","","","","0.1098","","","","","","1.036","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237280","9.4225","0.0012","9.9313","0.0012","11.3641","0.0015","90","","98.482","0.009","90","","1051.8","0.2","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Isopropyl 2,3,4,6-tetra-<i>O</i>-acetyl-β-<i>D</i>-glucopyranoside","","- C17 H26 O10 -","- C17 H26 O10 -","- C34 H52 O20 -","2","1","BT6870","Mönch, Bettina; Emmerling, Franziska; Kraus, Werner; Becker, Roland; Nehls, Irene","Isopropyl 2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2013","69","2","o157","","10.1107/S1600536812051483","","","0.71073","MoKα","","0.0998","0.0582","","","0.1292","0.1505","","","","","","1.074","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237281","7.0072","0.0011","15.215","0.003","19.579","0.003","90","","90","","90","","2087.4","0.6","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","<i>n</i>-Propyl 2,3,4,6-tetra-<i>O</i>-acetyl-β-<i>D</i>-glucopyranoside","(2<i>R</i>,3<i>R</i>,4<i>S</i>,5<i>R</i>,6<i>R</i>)-2-(Acetoxymethyl)-6- propoxytetrahydro-2<i>H</i>-pyran-3,4,5-triyl triacetate","","- C17 H26 O10 -","- C17 H26 O10 -","- C68 H104 O40 -","4","1","BT6871","Mönch, Bettina; Emmerling, Franziska; Kraus, Werner; Becker, Roland; Nehls, Irene","<i>n</i>-Propyl 2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2013","69","2","o158","","10.1107/S1600536812051495","","","0.71073","MoKα","","0.0877","0.0441","","","0.1038","0.1216","","","","","","0.873","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237282","11.229","0.004","7.8561","0.0007","9.668","0.003","90","","94.79","0.017","90","","849.9","0.4","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,11-Dimethyl-6,12-dimethoxyindolo[3,2-<i>b</i>]carbazole","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C44 H40 N4 O4 -","2","0.5","BT6882","Wrobel, Norma; Witulski, Bernhard; Schollmeyer, Dieter; Detert, Heiner","5,11-Dimethyl-6,12-dimethoxyindolo[3,2-<i>b</i>]carbazole","Acta Crystallographica Section E","2013","69","2","o255","","10.1107/S1600536813001463","","","1.54178","CuKα","","0.0563","0.0485","","","0.1443","0.1524","","","","","","1.104","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237283","8.8807","0.0006","11.628","0.0008","9.0596","0.0006","90","","107.665","0.002","90","","891.42","0.1","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(1<i>S</i>,3<i>R</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-2,2,10,10-Tetrachloro-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","","- C17 H24 Cl4 -","- C17 H24 Cl4 -","- C34 H48 Cl8 -","2","1","BT6883","Ourhriss, Najia; Benharref, Ahmed; Saadi, Mohamed; El Ammari, Lahcen; Berraho, Moha","(1<i>S</i>,3<i>R</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-2,2,10,10-Tetrachloro-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","Acta Crystallographica Section E","2013","69","2","o275","","10.1107/S1600536813001700","","","0.71073","MoKα","","0.0374","0.032","","","0.0813","0.0847","","","","","","1.029","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237284","7.4916","0.0002","9.4321","0.0003","28.8093","0.0008","90","","95.8785","0.0015","90","","2025","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Aminoanthrachinone-Tetracyanchinodimethane","1-Aminoanthraquinone‒2-[4-(dicyanomethylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile (1/1)","","- C26 H13 N5 O2 -","- C26 H13 N5 O2 -","- C104 H52 N20 O8 -","4","1","BT6884","de Oliveira, Adriano Bof; Beck, Johannes; Daniels, Jörg; Santos, Jaciara Nascimento; Feitosa, Bárbara Regina Santos","The charge-transfer complex 1-aminoanthraquinone‒7,7',8,8'-tetracyanoquinodimethane (1/1)","Acta Crystallographica Section E","2013","69","2","o301","","10.1107/S1600536813002195","","","0.71073","MoKα","","0.1063","0.0519","","","0.1094","0.1351","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237285","13.899","0.003","8.9184","0.0019","7.5043","0.0016","90","","94.098","0.006","90","","927.8","0.3","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-3-methoxymethyl-5-methylbenzaldehyde","","- C10 H12 O3 -","- C10 H12 O3 -","- C40 H48 O12 -","4","1","BT6886","Gunasekaran, B.; Jayamani, A.; Sengottuvelan, N.; Chakkaravarthi, G.","2-Hydroxy-3-methoxymethyl-5-methylbenzaldehyde","Acta Crystallographica Section E","2013","69","2","o317","","10.1107/S1600536813002845","","","0.71073","MoKα","","0.1203","0.0542","","","0.1331","0.1805","","","","","","1.03","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237286","22.166","0.0004","12.7349","0.0002","23.3951","0.0004","90","","90","","90","","6604.01","0.19","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Methyl-4-(4-methylpiperazin-4-ium-1-yl)-10<i>H</i>- thieno[2,3-<i>b</i>][1,5]benzodiazepinium bis(2,4,6-trinitrophenolate)","","- C29 H26 N10 O14 S -","- C29 H26 N10 O14 S -","- C232 H208 N80 O112 S8 -","8","1","BV2217","Kavitha, C. N.; Jasinski, Jerry P.; Keeley, Amanda C.; Yathirajan, H. S.; Dayananda, A. S.","Olanzapinium dipicrate","Acta Crystallographica Section E","2013","69","2","o232","o233","10.1107/S1600536813000640","","","1.54184","CuKα","","0.0464","0.0383","","","0.1004","0.1066","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237287","15.4029","0.0004","18.7822","0.0004","6.1639","0.0002","90","","90","","90","","1783.22","0.08","120","0.5","120","","","","","","","","","5","P n a 21","P 2c -2n","33","","<i>meso</i>-4,4'-Difluoro-2,2'-{[(3a<i>R</i>,7a<i>S</i>)-2,3,3a,4,5,6,7,7a- octahydro-1<i>H</i>-1,3-benzimidazole-1,3-diyl]bis(methylene)}diphenol","","- C21 H24 F2 N2 O2 -","- C21 H24 F2 N2 O2 -","- C84 H96 F8 N8 O8 -","4","1","BX2435","Rivera, Augusto; Quiroga, Diego; Ríos-Motta, Jaime; Kučeraková, Monika; Dušek, Michal","<i>meso</i>-4,4'-Difluoro-2,2'-{[(3a<i>R</i>,7a<i>S</i>)-2,3,3a,4,5,6,7,7a-octahydro-1<i>H</i>-1,3-benzimidazole-1,3-diyl]bis(methylene)}diphenol","Acta Crystallographica Section E","2013","69","2","o217","","10.1107/S1600536813000305","","","1.5418","CuKα","","0.0328","0.0302","","","0.0753","0.0773","","","","","","1.42","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237288","3.8645","0.0002","26.345","0.002","7.8961","0.0004","90","","92.509","0.001","90","","803.13","0.08","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Nitro-1,3-benzothiazole-2(3<i>H</i>)-thione","","- C7 H4 N2 O2 S2 -","- C7 H4 N2 O2 S2 -","- C28 H16 N8 O8 S8 -","4","1","CV5367","Qiu, Qi-Ming; Cui, Yang-Zhe; Zhao, Yin-Hua; Jin, Qiong-Hua; Zhang, Cun-Lin","6-Nitro-1,3-benzothiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2013","69","2","o171","","10.1107/S1600536812049719","","","0.71073","MoKα","","0.0795","0.0627","","","0.1531","0.1649","","","","","","1.04","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237289","12.561","0.0011","15.9118","0.0013","13.0221","0.0008","90","","103.207","0.003","90","","2533.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,4,6,8-Tetrakis(2-fluorophenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one","","- C31 H24 F4 N2 O -","- C31 H24 F4 N2 O -","- C124 H96 F16 N8 O4 -","4","1","CV5368","Park, Dong Ho; Ramkumar, V.; Parthiban, P.","2,4,6,8-Tetrakis(2-fluorophenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one","Acta Crystallographica Section E","2013","69","2","o179","","10.1107/S1600536812051574","","","0.71073","MoKα","","0.0849","0.0528","","","0.1408","0.1628","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237290","11.521","0.002","19.372","0.004","11.854","0.002","90","","93.61","0.03","90","","2640.4","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichloridodi-μ~2~-hydroxido-di-μ~3~-oxido-octaphenyltetratin(IV) dimethyl sulfoxide disolvate","","- C52 H54 Cl2 O6 S2 Sn4 -","- C52 H54 Cl2 O6 S2 Sn4 -","- C104 H108 Cl4 O12 S4 Sn8 -","2","0.5","CV5369","Foladi, Shahrbano; Khazaei, Parivash; Attar Gharamaleki, Jafar; Notash, Behrouz; Rofouei, Mohammad Kazem","Dichloridodi-μ~2~-hydroxido-di-μ~3~-oxido-octaphenyltetratin(IV) dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2013","69","2","m91","","10.1107/S1600536812051744","","","0.71073","MoKα","","0.0397","0.0304","","","0.0757","0.0789","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237291","9.4408","0.0003","17.9636","0.0005","13.9415","0.0004","90","","99.247","0.004","90","","2333.62","0.12","100","","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(2<i>H</i>-Indazol-2-yl)-1-phenylethanone","","- C15 H12 N2 O -","- C15 H12 N2 O -","- C120 H96 N16 O8 -","8","2","CV5372","Özel Güven, Özden; Türk, Gökhan; Adler, Philip D. F.; Coles, Simon J.; Hökelek, Tuncer","2-(2<i>H</i>-Indazol-2-yl)-1-phenylethanone","Acta Crystallographica Section E","2013","69","2","o184","","10.1107/S1600536812051811","","","0.71073","MoKα","","0.1072","0.0565","","","0.1126","0.1286","","","","","","1.018","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237292","10.0432","0.0004","10.4646","0.0004","13.9932","0.0006","105.422","0.004","105.982","0.004","96.407","0.004","1335.53","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 4-anilino-2,6-bis(4-fluorophenyl)-1-phenyl-1,2,5,6-tetrahydropyridine-3-carboxylate","","- C32 H28 F2 N2 O2 -","- C32 H28 F2 N2 O2 -","- C64 H56 F4 N4 O4 -","2","1","CV5374","Anthal, Sumati; Brahmachari, Goutam; Das, Suvankar; Kant, Rajni; Gupta, Vivek K.","Ethyl 4-anilino-2,6-bis(4-fluorophenyl)-1-phenyl-1,2,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E","2013","69","2","o299","o300","10.1107/S1600536813002158","","","0.71073","MoKα","","0.099","0.0564","","","0.1401","0.1666","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237293","9.885","0.002","12.948","0.003","13.6","0.003","101.761","0.002","102.539","0.002","92.004","0.002","1657.8","0.6","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","3,3',5,5'-Tetra-<i>tert</i>-butyl-2'-hydroxy-[1,1'-biphenyl]-2-yl 4-methylbenzenesulfonate","","- C35 H48 O4 S -","- C35 H48 O4 S -","- C70 H96 O8 S2 -","2","1","CV5377","Jian, Chunli; Zhang, Jinjin; Wang, Lei; Tang, Ning; Wu, Jincai","3,3',5,5'-Tetra-<i>tert</i>-butyl-2'-hydroxy-[1,1'-biphenyl]-2-yl 4-methylbenzenesulfonate","Acta Crystallographica Section E","2013","69","2","o186","","10.1107/S1600536812051938","","","0.71073","MoKα","","0.171","0.0742","","","0.1628","0.2048","","","","","","0.988","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237294","9.6864","0.0005","15.5706","0.0008","9.746","0.0006","90","","109.221","0.007","90","","1387.98","0.14","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1<i>S</i>,3a<i>S</i>,4<i>S</i>,7a<i>S</i>)-Ethyl 1-benzyl-2-(4-methoxybenzyl)-6,7-dimethyl-3-oxo-2,3,3a,4,5,7a-hexahydro-1<i>H</i>-isoindole-4-carboxylate dichloromethane monosolvate","","- C29 H35 Cl2 N O4 -","- C29 H35 Cl2 N O4 -","- C58 H70 Cl4 N2 O8 -","2","1","CV5380","Lin, Benguo; Wu, Jin-Long","(1<i>S</i>,3a<i>S</i>,4<i>S</i>,7a<i>S</i>)-Ethyl 1-benzyl-2-(4-methoxybenzyl)-6,7-dimethyl-3-oxo-2,3,3a,4,5,7a-hexahydro-1<i>H</i>-isoindole-4-carboxylate dichloromethane monosolvate","Acta Crystallographica Section E","2013","69","2","o316","","10.1107/S1600536813002560","","","0.71073","MoKα","","0.0659","0.0476","","","0.1088","0.127","","","","","","1.066","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237295","8.1594","0.0015","12.728","0.002","8.7663","0.0016","90","","99.395","0.003","90","","898.2","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,4-diaminopyrimidine acetone monosolvate","Pyrimidine-2,4-diamine acetone monosolvate","","- C7 H12 N4 O -","- C7 H12 N4 O -","- C28 H48 N16 O4 -","4","1","CV5381","Draguta, Sergiu; Sandhu, Bhupinder; Khrustalev, Victor N.; Fonari, Marina S.; Timofeeva, Tatiana V.","Pyrimidine-2,4-diamine acetone monosolvate","Acta Crystallographica Section E","2013","69","2","o251","","10.1107/S1600536813001025","","","0.71073","MoKα","","0.0602","0.0478","","","0.1325","0.139","","","","","","1.066","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237296","12.107","0.004","16.945","0.005","27.37","0.009","90","","90","","90","","5615","3","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(4<i>R</i>*,4a<i>R</i>*,7a<i>S</i>*)-5-Oxo-6-phenyl-4a,5,6,7,7a,8-hexahydro-4<i>H</i>-furo[2,3-<i>f</i>]isoindole-4-carboxylic acid","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C272 H240 N16 O64 -","16","2","CV5382","Horak, Yuriy I.; Lytvyn, Roman Z.; Zubkov, Fedor I.; Nikitina, Eugeniya V.; Homza, Yuriy V.; Lis, Tadeusz; Kinzhybalo, Vasyl; Obushak, Mykola D.","(4<i>R</i>*,4a<i>R</i>*,7a<i>S</i>*)-5-Oxo-6-phenyl-4a,5,6,7,7a,8-hexahydro-4<i>H</i>-furo[2,3-<i>f</i>]isoindole-4-carboxylic acid","Acta Crystallographica Section E","2013","69","2","o273","o274","10.1107/S160053681300144X","","","0.71073","MoKα","","0.0658","0.044","","","0.1192","0.1272","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237297","13.5019","0.0011","12.5743","0.001","17.7314","0.001","90","","125.575","0.004","90","","2448.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaqua(5-carboxybenzene-1,3-dicarboxylato-κ<i>O</i>^1^)[8-ethyl-5-oxo-2-(piperazin-4-ium-1-yl)-5,8-dihydropyrido[2,3-<i>d</i>]pyrimidine-6-carboxylato-κ^2^<i>O</i>^5^,<i>O</i>^6^]zinc monohydrate","","- C23 H27 N5 O12 Zn -","- C23 H27 N5 O12 Zn -","- C92 H108 N20 O48 Zn4 -","4","1","CV5383","Ye, Zhong-Li; Xin, Guang-Hua; Zhang, Fu-Tian; Xiao, Dong-Rong","Diaqua(5-carboxybenzene-1,3-dicarboxylato-κ<i>O</i>^1^)[8-ethyl-5-oxo-2-(piperazin-4-ium-1-yl)-5,8-dihydropyrido[2,3-<i>d</i>]pyrimidine-6-carboxylato-κ^2^<i>O</i>^5^,<i>O</i>^6^]zinc monohydrate","Acta Crystallographica Section E","2013","69","2","m127","","10.1107/S1600536813002122","","","0.71073","MoKα","","0.031","0.0276","","","0.1012","0.1048","","","","","","0.862","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237298","7.9206","0.0002","9.46","0.0003","20.0915","0.0006","90","","94.505","0.003","90","","1500.78","0.08","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Methyl 2-bromo-3-(4-chlorobenzenesulfonamido)benzoate","","- C14 H11 Br Cl N O4 S -","- C14 H11 Br Cl N O4 S -","- C56 H44 Br4 Cl4 N4 O16 S4 -","4","1","DS2221","Ghafoor, Ahmad Z.; Chang, Brian; King, Christopher L.; Butcher, Ray J.; Kulkarni, Amol A.","Methyl 2-bromo-3-(4-chlorobenzenesulfonamido)benzoate","Acta Crystallographica Section E","2013","69","2","o311","","10.1107/S1600536812048581","","","1.54184","CuKα","","0.0359","0.0341","","","0.0913","0.0928","","","","","","1.081","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237299","8.6243","0.0009","7.3203","0.0006","10.1704","0.0009","90","","91.719","0.008","90","","641.79","0.1","293","2","293","2","","","","","","","","3","P 1 c 1","P -2yc","7","","(6<i>R</i>*,10<i>R</i>*)-Dimethyl 1,4-dioxaspiro[4.5]decane-6,10-dicarboxylate","","- C12 H18 O6 -","- C12 H18 O6 -","- C24 H36 O12 -","2","1","DS2225","Jahangiri, Amita; Wendt, Ola F.; Strand, Daniel","(6<i>R</i>*,10<i>R</i>*)-Dimethyl 1,4-dioxaspiro[4.5]decane-6,10-dicarboxylate","Acta Crystallographica Section E","2013","69","2","o265","","10.1107/S160053681300161X","","","0.71073","MoKα","","0.056","0.0471","","","0.136","0.1482","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237300","12.827","0.004","7.4997","0.0018","15.486","0.004","90","","113.906","0.004","90","","1361.9","0.6","93","","93","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(2,4-Dinitrophenyl)-2,4-dinitroaniline","","- C12 H7 N5 O8 -","- C12 H7 N5 O8 -","- C48 H28 N20 O32 -","4","1","FF2093","Tokutome, Yui; Okuno, Tsunehisa","A second monoclinic polymorph of <i>N</i>-(2,4-dinitrophenyl)-2,4-dinitroaniline","Acta Crystallographica Section E","2013","69","2","o152","","10.1107/S1600536812051288","","","0.71075","MoKα","","","0.0379","","","","0.1053","","","","","","1.06","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237301","11.6168","0.0004","12.7385","0.0005","21.2429","0.0008","90","","90","","90","","3143.5","0.2","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(1<i>SR</i>,3<i>RS</i>,3a<i>SR</i>,6a<i>RS</i>)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoromethyl)phenyl]octahydropyrrolo[3,4- <i>c</i>]pyrrole-1-carboxylate","","- C16 H15 F3 N2 O4 -","- C16 H15 F3 N2 O4 -","- C128 H120 F24 N16 O32 -","8","1","FF2094","Kudryavtsev, Konstantin V.; Ivantcova, Polina M.; Churakov, Andrei V.","(1<i>SR</i>,3<i>RS</i>,3a<i>SR</i>,6a<i>RS</i>)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoromethyl)phenyl]octahydropyrrolo[3,4-<i>c</i>]pyrrole-1-carboxylate","Acta Crystallographica Section E","2013","69","2","o161","o162","10.1107/S1600536812051471","","","0.71073","MoKα","","0.0522","0.0412","","","0.1074","0.1153","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237302","8.4152","0.0007","19.2403","0.0015","8.4105","0.0007","90","","114.21","0.001","90","","1241.98","0.18","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(1<i>H</i>-Imidazol-1-yl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole","","- C13 H8 F3 N3 S -","- C13 H8 F3 N3 S -","- C52 H32 F12 N12 S4 -","4","1","FF2095","Kudryavtsev, Konstantin V.; Churakov, Andrei V.; Guh, Jih-Hwa","2-(1<i>H</i>-Imidazol-1-yl)-4-[3-(trifluoromethyl)phenyl]-1,3-thiazole","Acta Crystallographica Section E","2013","69","2","o238","","10.1107/S1600536813000615","","","0.71073","MoKα","","0.0534","0.0408","","","0.0958","0.1027","","","","","","1.066","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237303","7.3731","0.0005","8.9408","0.0019","16.9936","0.0008","90","","91.892","0.004","90","","1119.6","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Benzyl-4-ethyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","","- C11 H13 N3 S -","- C11 H13 N3 S -","- C44 H52 N12 S4 -","4","1","FY2077","Karczmarzyk, Zbigniew; Pitucha, Monika; Wysocki, Waldemar; Pachuta-Stec, Anna; Stańczuk, Andrzej","3-Benzyl-4-ethyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2013","69","2","o155","o156","10.1107/S1600536812051276","","","0.71073","MoKα","","0.1854","0.0474","","","0.1109","0.1559","","","","","","0.981","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237304","6.1787","0.0002","8.2696","0.0002","12.3665","0.0004","90","","101.632","0.002","90","","618.89","0.03","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-Hydroxy-1-methyl-3-phenylquinolin-2(1<i>H</i>)-one","","- C16 H13 N O2 -","- C16 H13 N O2 -","- C32 H26 N2 O4 -","2","1","FY2079","Kafka, Stanislav; Pevec, Andrej; Proisl, Karel; Kimmel, Roman; Košmrlj, Janez","4-Hydroxy-1-methyl-3-phenylquinolin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2013","69","2","o231","","10.1107/S1600536813000226","","","0.71073","MoKα","","0.0503","0.0393","","","0.0942","0.1023","","","","","","1.018","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237305","6.2134","0.0009","8.2415","0.0009","9.628","0.0011","77.54","0.01","83.364","0.011","73.081","0.012","459.84","0.1","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","2-(Acetoxymethyl)benzoic acid","","- C10 H10 O4 -","- C10 H10 O4 -","- C20 H20 O8 -","2","1","FY2082","Gainsford, Graeme J.; Schwörer, Ralf","2-(Acetoxymethyl)benzoic acid","Acta Crystallographica Section E","2013","69","2","o259","","10.1107/S1600536813000780","","","1.54184","CuKα","","0.0336","0.0325","","","0.0918","0.0933","","","","","","1.078","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237306","8.4276","0.0002","13.0126","0.0003","14.2522","0.0004","79.968","0.002","79.794","0.002","83.505","0.002","1509.25","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-Methyl-1-tosyl-1<i>H</i>-indole-2-carbaldehyde","","- C17 H15 N O3 S -","- C17 H15 N O3 S -","- C68 H60 N4 O12 S4 -","4","2","FY2083","Pradeep, Priyamvada; Khorasani, Sanaz; de Koning, Charles B.; Fernandes, Manuel A.","3-Methyl-1-tosyl-1<i>H</i>-indole-2-carbaldehyde","Acta Crystallographica Section E","2013","69","2","o219","","10.1107/S160053681205180X","","","0.71073","MoKα","","0.0969","0.049","","","0.1087","0.126","","","","","","1.006","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237307","16.3922","0.001","5.7201","0.0002","17.7632","0.001","90","","106.284","0.005","90","","1598.75","0.15","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-{(<i>Z</i>)-[2-Methoxy-5-(trifluoromethyl)anilino]methylidene}naphthalen- 2(1<i>H</i>)-one","","- C19 H14 F3 N O2 -","- C19 H14 F3 N O2 -","- C76 H56 F12 N4 O8 -","4","1","FY2084","Kargılı, Hakan; Alaman Ağar, Ayşen; Alpaslan, Gökhan; Büyükgüngör, Orhan; Erdönmez, Ahmet","1-{(<i>Z</i>)-[2-Methoxy-5-(trifluoromethyl)anilino]methylidene}naphthalen-2(1<i>H</i>)-one","Acta Crystallographica Section E","2013","69","2","o163","","10.1107/S1600536812051410","","","0.71073","MoKα","","0.1122","0.048","","","0.0812","0.0969","","","","","","0.948","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237308","6.738","0.0002","13.431","0.0004","10.4563","0.0003","90","","103.094","0.003","90","","921.67","0.05","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-3-Amino-4-(2-phenylhydrazinylidene)-1<i>H</i>- pyrazol-5(4<i>H</i>)-one","","- C9 H9 N5 O -","- C9 H9 N5 O -","- C36 H36 N20 O4 -","4","1","GG2105","Elgemeie, Galal H.; Sayed, Shahinaz H.; Jones, Peter G.","(<i>E</i>)-3-Amino-4-(2-phenylhydrazinylidene)-1<i>H</i>-pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2013","69","2","o187","","10.1107/S1600536812050854","","","1.54184","CuKα","","0.0338","0.0323","","","0.0858","0.0873","","","","","","1.052","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237309","14.2945","0.0004","8.0115","0.0003","19.0962","0.0005","90","","90","","90","","2186.9","0.12","200","1","200","1","","","","","","","","5","P n a 21","P 2c -2n","33","sulfamethazine 2-nitrobenzoic acid (1:1)","4-Amino-<i>N</i>-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide‒ 2-nitrobenzoic acid (1/1)","","- C19 H19 N5 O6 S -","- C19 H19 N5 O6 S -","- C76 H76 N20 O24 S4 -","4","1","GG2106","Smith, Graham; Wermuth, Urs D.","4-Amino-<i>N</i>-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide‒2-nitrobenzoic acid (1/1)","Acta Crystallographica Section E","2013","69","2","o234","","10.1107/S1600536813000779","","","0.71073","MoKα","","0.0439","0.04","","","0.0973","0.0994","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237310","16.261","0.01","7.71","0.004","17.483","0.01","90","","106.131","0.012","90","","2106","2","93","","93","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,2-Dimethyl-2,3-dihydro-1<i>H</i>-perimidine","","- C13 H14 N2 -","- C13 H14 N2 -","- C104 H112 N16 -","8","2","GG2107","Maloney, Sarah; Slawin, Alexandra M. Z.; Woollins, J. Derek","2,2-Dimethyl-2,3-dihydro-1<i>H</i>-perimidine","Acta Crystallographica Section E","2013","69","2","o246","","10.1107/S1600536813000986","","","0.71075","MoKα","","","0.0557","","","","0.1332","","","","","","0.961","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237311","10.0275","0.0005","11.1058","0.0006","13.2938","0.0008","107.797","0.005","103.896","0.005","90.435","0.004","1363.08","0.14","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Desoxyhemigossypol 6-methyl ether","6-Methoxy-10-methyl-7-(propan-2-yl)-2-oxatricyclo[6.3.1.0^4,12^]dodeca-1(11),4,6,8(12),9-pentaen-5-ol","","- C16 H18 O3 -","- C16 H18 O3 -","- C64 H72 O12 -","4","2","GK2530","Uzbekov, Vyacheslav V.; Talipov, Samat A.; Ibragimov, Bakhtiyar T.; Stipanovic, Robert D.; Liu, Jinggao","Desoxyhemigossypol 6-methyl ether","Acta Crystallographica Section E","2013","69","2","o302","","10.1107/S1600536813002304","","","1.54184","CuKα","","0.0729","0.0499","","","0.143","0.1579","","","","","","1.04","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237312","10.7824","0.0002","10.627","0.0002","11.2364","0.0002","90","","91.678","0.001","90","","1286.97","0.04","200","2","200","2","","","","","","","","5","P 1 c 1","P -2yc","7","Flunarizinium succinate","4-[Bis(4-fluorophenyl)methyl]-1-[(2<i>E</i>)-3-phenylprop-2-en-1- yl]piperazin-1-ium 3-carboxypropanoate","","- C30 H32 F2 N2 O4 -","- C30 H32 F2 N2 O4 -","- C60 H64 F4 N4 O8 -","2","1","GK2534","Kavitha, Channappa N.; Yathirajan, Hemmige S.; Narayana, Badiadka; Gerber, Thomas; van Brecht, Benjamin; Betz, Richard","4-[Bis(4-fluorophenyl)methyl]-1-[(2<i>E</i>)-3-phenylprop-2-en-1-yl]piperazin-1-ium 3-carboxypropanoate","Acta Crystallographica Section E","2013","69","2","o260","o261","10.1107/S1600536813000706","","","0.71073","MoKα","","0.0297","0.0288","","","0.0794","0.0805","","","","","","1.03","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237313","11.537","0.002","7.0093","0.0014","11.632","0.002","90","","106.57","0.03","90","","901.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","<i>N</i>-(7-Dibromomethyl-5-methyl-1,8-naphthyridin-2-yl)acetamide‒ pyrrolidine-2,5-dione (1/1)","","- C16 H16 Br2 N4 O3 -","- C16 H16 Br2 N4 O3 -","- C32 H32 Br4 N8 O6 -","2","0.5","GK2541","Gou, Gao-Zhang; Kou, Jun-Feng; Zhou, Qing-Di; Chi, Shao-Ming","<i>N</i>-(7-Dibromomethyl-5-methyl-1,8-naphthyridin-2-yl)acetamide‒pyrrolidine-2,5-dione (1/1)","Acta Crystallographica Section E","2013","69","2","o153","o154","10.1107/S1600536812051112","","","0.71073","MoKα","","0.0763","0.0507","","","0.1307","0.1642","","","","","","1.119","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237314","9.548","0.0005","9.548","0.0005","21.957","0.0009","90","","90","","90","","2001.69","0.17","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","5-amino-3-picolinamido-1H-1,2,4-triazole","<i>N</i>-(5-Amino-1<i>H</i>-1,2,4-triazol-3-yl)pyridine-2-carboxamide","","- C8 H8 N6 O -","- C8 H8 N6 O -","- C64 H64 N48 O8 -","8","1","GK2547","Hernández-Gil, Javier; Ferrer, Sacramento; Ballesteros, Rafael; Castiñeiras, Alfonso","<i>N</i>-(5-Amino-1<i>H</i>-1,2,4-triazol-3-yl)pyridine-2-carboxamide","Acta Crystallographica Section E","2013","69","2","o227","o228","10.1107/S1600536813000123","","","0.71073","MoKα","","0.0715","0.0384","","","0.0896","0.1068","","","","","","1.067","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237315","9.5044","0.0003","9.8389","0.0003","12.1473","0.0004","72.036","0.001","77.024","0.001","62.384","0.001","952.95","0.05","296","2","296","2","","","","","","","","6","P -1","-P 1","2","1-Tosyl-4-[2-(trifluoromethyl)benzyl]piperazine","1-(4-Methylphenylsulfonyl)-4-[2-(trifluoromethyl)benzyl]piperazine","","- C19 H21 F3 N2 O2 S -","- C19 H21 F3 N2 O2 S -","- C38 H42 F6 N4 O4 S2 -","2","1","GK2548","Sreenivasa, S.; Anitha, H. C.; ManojKumar, K. E.; Tonannavar, J.; Jayashree, Yenagi; Suchetan, P. A.; Palakshamurthy, B. S.","1-Tosyl-4-[2-(trifluoromethyl)benzyl]piperazine","Acta Crystallographica Section E","2013","69","2","o239","","10.1107/S1600536813000317","","","0.71073","MoKα","","0.0467","0.0419","","","0.1154","0.1187","","","","","","1.077","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237316","12.7911","0.0005","8.1862","0.0003","13.7325","0.0005","90","","98.85","0.004","90","","1420.82","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Benzoyl-4-(4-fluorophenyl)-3,4-dihydropyrimidin-2(1<i>H</i>)-one","","- C17 H13 F N2 O2 -","- C17 H13 F N2 O2 -","- C68 H52 F4 N8 O8 -","4","1","GK2549","Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Patil, D. R.; Deshmukh, Madhukar B.","5-Benzoyl-4-(4-fluorophenyl)-3,4-dihydropyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2013","69","2","o196","","10.1107/S1600536812052105","","","0.71073","MoKα","","0.0806","0.0483","","","0.1144","0.1306","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237317","7.0026","0.0005","7.9939","0.0006","14.8033","0.0011","75.433","0.004","86.642","0.004","78.355","0.004","785.49","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(6-Methoxy-2-oxo-2<i>H</i>-chromen-4-yl)methyl morpholine-4-carbodithioate","","- C16 H17 N O4 S2 -","- C16 H17 N O4 S2 -","- C32 H34 N2 O8 S4 -","2","1","GW2129","Devarajegowda, H. C.; Kumar, K. Mahesh; Seenivasa, S.; Arunkashi, H. K.; Kotresh, O.","(6-Methoxy-2-oxo-2<i>H</i>-chromen-4-yl)methyl morpholine-4-carbodithioate","Acta Crystallographica Section E","2013","69","2","o192","","10.1107/S1600536812051847","","","0.71073","MoKα","","0.03","0.027","","","0.0714","0.0733","","","","","","1.064","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237318","41.253","0.008","15.057","0.003","20.809","0.004","90","","106.106","0.002","90","","12418","4","105","2","105","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(Acetonitrile){2-[bis(pyridin-2-ylmethyl-κ^2^<i>N</i>)amino-κ<i>N</i>]- <i>N</i>-(2,6-dimethylphenyl)acetamide-κ<i>O</i>}(perchlorato-κ<i>O</i>)zinc (acetonitrile){2-[bis(pyridin-2-ylmethyl-κ^2^<i>N</i>)amino-κ<i>N</i>]- <i>N</i>-(2,6-dimethylphenyl)acetamide-κ<i>O</i>}zinc tris(perchlorate)","","- C48 H54 Cl4 N10 O18 Zn2 -","- C48 H54 Cl4 N10 O18 Zn2 -","- C384 H432 Cl32 N80 O144 Zn16 -","8","1","HB6972","Åstrand, Ove Alexander Høgmoen; Görbitz, Carl Henrik; Kristoffersen, Kenneth Aase; Rongved, Pål","(Acetonitrile){2-[bis(pyridin-2-ylmethyl-κ^2^<i>N</i>)amino-κ<i>N</i>]-<i>N</i>-(2,6-dimethylphenyl)acetamide-κ<i>O</i>}(perchlorato-κ<i>O</i>)zinc (acetonitrile){2-[bis(pyridin-2-ylmethyl-κ^2^<i>N</i>)amino-κ<i>N</i>]-<i>N</i>-(2,6-dimethylphenyl)acetamide-κ<i>O</i>}zinc tris(perchlorate)","Acta Crystallographica Section E","2013","69","2","m112","m113","10.1107/S1600536813001396","","","0.71073","MoKα","","0.0601","0.0448","","","0.1166","0.1241","","","","","","1.065","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237319","9.184","0.003","6.737","0.004","17.066","0.002","97.61","0.02","91.39","0.04","85.72","0.03","1043.6","0.7","296","","296","","","","","","","","","5","P -1","-P 1","2","","Bis(4-methoxybenzylammonium) dihydrogen diphosphate","","- C16 H26 N2 O9 P2 -","- C16 H26 N2 O9 P2 -","- C32 H52 N4 O18 P4 -","2","1","HB7003","Elboulali, Adel; Akriche, Samah; Al-Deyab, Salem S.; Rzaigui, Mohamed","Bis(4-methoxybenzylammonium) dihydrogen diphosphate","Acta Crystallographica Section E","2013","69","2","o213","o214","10.1107/S1600536812051616","","","0.56087","AgKα","","0.1322","0.0547","","","0.12","0.1425","","","","","","0.975","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237320","13.2569","0.0002","10.5045","0.0002","12.2039","0.0002","90","","116.012","0.0009","90","","1527.32","0.05","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>endo</i>,<i>endo</i>-Tetracyclo[6.2.1.1^3,6^.0^2,7^]dodeca- 9-en-<i>anti</i>-11-yl 4-bromobenzoate","","- C19 H19 Br O2 -","- C19 H19 Br O2 -","- C76 H76 Br4 O8 -","4","1","HB7005","Lloyd, Barry A.; Arif, Atta M.; Coots, Robert J.","<i>endo</i>,<i>endo</i>-Tetracyclo[6.2.1.1^3,6^.0^2,7^]dodeca-9-en-<i>anti</i>-11-yl 4-bromobenzoate","Acta Crystallographica Section E","2013","69","2","o202","o203","10.1107/S1600536812051902","","","0.71073","MoKα","","0.0452","0.0276","","","0.0577","0.0632","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237321","8.9577","0.0004","12.015","0.0005","4.9079","0.0002","90","","100.505","0.002","90","","519.37","0.04","293","2","293","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","penikisite","Barium dimagnesium dialuminium triphosphate trihydroxide","","- Al2 Ba H3 Mg1.97 Mn0.03 O15 P3 -","- Al2 Ba H3 Mg1.97 Mn0.03 O15 P3 -","- Al4 Ba2 H6 Mg3.94 Mn0.06 O30 P6 -","2","0.5","HB7009","Bowman, Michael G.; Downs, Robert T.; Yang, Hexiong","Penikisite, BaMg~2~Al~2~(PO~4~)~3~(OH)~3~, isostructural with bjarebyite","Acta Crystallographica Section E","2013","69","2","i4","i5","10.1107/S1600536812051793","","","0.71073","MoKα","","0.0155","0.015","","","0.0387","0.0389","","","","","","1.137","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237322","9.7732","0.0014","12.2671","0.0016","15.257","0.002","90","","106.836","0.005","90","","1750.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[5-(2-Fluorophenyl)-3-isobutyl-1<i>H</i>-pyrazol-1-yl]benzoic acid","","- C20 H19 F N2 O2 -","- C20 H19 F N2 O2 -","- C80 H76 F4 N8 O8 -","4","1","HB7011","Sreenivasa, S.; Manojkumar, K. E.; Suchetan, P. A.; Mohan, N. R.; Kumar, Vijith; Palakshamurthy, B. S.","2-[5-(2-Fluorophenyl)-3-isobutyl-1<i>H</i>-pyrazol-1-yl]benzoic acid","Acta Crystallographica Section E","2013","69","2","o176","","10.1107/S1600536812050702","","","0.71073","MoKα","","0.0521","0.0405","","","0.1079","0.1143","","","","","","0.981","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237323","9.3195","0.0019","13.899","0.003","21.962","0.004","90","","94.92","0.03","90","","2834.3","1","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Tetrabromo[4-(triphenylphosphanyloxy)butyl]tellurium acetonitrile monosolvate","","- C24 H26 Br4 N O P Te -","- C24 H26 Br4 N O P Te -","- C96 H104 Br16 N4 O4 P4 Te4 -","4","1","HB7012","Närhi, Sari M.; Oilunkaniemi, Raija; Laitinen, Risto S.","Tetrabromido[4-(triphenylphosphanyloxy)butyl]tellurium acetonitrile monosolvate","Acta Crystallographica Section E","2013","69","2","m88","","10.1107/S1600536812051707","","","0.71073","MoKα","","0.066","0.048","","","0.1162","0.1345","","","","","","1.067","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237324","13.4466","0.0002","10.6921","0.0002","27.2057","0.0005","90","","90","","90","","3911.43","0.12","90","0.2","90","0.2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-Benzyl-3-hydroxy-3-(2-imino-3-methyl-5-oxoimidazolidin-4-yl)- 2,3-dihydro-1<i>H</i>-indol-2-one","","- C19 H18 N4 O3 -","- C19 H18 N4 O3 -","- C152 H144 N32 O24 -","8","1","HB7013","Penthala, Narsimha Reddy; Crooks, Peter A.","<i>rac</i>-<i>N</i>-Benzylisatincreatinine (unknown solvate)","Acta Crystallographica Section E","2013","69","2","o290","o291","10.1107/S1600536813000378","","","1.54178","CuKα","","0.04","0.0378","","","0.1023","0.1039","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237325","9.3097","0.0003","24.8252","0.0007","9.6761","0.0003","90","","112.322","0.001","90","","2068.71","0.11","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-{5-Ethoxycarbonyl-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1<i>H</i>- benzimidazol-2-yl}benzoic acid","","- C24 H25 N3 O5 -","- C24 H25 N3 O5 -","- C96 H100 N12 O20 -","4","1","HB7017","Yoon, Yeong Keng; Ali, Mohamed Ashraf; Tan, Soo Choon; Rosli, Mohd Mustaqim; Razak, Ibrahim Abdul","3-{5-Ethoxycarbonyl-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1<i>H</i>-benzimidazol-2-yl}benzoic acid","Acta Crystallographica Section E","2013","69","2","o304","","10.1107/S1600536813001116","","","0.71073","MoKα","","0.119","0.0643","","","0.1138","0.1337","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237326","7.3108","0.0004","11.1545","0.0006","15.9752","0.001","90","","100.921","0.004","90","","1279.16","0.13","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 5-bromonaphtho[2,1-<i>b</i>]furan-2-carboxylate","","- C15 H11 Br O3 -","- C15 H11 Br O3 -","- C60 H44 Br4 O12 -","4","1","HB7019","Shet Prakash, M.; Suchetan, P. A.; Mahadevan, K. M.; Vaidya, V. P.; Velumurgan, D.; Palakshamurthy, B. S.","Ethyl 5-bromonaphtho[2,1-<i>b</i>]furan-2-carboxylate","Acta Crystallographica Section E","2013","69","2","o198","","10.1107/S160053681205204X","","","0.71073","MoKα","","0.0639","0.0452","","","0.1217","0.1272","","","","","","1.084","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237327","8.0694","0.0002","15.2168","0.0004","14.0996","0.0003","90","","92.505","0.002","90","","1729.64","0.07","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(Naphthalene-2-sulfonamido)-3-phenylpropanoic acid","","- C19 H17 N O4 S -","- C19 H17 N O4 S -","- C76 H68 N4 O16 S4 -","4","1","HB7020","Mubashar-ur-Rehman, Hafiz; Arshad, Muhammad Nadeem; Asiri, Abdullah M.; Khan, Islam Ullah; Bilal, Muhammad","2-(Naphthalene-2-sulfonamido)-3-phenylpropanoic acid","Acta Crystallographica Section E","2013","69","2","o194","","10.1107/S1600536813000081","","","1.54184","CuKα","","0.0529","0.0414","","","0.1076","0.1183","","","","","","1.031","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237328","30.412","0.006","6.9325","0.0015","14.936","0.003","90","","111.737","0.008","90","","2925.1","1.1","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 2,4-dihydroxy-5-(4-nitrobenzamido)benzoate","","- C15 H12 N2 O7 -","- C15 H12 N2 O7 -","- C120 H96 N16 O56 -","8","1","HB7022","Naz, Syeda Sohaila; Islam, Nazar Ul; Tahir, M. Nawaz; Shah, Muhammad Raza","Methyl 2,4-dihydroxy-5-(4-nitrobenzamido)benzoate","Acta Crystallographica Section E","2013","69","2","o207","","10.1107/S160053681300024X","","","0.71073","MoKα","","0.123","0.0517","","","0.1052","0.1338","","","","","","0.976","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237329","22.732","0.004","8.2338","0.0016","14.743","0.003","90","","113.506","0.009","90","","2530.5","0.9","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 2,4-dihydroxy-5-(2-methylpropanamido)benzoate","","- C12 H15 N O5 -","- C12 H15 N O5 -","- C96 H120 N8 O40 -","8","1","HB7024","Naz, Syeda Sohaila; Islam, Nazar Ul; Tahir, M. Nawaz; Shah, Muhammad Raza","Methyl 2,4-dihydroxy-5-(2-methylpropanamido)benzoate","Acta Crystallographica Section E","2013","69","2","o221","","10.1107/S1600536813000457","","","0.71073","MoKα","","0.1754","0.0649","","","0.1249","0.1677","","","","","","0.963","","","","has coordinates,has disorder,has Fobs","201979","2020-10-21","18:00:00",""
"2237330","9.652","0.003","10.252","0.004","11.121","0.004","87.214","0.01","86.358","0.01","84.348","0.011","1091.9","0.7","300","2","300","2","","","","","","","","4","P -1","-P 1","2","","4'-Cyanobiphenyl-4-yl 7-diethylamino-2-oxo-2<i>H</i>-chromene-3-carboxylate","","- C27 H22 N2 O4 -","- C27 H22 N2 O4 -","- C54 H44 N4 O8 -","2","1","HB7027","Sreenivasa, S.; Srinivasa, H. T.; Palakshamurthy, B. S.; Kumar, Vijith; Devarajegowda, H. C.","4'-Cyanobiphenyl-4-yl 7-diethylamino-2-oxo-2<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section E","2013","69","2","o266","","10.1107/S1600536813001591","","","0.71073","MoKα","","0.0911","0.0575","","","0.1546","0.1734","","","","","","0.972","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237331","6.4116","0.0006","7.7751","0.0007","13.0423","0.0012","80.136","0.001","80.413","0.001","73.231","0.001","608.57","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis(2-amino-4-methylpyrimidin-1-ium) hexaaquacobalt(II) disulfate dihydrate","","- C10 H32 Co N6 O16 S2 -","- C10 H32 Co N6 O16 S2 -","- C10 H32 Co N6 O16 S2 -","1","0.5","HB7029","Mirzaei, M.; Eshtiagh-Hosseini, H.; Zarghami, S.; Karrabi, Z.; Saeedi, M.; Mague, J. T.","Bis(2-amino-4-methylpyrimidin-1-ium) hexaaquacobalt(II) disulfate dihydrate","Acta Crystallographica Section E","2013","69","2","m128","","10.1107/S1600536813002146","","","0.71073","MoKα","","0.0273","0.0263","","","0.072","0.0729","","","","","","1.09","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237332","14.87","0.004","14.233","0.003","9.245","0.002","90","","103.693","0.004","90","","1901","0.8","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,3-Bis[(<i>tert</i>-butylsulfanyl)methyl]-2,4,6-trimethylbenzene","","- C19 H32 S2 -","- C19 H32 S2 -","- C76 H128 S8 -","4","0.5","HB7031","Paz-Morales, Evelyn; Basauri-Molina, Manuel; Germán-Acacio, Juan Manuel; Reyes-Martínez, Reyna; Morales-Morales, David","1,3-Bis[(<i>tert</i>-butylsulfanyl)methyl]-2,4,6-trimethylbenzene","Acta Crystallographica Section E","2013","69","2","o306","","10.1107/S1600536813002249","","","0.71073","MoKα","","0.1014","0.0552","","","0.1267","0.1425","","","","","","0.927","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237333","30.414","0.004","5.453","0.003","20.661","0.005","90","","118.568","0.003","90","","3009.4","1.9","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-(3,4-Dimethoxybenzyl)chroman-4-one","","- C18 H18 O4 -","- C18 H18 O4 -","- C144 H144 O32 -","8","1","HG5275","Shalini, S.; Girija, C. R.; Simon, Lalitha; Srinivasan, K. K.; Venkatesha, T. V.; Jotani, M. M.","3-(3,4-Dimethoxybenzyl)chroman-4-one","Acta Crystallographica Section E","2013","69","2","o241","","10.1107/S1600536813000925","","","0.71073","MoKα","","0.0695","0.0453","","","","0.1419","","","","","","1.025","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237334","7.8384","0.0016","24.553","0.005","10.936","0.002","90","","99.54","0.03","90","","2075.6","0.7","90","0.2","90","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Benzyl-5-bromo-3-hydroxy-3-(2-imino-3-methyl-5-oxoimidazolidin-4-yl)- 2,3-dihydro-1<i>H</i>-indol-2-one ethanol monosolvate","","- C21 H23 Br N4 O4 -","- C21 H23 Br N4 O4 -","- C84 H92 Br4 N16 O16 -","4","1","HG5279","Penthala, Narsimha Reddy; Crooks, Peter A.","<i>rac</i>-5-Bromo-<i>N</i>-benzylisatincreatinine ethanol monosolvate","Acta Crystallographica Section E","2013","69","2","o288","o289","10.1107/S160053681300038X","","","0.71073","MoKα","","0.036","0.0288","","","0.0707","0.0741","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237335","10.1577","0.0005","19.1711","0.0008","8.6536","0.0003","90","","119.304","0.002","90","","1469.51","0.11","120","2","120","2","","","","","","","","7","C 1 c 1","C -2yc","9","","<i>cis</i>-Dichlorido(dimethyl sulfoxide-κ<i>S</i>)(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'- tetramethylguanidine)platinum(II)","","- C7 H19 Cl2 N3 O Pt S -","- C7 H19 Cl2 N3 O Pt S -","- C28 H76 Cl8 N12 O4 Pt4 S4 -","4","1","HG5281","Eliseev, Ivan I.; Bokach, Nadezhda A.; Haukka, Matti; Golenya, Irina A.","<i>cis</i>-Dichlorido(dimethyl sulfoxide-κ<i>S</i>)(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylguanidine-κ<i>N</i>'')platinum(II)","Acta Crystallographica Section E","2013","69","2","m117","m118","10.1107/S160053681300130X","","","0.71073","MoKα","","0.0268","0.0225","","","0.0439","0.0452","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237336","9.9515","0.0008","10.7382","0.0009","12.625","0.001","98.863","0.007","104.391","0.007","111.498","0.008","1170","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","Orphenadrinium dihydrogen citrate","<i>N</i>,<i>N</i>-Dimethyl-2-[(2-methylphenyl)(phenyl)methoxy]ethanaminium 2-carboxylatomethyl-2-hydroxybutanedioic acid","","- C24 H31 N O8 -","- C24 H31 N O8 -","- C48 H62 N2 O16 -","2","1","HG5283","Kaur, Manpreet; Jasinski, Jerry P.; Keeley, Amanda C.; Yathirajan, H. S.; Siddaraju, B. P.","Orphenadrinium dihydrogen citrate","Acta Crystallographica Section E","2013","69","2","o248","","10.1107/S1600536813001207","","","1.54184","CuKα","","0.0633","0.0558","","","0.1511","0.1607","","","","","","1.026","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237337","5.4032","0.0008","14.722","0.002","12.1055","0.0018","90","","96.182","0.004","90","","957.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(Carboxymethyl)imidazo[1,2-<i>a</i>]pyridin-1-ium chloride","","- C9 H9 Cl N2 O2 -","- C9 H9 Cl N2 O2 -","- C36 H36 Cl4 N8 O8 -","4","1","HP2052","Yin, Wen-Yu","2-(Carboxymethyl)imidazo[1,2-<i>a</i>]pyridin-1-ium chloride","Acta Crystallographica Section E","2013","69","2","o211","","10.1107/S1600536812051549","","","0.71073","MoKα","","0.0628","0.0473","","","0.0779","0.0831","","","","","","1.016","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237338","7.451","0.0005","14.1636","0.0008","8.1977","0.0005","90","","90.459","0.006","90","","865.1","0.09","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","<i>catena</i>-Poly[(acetatochloridozinc)-μ-1,1'-[1,4- phenylenebis(methylene)]di-1<i>H</i>-imidazole]","","- C16 H17 Cl N4 O2 Zn -","- C16 H17 Cl N4 O2 Zn -","- C32 H34 Cl2 N8 O4 Zn2 -","2","0.5","HP2053","Wang, Liang","<i>catena</i>-Poly[(acetatochloridozinc)-μ-1,1'-[1,4-phenylenebis(methylene)]di-1<i>H</i>-imidazole]","Acta Crystallographica Section E","2013","69","2","m102","","10.1107/S1600536813000524","","","0.71073","MoKα","","0.0787","0.0535","","","0.1137","0.1239","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237339","10.406","0.004","14.323","0.005","10.45","0.004","90","","93.294","0.006","90","","1554.9","1","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2-Amino-7-methyl-4-oxidopteridine-6-carboxylato- κ^3^<i>O</i>^4^,<i>N</i>^5^,<i>O</i>^6^)aqua(ethane-1,2-diamine- κ^2^<i>N</i>,<i>N</i>')nickel(II) dihydrate","","- C10 H19 N7 Ni O6 -","- C10 H19 N7 Ni O6 -","- C40 H76 N28 Ni4 O24 -","4","1","HY2612","Baisya, Siddhartha S.; Roy, Parag S.","(2-Amino-7-methyl-4-oxidopteridine-6-carboxylato-κ^3^<i>O</i>^4^,<i>N</i>^5^,<i>O</i>^6^)aqua(ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')nickel(II) dihydrate","Acta Crystallographica Section E","2013","69","2","m99","m100","10.1107/S160053681300069X","","","0.71073","MoKα","","0.0641","0.0501","","0.1348","0.1258","0.1348","","","","","","0.9145","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237340","16.83","0.004","22.032","0.005","23.221","0.005","90","","90","","90","","8610","3","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","<i>trans</i>-Dibromidotetrakis(pyridine-κ<i>N</i>)ruthenium(II)","","- C20 H20 Br2 N4 Ru -","- C20 H20 Br2 N4 Ru -","- C320 H320 Br32 N64 Ru16 -","16","0.5","HY2613","Wu, Xiu-Li; Ye, Ru-Fei; Jia, Ai-Quan; Chen, Qun; Zhang, Qian-Feng","<i>trans</i>-Dibromidotetrakis(pyridine-κ<i>N</i>)ruthenium(II)","Acta Crystallographica Section E","2013","69","2","m105","","10.1107/S1600536813000871","","","0.71073","MoKα","","0.0493","0.0251","","","0.0588","0.0686","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237341","9.7733","0.0003","19.6193","0.0005","11.7922","0.0003","90","","109.603","0.001","90","","2130.05","0.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(2,4-Dinitrophenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1<i>H</i>- xanthene-1,8(2<i>H</i>)-dione","","- C23 H24 N2 O7 -","- C23 H24 N2 O7 -","- C92 H96 N8 O28 -","4","1","IM2418","Sureshbabu, N.; Sughanya, V.","9-(2,4-Dinitrophenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1<i>H</i>-xanthene-1,8(2<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","2","o281","","10.1107/S1600536813001384","","","0.71073","MoKα","","0.0853","0.0518","","","0.1369","0.1585","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237342","8.313","0.0015","20.866","0.004","12.513","0.002","90","","97.665","0.002","90","","2151.1","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[[[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ-(2,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,4-diolato)-κ^4^<i>O</i>^1^,<i>O</i>^6^:<i>O</i>^3^,<i>O</i>^4^] ethanol disolvate]","","- C20 H20 Cl2 Mn N2 O6 -","- C20 H20 Cl2 Mn N2 O6 -","- C80 H80 Cl8 Mn4 N8 O24 -","4","1","IS5235","Nishimura, Yuji; Himegi, Akiko; Fuyuhiro, Akira; Hayami, Shinya; Kawata, Satoshi","<i>catena</i>-Poly[[[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ-(2,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,4-diolato)-κ^4^<i>O</i>^1^,<i>O</i>^6^:<i>O</i>^3^,<i>O</i>^4^] ethanol disolvate]","Acta Crystallographica Section E","2013","69","2","m119","m120","10.1107/S1600536813001438","","","0.71075","MoKα","","0.0403","0.037","","","0.087","0.0893","","","","","","1.097","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237343","10.3669","0.0002","15.7466","0.0003","18.4539","0.0003","77.373","0.001","80.425","0.001","87.058","0.001","2898.31","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 4-hydroxy-1-methyl-5-oxo-2-phenylpyrrolidine-3-carboxylate 1.25-hydrate","","- C14 H19.5 N O5.25 -","- C14 H19.5 N O5.25 -","- C112 H156 N8 O42 -","8","4","IS5239","Mansor, Nurul Shulehaf; Mohammat, Mohd Fazli; Shaameri, Zurina; Khaledi, Hamid","Ethyl 4-hydroxy-1-methyl-5-oxo-2-phenylpyrrolidine-3-carboxylate 1.25-hydrate","Acta Crystallographica Section E","2013","69","2","o293","o294","10.1107/S1600536813001943","","","0.71073","MoKα","","0.0463","0.0387","","","0.0985","0.1038","","","","","","1.021","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237344","16.22","0.003","15.361","0.003","18.224","0.004","90","","113.792","0.002","90","","4154.7","1.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","N-Boc-5-bromo-3-(thiophene-2-carbonyl)-1H-indole-2-ethylcarboxylate","1-<i>tert</i>-Butyl 2-ethyl 5-bromo-3-(thiophen-2-ylcarbonyl)-1<i>H</i>-indole-1,2-dicarboxylate","","- C21 H20 Br N O5 S -","- C20.9999 H20 Br N O5 S -","- C167.999 H160 Br8 N8 O40 S8 -","8","1","JJ2160","Hassam, Mohammad; Smith, Vincent J.","1-<i>tert</i>-Butyl 2-ethyl 5-bromo-3-(thiophen-2-ylcarbonyl)-1<i>H</i>-indole-1,2-dicarboxylate","Acta Crystallographica Section E","2013","69","2","o237","","10.1107/S1600536813000809","","","0.71073","MoKα","","0.0376","0.0285","","","0.0632","0.0661","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237345","8.56","0.0003","6.632","0.0002","23.413","0.0007","90","","90.742","0.002","90","","1329.04","0.07","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","7-Methoxyflavanone","7-Methoxy-2-phenylchroman-4-one","","- C16 H14 O3 -","- C16 H14 O3 -","- C64 H56 O12 -","4","1","KJ2213","Piaskowska, Agata; Hodorowicz, Maciej; Nitek, Wojciech","7-Methoxy-2-phenylchroman-4-one","Acta Crystallographica Section E","2013","69","2","o271","","10.1107/S1600536813001451","","","0.71073","MoKα","","0.126","0.0864","","","0.2556","0.2798","","","","","","1.176","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237346","9.4741","0.0015","10.1805","0.0015","12.0677","0.0018","103.25","0.004","95.443","0.003","97.08","0.003","1115.2","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-chlorido-bis{[2-(di-<i>tert</i>-butylphosphanyl)biphenyl-3-yl- κ^2^<i>C</i>^3^,<i>P</i>]palladium(II)} dichloromethane disolvate","","- C42 H56 Cl6 P2 Pd2 -","- C42 H56 Cl6 P2 Pd2 -","- C42 H56 Cl6 P2 Pd2 -","1","0.5","KJ2217","Holzapfel, Cedric W.; Omondi, Bernard","Di-μ-chlorido-bis{[2-(di-<i>tert</i>-butylphosphanyl)biphenyl-3-yl-κ^2^<i>C</i>^3^,<i>P</i>]palladium(II)} dichloromethane disolvate","Acta Crystallographica Section E","2013","69","2","m86","","10.1107/S1600536812051136","","","0.71073","MoKα","","0.0589","0.0389","","","0.0847","0.0936","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237347","8.014","0.004","15.472","0.007","16.006","0.007","90","","99.98","0.02","90","","1954.6","1.6","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-Benzhydryl-6-<i>tert</i>-butyl-4-methylphenol","","- C24 H26 O -","- C24 H26 O -","- C96 H104 O4 -","4","1","KJ2218","Yoon, Sungwoo; Lee, Junseong; Kim, Youngjo","2-Benzhydryl-6-<i>tert</i>-butyl-4-methylphenol","Acta Crystallographica Section E","2013","69","2","o287","","10.1107/S1600536813002006","","","0.71073","MoKα","","0.1858","0.0705","","","0.1322","0.1717","","","","","","1","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237348","13.431","0.014","9.1803","0.0009","12.638","0.004","90","","100.49","0.08","90","","1532.2","1.7","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[2-(5-<i>tert</i>-Butyl-1,2-oxazol-3-yl)hydrazinylidene]chroman-2,4-dione","","- C16 H15 N3 O4 -","- C16 H15 N3 O4 -","- C64 H60 N12 O16 -","4","1","KP2443","Jashari, Ahmed; Popovski, Emil; Mikhova, Bozhana; Nikolova, Rositsa P.; Shivachev, Boris L.","3-[2-(5-<i>tert</i>-Butyl-1,2-oxazol-3-yl)hydrazinylidene]chroman-2,4-dione","Acta Crystallographica Section E","2013","69","2","o258","","10.1107/S1600536813000858","","","0.7107","MoKα","","0.101","0.0718","","","0.1659","0.1813","","","","","","1.09","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237349","8.7126","0.0003","19.1311","0.0006","13.9338","0.0004","90","","93.198","0.002","90","","2318.89","0.13","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-{2-[(<i>E</i>)-3-(4-Chlorophenyl)-3-oxoprop-1-en-1-yl]phenoxy}butyl)-1<i>H</i>-indole-3-carbaldehyde","","- C28 H24 Cl N O3 -","- C28 H24 Cl N O3 -","- C112 H96 Cl4 N4 O12 -","4","1","KP2444","Paramasivam, S.; Purushothaman, Santhanagopalan; Seshadri, P. R.; Raghunathan, Raghavachary","1-(4-{2-[(<i>E</i>)-3-(4-Chlorophenyl)-3-oxoprop-1-en-1-yl]phenoxy}butyl)-1<i>H</i>-indole-3-carbaldehyde","Acta Crystallographica Section E","2013","69","2","o314","o315","10.1107/S1600536813002456","","","0.71073","MoKα","","0.0739","0.0493","","","0.1266","0.1446","","","","","","1.026","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237350","11.517","0.003","13.248","0.002","13.459","0.001","91.13","0.005","104.708","0.004","109.798","0.004","1856.2","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dichlorido{<i>N</i>'-[phenyl(pyridin-2-yl- κ<i>N</i>)methylidene]isonicotinohydrazide-κ^2^<i>N</i>',<i>O</i>}zinc","","- C18 H14 Cl2 N4 O Zn -","- C18 H14 Cl2 N4 O Zn -","- C72 H56 Cl8 N16 O4 Zn4 -","4","2","KQ2001","Sy, Adama; Dieng, Moussa; Thiam, Ibrahima Elhadj; Gaye, Mohamed; Retailleau, Pascal","Dichlorido{<i>N</i>'-[phenyl(pyridin-2-yl-κ<i>N</i>)methylidene]isonicotinohydrazide-κ^2^<i>N</i>',<i>O</i>}zinc","Acta Crystallographica Section E","2013","69","2","m108","","10.1107/S1600536813001281","","","0.7107","MoKα","","0.0928","0.0424","","","0.0856","0.1018","","","","","","0.972","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237351","18.3693","0.0014","5.6971","0.0004","16.3049","0.0012","90","","109.526","0.001","90","","1608.2","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>rac</i>-1-[6-Hydroxy-4-(4-methoxyphenyl)-3,6-dimethyl-4,5,6,7- tetrahydro-2<i>H</i>-indazol-5-yl]ethanone","","- C18 H22 N2 O3 -","- C18 H22 N2 O3 -","- C72 H88 N8 O12 -","4","1","LD2089","Potekhin, Konstantin A.; Askerov, Rizvan K.; Hajiyeva, Kushvar E.; Gadirova, Narmina A.; Nazarov, Shahkaram I.","<i>rac</i>-1-[6-Hydroxy-4-(4-methoxyphenyl)-3,6-dimethyl-4,5,6,7-tetrahydro-2<i>H</i>-indazol-5-yl]ethanone","Acta Crystallographica Section E","2013","69","2","o243","","10.1107/S1600536813000937","","","0.71073","MoKα","","0.091","0.0574","","","0.136","0.1513","","","","","","1.002","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237352","6.311","0.0013","15.429","0.003","15.433","0.003","90","","90","","90","","1502.7","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","[(1<i>R</i>,3<i>S</i>)-2,2-Dichloro-3-(hydroxymethyl)cyclopropyl]methanol","","- C5 H8 Cl2 O2 -","- C5 H8 Cl2 O2 -","- C40 H64 Cl16 O16 -","8","2","LD2090","Kailani, Mohammed H.","[(1<i>R</i>,3<i>S</i>)-2,2-Dichloro-3-(hydroxymethyl)cyclopropyl]methanol","Acta Crystallographica Section E","2013","69","2","o225","","10.1107/S1600536813000366","","","0.71073","MoKα","","0.0592","0.0384","","","0.078","0.0847","","","","","","1.026","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237353","15.9018","0.001","7.3716","0.0004","16.8376","0.001","90","","111.644","0.003","90","","1834.57","0.19","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Ethyl-4-{2-[1-(4-methylphenyl)ethylidene]hydrazinylidene}-3,4-dihydro-1<i>H</i>-2λ^6^,1-benzothiazine-2,2-dione","","- C19 H21 N3 O2 S -","- C19 H21 N3 O2 S -","- C76 H84 N12 O8 S4 -","4","1","LD2091","Shafiq, Muhammad; Tahir, M. Nawaz; Harrison, William T. A.; Bokhari, Tanveer Hussain; Safder, Muhammad","1-Ethyl-4-{2-[1-(4-methylphenyl)ethylidene]hydrazinylidene}-3,4-dihydro-1<i>H</i>-2λ^6^,1-benzothiazine-2,2-dione","Acta Crystallographica Section E","2013","69","2","o200","","10.1107/S1600536813000202","","","0.71073","MoKα","","0.0703","0.0481","","","0.1232","0.1387","","","","","","1.024","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237354","14.451","0.011","9.558","0.007","11.404","0.009","90","","92.749","0.015","90","","1573","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis[μ-4-(4-carboxyphenoxy)phthalato]bis[triaquacobalt(II)]","","- C30 H28 Co2 O20 -","- C30 H28 Co2 O20 -","- C60 H56 Co4 O40 -","2","0.5","LH5557","Wang, Liang","Bis[μ-4-(4-carboxyphenoxy)phthalato]bis[triaquacobalt(II)]","Acta Crystallographica Section E","2013","69","2","m101","","10.1107/S1600536813000536","","","0.71073","MoKα","","0.141","0.0589","","","0.0977","0.1159","","","","","","0.895","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237355","8.7845","0.0004","9.4656","0.0004","13.7529","0.0006","109.276","0.001","98.306","0.001","99.739","0.001","1038.95","0.08","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Di-μ-thiosemicarbazide- κ^4^<i>S</i>:<i>S</i>-bis[chloridobis(triphenylphosphane-κ<i>P</i>)silver(I)]","","- C38 H40 Ag2 Cl2 N6 P2 S2 -","- C38 H40 Ag2 Cl2 N6 P2 S2 -","- C38 H40 Ag2 Cl2 N6 P2 S2 -","1","0.5","LH5573","Wattanakanjana, Yupa; Pakawatchai, Chaveng; Nimthong, Ruthairat","Di-μ-thiosemicarbazide-κ^4^<i>S</i>:<i>S</i>-bis[chloridobis(triphenylphosphane-κ<i>P</i>)silver(I)]","Acta Crystallographica Section E","2013","69","2","m83","m84","10.1107/S1600536812051562","","","0.71073","MoKα","","0.0282","0.0258","","","0.0675","0.0694","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237356","14.1607","0.0006","15.3126","0.001","21.1196","0.0014","90","","90","","90","","4579.5","0.5","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","9-(3,4-Dimethoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","","- C25 H31 N O4 -","- C25 H31 N O4 -","- C200 H248 N8 O32 -","8","2","LH5574","Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Patil, D. R.; Chandam, D. R.; Deshmukh, Madhukar B.","9-(3,4-Dimethoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2013","69","2","o297","o298","10.1107/S1600536813002250","","","0.71073","MoKα","","0.0962","0.0587","","","0.1087","0.1272","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237357","13.4735","0.0004","14.7294","0.0004","18.2282","0.0006","90","","109.255","0.001","90","","3415.14","0.18","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","μ-Oxalato-bis[bis(triphenylphosphine)copper(I)] dichloromethane disolvate","","- C76 H64 Cl4 Cu2 O4 P4 -","- C76 H64 Cl4 Cu2 O4 P4 -","- C152 H128 Cl8 Cu4 O8 P8 -","2","0.5","LH5575","Royappa, Andrew D.; Golen, James A.; Rheingold, Arnold L.; Royappa, A. Timothy","μ-Oxalato-bis[bis(triphenylphosphine)copper(I)] dichloromethane disolvate","Acta Crystallographica Section E","2013","69","2","m126","","10.1107/S1600536813002080","","","0.71073","MoKα","","0.0493","0.0354","","","0.0817","0.0875","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237358","8.493","0.003","10.285","0.003","15.247","0.005","90","","94.512","0.004","90","","1327.7","0.7","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Chloro-2,4-bis(dimethylamino)-1,3,5-trimethylborazine","","- C7 H21 B3 Cl N5 -","- C7 H21 B3 Cl N5 -","- C28 H84 B12 Cl4 N20 -","4","1","LH5576","Rodriguez, Mark A.; Borek, Theodore T.","6-Chloro-2,4-bis(dimethylamino)-1,3,5-trimethylborazine","Acta Crystallographica Section E","2013","69","2","o309","","10.1107/S1600536813002420","","","0.71073","MoKα","","0.0648","0.0403","","","0.0963","0.1095","","","","","","1.026","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237359","8.696","0.0006","12.3708","0.0004","18.3303","0.001","90","","90","","90","","1971.91","0.18","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3β-Acetoxy-19-hydroxy-Δ^5^-pregnen-20-one","","- C23 H34 O4 -","- C23 H34 O4 -","- C92 H136 O16 -","4","1","LR2076","Meier zu Greffen, Aike; Kranz, Darius P.; Neudörfl, Jörg-M.; Schmalz, Hans-Günther","3β-Acetoxy-19-hydroxy-Δ^5^-pregnen-20-one","Acta Crystallographica Section E","2013","69","2","o313","","10.1107/S1600536813002493","","","0.71073","MoKα","","0.0543","0.0367","","","0.0743","0.0794","","","","","","0.987","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237360","8.3022","0.0002","9.0208","0.0003","12.0334","0.0004","96.468","0.002","93.652","0.002","117.422","0.002","788","0.04","295","2","295","","","","","","","","","4","P -1","-P 1","2","","Dimethyl 2-[(acridin-9-yl)methylidene]malonate","","- C19 H15 N O4 -","- C19 H15 N O4 -","- C38 H30 N2 O8 -","2","1","LR2094","de Almeida, Sinara M. V.; Pitta, Ivan R.; do Lima, Maria; Mendonça Junior, Francisco J. B.; de Simone, Carlos A.","Dimethyl 2-[(acridin-9-yl)methylidene]malonate","Acta Crystallographica Section E","2013","69","2","o224","","10.1107/S1600536813000500","","","0.71073","MoKα","","0.063","0.0515","","","0.1344","0.1479","","","","","","1.048","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237361","9.0248","0.0003","8.7602","0.0003","13.1792","0.0004","90","","101.062","0.002","90","","1022.58","0.06","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Ethyl 3-[6-(4-methoxybenzenesulfonamido)-2<i>H</i>-indazol-2-yl]propanoate monohydrate","","- C19 H23 N3 O6 S -","- C19 H23 N3 O6 S -","- C38 H46 N6 O12 S2 -","2","1","LR2095","Abbassi, Najat; Rakib, El Mostapha; Hannioui, Abdellah; Saadi, Mohamed; El Ammari, Lahcen","Ethyl 3-[6-(4-methoxybenzenesulfonamido)-2<i>H</i>-indazol-2-yl]propanoate monohydrate","Acta Crystallographica Section E","2013","69","2","o190","o191","10.1107/S1600536812051975","","","0.71073","MoKα","","0.032","0.0305","","","0.0756","0.0767","","","","","","1.053","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237362","4.6311","0.0003","5.0435","0.0003","15.2957","0.0009","89.091","0.004","83.315","0.004","85.956","0.004","353.94","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","1,2-Ethanediylbis(2-hydroxybenzamide)","2,2'-Dihydroxy-<i>N</i>,<i>N</i>'-(ethane-1,2-diyl)dibenzamide","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","1","0.5","LR2096","da Costa, Daniel Pereira; Nobre, Sabrina Madruga; Lisboa, Bruna Gonçalves; de Vicenti, Juliano Rosa; Back, Davi Fernando","2,2'-Dihydroxy-<i>N</i>,<i>N</i>'-(ethane-1,2-diyl)dibenzamide","Acta Crystallographica Section E","2013","69","2","o201","","10.1107/S1600536812051963","","","0.71073","MoKα","","0.0882","0.0486","","","0.122","0.1427","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237363","4.0171","0.0008","14.105","0.003","11.899","0.002","90","","92.54","0.03","90","","673.5","0.2","85","2","85","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(3-picoline)2CuBr2","<i>trans</i>-Dibromidobis(3-methylpyridine-κ<i>N</i>)copper(II)","","- C12 H14 Br2 Cu N2 -","- C12 H14 Br2 Cu N2 -","- C24 H28 Br4 Cu2 N4 -","2","0.5","LR2097","Awwadi, Firas F.","<i>trans</i>-Dibromidobis(3-methylpyridine-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2013","69","2","m116","","10.1107/S1600536813001414","","","0.71073","MoKα","","0.0435","0.0323","","","0.0707","0.0749","","","","","","1.009","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237364","15.4839","0.0004","9.5832","0.0002","15.6375","0.0004","90","","115.184","0.001","90","","2099.81","0.09","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>rac</i>-Methyl (1<i>R</i>,3'<i>S</i>)-1',1''-dimethyl-2,2''-dioxo-2<i>H</i>- dispiro[acenaphthylene-1,2'-pyrrolidine-3',3''-indoline]-4'-carboxylate","","- C26 H22 N2 O4 -","- C26 H22 N2 O4 -","- C104 H88 N8 O16 -","4","1","LX2278","Ganesh, G.; Yuvaraj, Panneer Selvam; Divakara, Chinthalapuri; Reddy, Boreddy S. R.; SubbiahPandi, A.","<i>rac</i>-Methyl (1<i>R</i>,3'<i>S</i>)-1',1''-dimethyl-2,2''-dioxo-2<i>H</i>-dispiro[acenaphthylene-1,2'-pyrrolidine-3',3''-indoline]-4'-carboxylate","Acta Crystallographica Section E","2013","69","2","o235","","10.1107/S1600536813000470","","","0.71073","MoKα","","0.0564","0.0377","","","0.0918","0.103","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237365","13.4342","0.0002","13.7395","0.0003","13.9932","0.0003","89.174","0.011","77.075","0.012","77.159","0.012","2452.76","0.19","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","Bis{2-[(2,4,6-trimethylphenyl)iminomethyl]pyrrol-1-ido}palladium(II)","","- C28 H30 N4 Pd -","- C28 H30 N4 Pd -","- C112 H120 N16 Pd4 -","4","2","NC2300","Imhof, Wolfgang","Bis{2-[(2,4,6-trimethylphenyl)iminomethyl]pyrrol-1-ido}palladium(II)","Acta Crystallographica Section E","2013","69","2","m96","","10.1107/S1600536813000573","","","0.71073","MoKα","","0.0459","0.0322","","","0.0759","0.0819","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237366","9.2483","0.0018","6.663","0.0013","17.622","0.003","90","","94.377","0.002","90","","1082.7","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Chloro-<i>N</i>-methyl-<i>N</i>-[2-(methylamino)phenyl]acetamide","","- C10 H13 Cl N2 O -","- C10 H13 Cl N2 O -","- C40 H52 Cl4 N8 O4 -","4","1","NC2302","Bai, Yu-Bin; Chen, Xia-Hui; Ma, Ya-Tuan; Zhang, An-Ling; Gao, Jin-Ming","2-Chloro-<i>N</i>-methyl-<i>N</i>-[2-(methylamino)phenyl]acetamide","Acta Crystallographica Section E","2013","69","2","o229","","10.1107/S1600536813000494","","","0.71073","MoKα","","0.0632","0.0445","","","0.1243","0.1401","","","","","","1.009","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237367","11.2079","0.0003","13.1612","0.0005","14.3443","0.0006","86.578","0.003","70.484","0.003","71.232","0.003","1885.6","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis(diethylamido-κ<i>N</i>)(diethylamine-κ<i>N</i>)bis(2,6- diisopropylphenylamido-κ<i>N</i>)zirconium(IV)","","- C36 H67 N5 Zr -","- C36 H67 N5 Zr -","- C72 H134 N10 Zr2 -","2","1","NG5310","Zauliczny, Mateusz; Grubba, Rafał; Ponikiewski, Łukasz; Pikies, Jerzy","Bis(diethylamido-κ<i>N</i>)(diethylamine-κ<i>N</i>)bis(2,6-diisopropylphenylamido-κ<i>N</i>)zirconium(IV)","Acta Crystallographica Section E","2013","69","2","m72","","10.1107/S160053681205115X","","","0.71073","MoKα","","0.0921","0.0734","","","0.1797","0.1882","","","","","","1.121","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237368","12.8617","0.001","7.5352","0.0005","17.595","0.0015","90","","103.143","0.008","90","","1660.6","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Dimethylphenyl acridine-9-carboxylate","","- C22 H17 N O2 -","- C22 H17 N O2 -","- C88 H68 N4 O8 -","4","1","NG5313","Trzybiński, Damian; Wera, Michał; Krzymiński, Karol; Błażejowski, Jerzy","2,6-Dimethylphenyl acridine-9-carboxylate","Acta Crystallographica Section E","2013","69","2","o166","","10.1107/S160053681205129X","","","0.71073","MoKα","","0.0918","0.0565","","","0.1305","0.1514","","","","","","0.968","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237369","16.4369","0.0013","6.54","0.0005","16.5025","0.0017","90","","104.312","0.004","90","","1718.9","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","6-Bromo-1-methyl-4-[2-(1-phenylethylidene)hydrazinylidene]- 3,4-dihydro-1<i>H</i>-2λ^6^,1-benzothiazine-2,2-dione","","- C17 H16 Br N3 O2 S -","- C17 H16 Br N3 O2 S -","- C68 H64 Br4 N12 O8 S4 -","4","1","NG5314","Shafiq, Muhammad; Tahir, M. Nawaz; Harrison, William T. A.; Bukhari, Iftikhar Hussain; Khan, Islam Ullah","6-Bromo-1-methyl-4-[2-(1-phenylethylidene)hydrazinylidene]-3,4-dihydro-1<i>H</i>-2λ^6^,1-benzothiazine-2,2-dione","Acta Crystallographica Section E","2013","69","2","o164","","10.1107/S1600536812051380","","","0.71073","MoKα","","0.0646","0.0366","","","0.0738","0.0824","","","","","","1.018","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237370","16.3887","0.0004","8.3136","0.0002","10.1404","0.0003","90","","90.234","0.002","90","","1381.61","0.06","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzyl <i>N</i>-[(<i>Z</i>)-(1-methyl-2-sulfanylpropylidene)amino]carbamodithioate","","- C12 H16 N2 S3 -","- C12 H16 N2 S3 -","- C48 H64 N8 S12 -","4","1","NK2192","bin Break, Mohammed Khaled; Mehta, Sachin; Tahir, M. Ibrahim M.; Crouse, Karen A.; Khoo, Teng-Jin","Benzyl <i>N</i>-[(<i>Z</i>)-(1-methyl-2-sulfanylpropylidene)amino]carbamodithioate","Acta Crystallographica Section E","2013","69","2","o178","","10.1107/S1600536812051008","","","1.5418","CuKα","","0.0485","0.0443","","0.1226","0.1188","0.1226","","","","","","0.9896","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237371","17.728","0.013","12.272","0.009","12.094","0.008","90","","90","","90","","2631","3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","3''-(2-Fluorobenzylidene)-4'-(2-fluorophenyl)-1'-methyldispiro[acenaphthylene- 1,2'-pyrrolidine-3',1''-cyclopentane]-2,2''-dione","","- C33 H25 F2 N O2 -","- C33 H25 F2 N O2 -","- C132 H100 F8 N4 O8 -","4","1","PK2458","Chen, Gao-Zhi; Wei, Xiao-Yan; Wang, Yi; Ren, Lu-Qing; Li, Xiao-Kun","3''-(2-Fluorobenzylidene)-4'-(2-fluorophenyl)-1'-methyldispiro[acenaphthylene-1,2'-pyrrolidine-3',1''-cyclopentane]-2,2''-dione","Acta Crystallographica Section E","2013","69","2","o249","o250","10.1107/S1600536812051550","","","0.71073","MoKα","","0.0642","0.0545","","","0.1205","0.1256","","","","","","1.019","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2237372","22.7084","0.0004","10.3582","0.0002","14.7152","0.0003","90","","100.106","0.001","90","","3407.58","0.11","193","2","193","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","2,7-Diisopropoxy-1,8-bis(4-phenoxybenzoyl)naphthalene","[8-(4-Phenoxybenzoyl)-2,7-bis(propan-2-yloxy)naphthalen-1-yl](4- phenoxyphenyl)methanone","","- C42 H36 O6 -","- C42 H36 O6 -","- C168 H144 O24 -","4","0.5","PK2459","Yoshiwaka, Sayaka; Hijikata, Daichi; Sasagawa, Kosuke; Okamoto, Akiko; Yonezawa, Noriyuki","[8-(4-Phenoxybenzoyl)-2,7-bis(propan-2-yloxy)naphthalen-1-yl](4-phenoxyphenyl)methanone","Acta Crystallographica Section E","2013","69","2","o242","","10.1107/S1600536813000913","","","1.54187","CuKα","","0.0393","0.0356","","","0.0937","0.0958","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237373","12.8391","0.0015","11.0697","0.0013","35.897","0.004","90","","90","","90","","5101.9","1","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(4-Chloroacetanilido-κ^2^<i>N</i>,<i>O</i>)bis[2-(pyridin-2-yl)phenyl- κ^2^<i>C</i>^1^,<i>N</i>]iridium(III)","","- C30 H23 Cl Ir N3 O -","- C30 H23 Cl Ir N3 O -","- C240 H184 Cl8 Ir8 N24 O8 -","8","1","PK2461","Sun, Lijun; Zhang, Songlin; Song, Qijun","(4-Chloroacetanilido-κ^2^<i>N</i>,<i>O</i>)bis[2-(pyridin-2-yl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]iridium(III)","Acta Crystallographica Section E","2013","69","2","m98","","10.1107/S1600536813000433","","","0.7107","MoKα","","0.0691","0.0575","","","0.095","0.099","","","","","","1.107","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237374","7.6418","0.0003","20.8825","0.0009","18.0412","0.0009","90","","94.485","0.001","90","","2870.2","0.2","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl <i>N</i>-hydroxy-<i>N</i>-(2-methylphenyl)carbamate","","- C9 H11 N O3 -","- C9 H11 N O3 -","- C108 H132 N12 O36 -","12","3","PK2462","Zhang, Binbin; Wang, Yifeng; Dong, Kun; Xu, Danqian","Methyl <i>N</i>-hydroxy-<i>N</i>-(2-methylphenyl)carbamate","Acta Crystallographica Section E","2013","69","2","o230","","10.1107/S1600536813000421","","","0.71073","MoKα","","0.1175","0.063","","","0.1322","0.1606","","","","","","1.007","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237375","11.6939","0.0002","13.1689","0.0003","25.9575","0.0005","90","","95.4","0.01","90","","3979.61","0.15","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[diaqua(μ~4~-carboxylatomethylphosphonato)(μ~4~- carboxymethylphosphonato)pentadecamethylpentatin(IV)]","","- C19 H54 O12 P2 Sn5 -","- C19 H54 O12 P2 Sn5 -","- C76 H216 O48 P8 Sn20 -","4","0.5","PV2611","Boye, Mouhamadou Sembene; Diasse-Sarr, Aminata; Grosjean, Arnaud; Guionneau, Philippe","Poly[diaqua(μ~4~-carboxylatomethylphosphonato)(μ~4~-carboxymethylphosphonato)pentadecamethylpentatin(IV)]","Acta Crystallographica Section E","2013","69","2","m110","m111","10.1107/S1600536813000676","","","0.71073","MoKα","","0.0261","0.0223","","","0.0525","0.0539","","","","","","1.087","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237376","9.3526","0.0003","17.9559","0.0005","10.9158","0.0003","90","","101.346","0.001","90","","1797.31","0.09","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","14-Ethoxy-4,6,9-trimethyl-8,12-dioxa-4,6- diazatetracyclo[8.8.0.0^2,7^.0^13,18^]octadeca- 2(7),13,15,17-tetraene-3,5,11-trione","","- C19 H20 N2 O6 -","- C19 H20 N2 O6 -","- C76 H80 N8 O24 -","4","1","PV2613","Jagadeesan, G.; Kannan, D.; Bakthadoss, M.; Aravindhan, S.","14-Ethoxy-4,6,9-trimethyl-8,12-dioxa-4,6-diazatetracyclo[8.8.0.0^2,7^.0^13,18^]octadeca-2(7),13,15,17-tetraene-3,5,11-trione","Acta Crystallographica Section E","2013","69","2","o272","","10.1107/S1600536813000743","","","0.71073","MoKα","","0.0772","0.0493","","","0.1314","0.1505","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237377","20.057","0.004","7.3816","0.0015","13.7","0.003","90","","112.324","0.004","90","","1876.3","0.7","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","(7a<i>R</i>)-1-[(2<i>R</i>,5<i>S</i>,<i>E</i>)-6-Hydroxy-5,6-dimethylhept- 3-en-2-yl]-7a-methylhexahydro-1<i>H</i>-inden-4(2<i>H</i>)-one","","- C19 H32 O2 -","- C19 H32 O2 -","- C76 H128 O8 -","4","1","PV2614","Rivadulla, Marcos L.; Sene, Massene; González, María; Covelo, Berta","(7a<i>R</i>)-1-[(2<i>R</i>,5<i>S</i>,<i>E</i>)-6-Hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methylhexahydro-1<i>H</i>-inden-4(2<i>H</i>)-one","Acta Crystallographica Section E","2013","69","2","o218","","10.1107/S1600536812051343","","","0.71073","MoKα","","0.0712","0.0477","","","0.1314","0.1515","","","","","","1.023","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237378","38.9453","0.0014","5.7769","0.0002","18.3045","0.0007","90","","95.334","0.002","90","","4100.4","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-Cyclopropyl-2-(2-fluorophenyl)-5-(4-fluorophenyl)-3-phenylpentane-1,5-dione","","- C26 H22 F2 O2 -","- C26 H22 F2 O2 -","- C208 H176 F16 O16 -","8","1","PV2615","Srinivasan, Thothadri; Senthilkumar, Govindaraj; Manikandan, Haridoss; Gopalakrishanan, Mannathusamy; Velmurugan, Devadasan","1-Cyclopropyl-2-(2-fluorophenyl)-5-(4-fluorophenyl)-3-phenylpentane-1,5-dione","Acta Crystallographica Section E","2013","69","2","o215","","10.1107/S1600536813000032","","","0.71073","MoKα","","0.0768","0.0457","","","0.1114","0.1329","","","","","","1.016","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237379","9.7837","0.0012","10.3917","0.0014","12.2925","0.0017","108.669","0.004","104.484","0.004","99.746","0.004","1103.2","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","3-[2-(Triphenylphosphanylidene)acetyl]-2<i>H</i>-chromen-2-one","","- C29 H21 O3 P -","- C29 H21 O3 P -","- C58 H42 O6 P2 -","2","1","PV2616","Taha, Muhammad; Ismail, Nor Hadiani; Aziza, Ahmad Nazif; Shah, Syed Adnan Ali; Yousuf, Sammer","3-[2-(Triphenylphosphanylidene)acetyl]-2<i>H</i>-chromen-2-one","Acta Crystallographica Section E","2013","69","2","o245","","10.1107/S160053681300127X","","","0.71073","MoKα","","0.0397","0.0354","","","0.0872","0.0926","","","","","","1.074","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237380","7.4426","0.0006","10.5117","0.0009","10.6887","0.0009","60.939","0.004","88.107","0.005","77.546","0.005","711.22","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","8,8-Dimethyl-8,9-dihydro-7<i>H</i>-chromeno[2,3-<i>b</i>]quinoline-10,12-dione","","- C18 H15 N O3 -","- C18 H15 N O3 -","- C36 H30 N2 O6 -","2","1","PV2617","Srinivasan, Thothadri; Yuvaraj, Panneerselvam; Reddy, Boreddy S. R.; Velmurugan, Devadasan","8,8-Dimethyl-8,9-dihydro-7<i>H</i>-chromeno[2,3-<i>b</i>]quinoline-10,12-dione","Acta Crystallographica Section E","2013","69","2","o254","","10.1107/S1600536813001050","","","0.71073","MoKα","","0.0487","0.0401","","","0.1106","0.1183","","","","","","1.054","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237381","25.9304","0.0003","8.93","0.0001","14.9377","0.0002","90","","90","","90","","3458.95","0.07","100","0.5","100","0.5","","","","","","","","2","P b c n","-P 2n 2ab","60","","2-[3-(Naphthalen-2-yl)phenyl]naphthalene","","- C26 H18 -","- C26 H18 -","- C208 H144 -","8","1","PV2619","Wolfenden, Mark L.; Dhar, Raj K.; Fronczek, Frank R.; Watkins, Steven F.","2-[3-(Naphthalen-2-yl)phenyl]naphthalene","Acta Crystallographica Section E","2013","69","2","o308","","10.1107/S1600536813002390","","","0.71073","MoKα","","","0.0453","","","","0.1252","","","","","","1.018","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237382","8.917","0.005","11.03","0.006","12.179","0.007","83.171","0.006","73.903","0.006","68.332","0.006","1069.4","1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-chlorido-bis[(2,2'-bipyridine-5,5'-dicarboxylic acid-κ^2^<i>N</i>,<i>N</i>')chloridocopper(II)] dimethylformamide tetrasolvate","","- C36 H44 Cl4 Cu2 N8 O12 -","- C36 H44 Cl4 Cu2 N8 O12 -","- C36 H44 Cl4 Cu2 N8 O12 -","1","0.5","QK2049","Øien, Sigurd; Wragg, David Stephen; Lillerud, Karl Petter; Tilset, Mats","Di-μ-chlorido-bis[(2,2'-bipyridine-5,5'-dicarboxylic acid-κ^2^<i>N</i>,<i>N</i>')chloridocopper(II)] dimethylformamide tetrasolvate","Acta Crystallographica Section E","2013","69","2","m73","m74","10.1107/S1600536812051422","","","0.71073","MoKα","","0.0425","0.0294","","","0.063","0.0676","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237383","5.3784","0.0005","10.157","0.0009","14.5488","0.0017","77.315","0.009","84.735","0.009","78.193","0.008","758.06","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","(Pyridin-4-yl)methyl 3-[(1<i>E</i>,2<i>E</i>)-3-Phenylprop-2-en-1-ylidene]dithiocarbazate","(Pyridin-4-yl)methyl <i>N</i>'-(3-phenylallylidene)hydrazinecarbodithioate","","- C16 H15 N3 S2 -","- C16 H15 N3 S2 -","- C32 H30 N6 S4 -","2","1","QM2090","Low, May Lee; Ravoof, Thahira Begum S. A.; Tahir, Mohamed Ibrahim Mohamed; Crouse, Karen A.; Tiekink, Edward R. T.","(Pyridin-4-yl)methyl <i>N</i>'-(3-phenylallylidene)hydrazinecarbodithioate","Acta Crystallographica Section E","2013","69","2","o167","o168","10.1107/S1600536812051537","","","1.54184","CuKα","","0.0504","0.0416","","","0.1074","0.1153","","","","","","1.052","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237384","10.6492","0.0005","11.4005","0.0006","15.8046","0.0008","90","","96.482","0.001","90","","1906.51","0.17","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3,5-Diphenyl-1,2,4-dithiazolium tetrabromidoferrate(III)","","- C14 H10 Br4 Fe N S2 -","- C14 H10 Br4 Fe N S2 -","- C56 H40 Br16 Fe4 N4 S8 -","4","1","QM2091","Shotonwa, Ibukun O.; Boeré, René T.","3,5-Diphenyl-1,2,4-dithiazolium tetrabromidoferrate(III)","Acta Crystallographica Section E","2013","69","2","m95","","10.1107/S1600536813000275","","","0.71073","MoKα","","0.0436","0.0269","","","0.0464","0.0502","","","","","","1.019","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237385","7.479","0.005","11.671","0.004","13.52","0.005","90","","100.217","0.005","90","","1161.4","1","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Methylpyridinium 4-hydroxybenzoate","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C52 H52 N4 O12 -","4","1","RK2392","Sudhahar, S.; Krishnakumar, M.; Sornamurthy, B. M.; Chakkaravarthi, G.; Mohankumar, R.","4-Methylpyridinium 4-hydroxybenzoate","Acta Crystallographica Section E","2013","69","2","o279","","10.1107/S1600536813001785","","","0.71073","MoKα","","0.0609","0.0434","","","0.1148","0.1277","","","","","","1.056","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237386","16.0313","0.0003","18.4956","0.0003","12.1238","0.0002","90","","131.389","0.001","90","","2696.96","0.09","193","2","193","2","","","","","","","","3","C 1 c 1","C -2yc","9","1,8-Bis(4-phenoxybenzoyl)-2,7-dihydroxynaphthalene","[2,7-Dihydroxy-8-(4-phenoxybenzoyl)naphthalen-1-yl](4-phenoxyphenyl)methanone","","- C36 H24 O6 -","- C36 H24 O6 -","- C144 H96 O24 -","4","1","RN2112","Hijikata, Daichi; Sasagawa, Kosuke; Yoshiwaka, Sayaka; Okamoto, Akiko; Yonezawa, Noriyuki","[2,7-Dihydroxy-8-(4-phenoxybenzoyl)naphthalen-1-yl](4-phenoxyphenyl)methanone","Acta Crystallographica Section E","2013","69","2","o208","o209","10.1107/S1600536812052038","","","1.54187","CuKα","","0.0404","0.0374","","","0.0939","0.096","","","","","","1.084","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237387","15.4611","0.0019","14.2436","0.0018","20.886","0.003","90","","90","","90","","4599.6","1","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(4,4''-difluoro-1,1':3',1''-terphenyl-2'-carboxylato- κ<i>O</i>)tetrakis(methanol-κ<i>O</i>)calcium methanol tetrasolvate","","- C46 H54 Ca F4 O12 -","- C46 H54 Ca F4 O12 -","- C184 H216 Ca4 F16 O48 -","4","0.5","RU2047","Kim, Namseok; Noh, Heeso; Yoon, Sungho; Park, Chan Ryang","Bis(4,4''-difluoro-1,1':3',1''-terphenyl-2'-carboxylato-κ<i>O</i>)tetrakis(methanol-κ<i>O</i>)calcium methanol tetrasolvate","Acta Crystallographica Section E","2013","69","2","m122","m123","10.1107/S1600536813000044","","","0.71073","MoKα","","0.164","0.0636","","","0.1245","0.1645","","","","","","0.978","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237388","7.0084","0.0008","7.9404","0.0009","23.064","0.003","90","","90","","90","","1283.5","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2-Chlorobenzene-1,4-diaminium bis(dihydrogenphosphate)","","- C6 H13 Cl N2 O8 P2 -","- C6 H13 Cl N2 O8 P2 -","- C24 H52 Cl4 N8 O32 P8 -","4","1","RU2048","Mrad, Mohamed Lahbib; Zeller, Matthias; Rzaigui, Mohamed; Ben Nasr, Cherif","2-Chlorobenzene-1,4-diaminium bis(dihydrogenphosphate)","Acta Crystallographica Section E","2013","69","2","o159","o160","10.1107/S1600536812051434","","","0.71073","MoKα","","0.0251","0.0245","","","0.064","0.0643","","","","","","1.108","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237389","9.3686","0.0019","13.08","0.003","7.3048","0.0015","90","","106.86","0.03","90","","856.7","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[bis(4-methylpyridine-κ<i>N</i>)cobalt(II)]- di-μ-dicyanamido-κ^2^<i>N</i>^1^:<i>N</i>^5^]","","- C16 H14 Co N8 -","- C16 H14 Co N8 -","- C32 H28 Co2 N16 -","2","0.5","RZ5034","Huang, Wenjiang; Zhang, Jinfang; Zhang, Chi","<i>catena</i>-Poly[[bis(4-methylpyridine-κ<i>N</i>)cobalt(II)]-di-μ-dicyanamido-κ^2^<i>N</i>^1^:<i>N</i>^5^]","Acta Crystallographica Section E","2013","69","2","m90","","10.1107/S1600536812051252","","","0.71073","MoKα","","0.034","0.0309","","","0.0834","0.0854","","","","","","1.07","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237390","16.1318","0.0003","7.18561","0.00013","20.7333","0.0004","90","","99.18","0.001","90","","2372.56","0.08","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-Benzoylnaphthalene-2,7-diyl dibenzoate","","- C31 H20 O5 -","- C31 H20 O5 -","- C124 H80 O20 -","4","1","RZ5035","Sakamoto, Rei; Sasagawa, Kosuke; Hijikata, Daichi; Okamoto, Akiko; Yonezawa, Noriyuki","1-Benzoylnaphthalene-2,7-diyl dibenzoate","Acta Crystallographica Section E","2013","69","2","o210","","10.1107/S1600536812052026","","","1.54187","CuKα","","0.0416","0.0372","","","0.0992","0.1025","","","","","","1.067","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237391","5.6957","0.0003","12.1117","0.0011","13.0813","0.0011","72.748","0.008","86.477","0.006","89.941","0.006","860.04","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Benzyl 2-(benzylsulfanyl)benzoate","","- C21 H18 O2 S -","- C21 H18 O2 S -","- C42 H36 O4 S2 -","2","1","RZ5036","Leka, Zorica; Novaković, Sladjana B.; Bogdanović, Goran A.; Radić, Gordana P.; Ratković, Zoran R.","Benzyl 2-(benzylsulfanyl)benzoate","Acta Crystallographica Section E","2013","69","2","o285","o286","10.1107/S1600536813001761","","","1.5418","CuKα","","0.0542","0.0404","","","0.101","0.113","","","","","","1.038","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237392","6.458","0.0004","13.4772","0.0008","16.3169","0.0009","90","","90","","90","","1420.15","0.14","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-2-Methoxy-<i>N</i>'-(2,4,6-trihydroxybenzylidene)benzohydrazide","","- C15 H14 N2 O5 -","- C15 H14 N2 O5 -","- C60 H56 N8 O20 -","4","1","RZ5037","Taha, Muhammad; Baharudin, M. Syukri; Ismail, Nor Hadiani; Shah, Syed Adnan Ali; Yousuf, Sammer","(<i>E</i>)-2-Methoxy-<i>N</i>'-(2,4,6-trihydroxybenzylidene)benzohydrazide","Acta Crystallographica Section E","2013","69","2","o277","","10.1107/S1600536813001748","","","0.71073","MoKα","","0.0328","0.0303","","","0.0773","0.0796","","","","","","1.07","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237393","12.583","0.0007","9.8335","0.0005","23.6377","0.0013","90","","90","","90","","2924.8","0.3","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(<i>E</i>)-<i>N</i>'-(4-Chlorobenzylidene)-2-methoxybenzohydrazide","","- C15 H13 Cl N2 O2 -","- C15 H13 Cl N2 O2 -","- C120 H104 Cl8 N16 O16 -","8","1","RZ5038","Baharudin, M. Syukri; Taha, Muhammad; Ismail, Nor Hadiani; Shah, Syed Adnan Ali; Yousuf, Sammer","(<i>E</i>)-<i>N</i>'-(4-Chlorobenzylidene)-2-methoxybenzohydrazide","Acta Crystallographica Section E","2013","69","2","o276","","10.1107/S160053681300175X","","","0.71073","MoKα","","0.0622","0.0444","","","0.1105","0.1235","","","","","","1.063","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237394","8.704","0.002","8.86","0.002","27.277","0.007","96.876","0.004","95.619","0.003","93.023","0.003","2073.9","0.9","140","1","140","1","","","","","","","","6","P -1","-P 1","2","","(4'-Ethynyl-2,2':6',2''-terpyridine)(2,2':6',2''-terpyridine)ruthenium(II) bis(hexafluoridophosphate) acetonitrile disolvate","","- C36 H28 F12 N8 P2 Ru -","- C36 H28 F12 N8 P2 Ru -","- C72 H56 F24 N16 P4 Ru2 -","2","1","SJ5287","Chen, Weizhong; Rein, Francisca N.; Scott, Brian L.; Rocha, Reginaldo C.","(4'-Ethynyl-2,2':6',2''-terpyridine)(2,2':6',2''-terpyridine)ruthenium(II) bis(hexafluoridophosphate) acetonitrile disolvate","Acta Crystallographica Section E","2013","69","2","m79","m80","10.1107/S1600536812051227","","","0.71073","MoKα","","0.1223","0.0844","","","0.2072","0.2277","","","","","","1.252","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237395","13.9605","0.0004","8.7564","0.0003","17.7055","0.0006","90","","104.381","0.002","90","","2096.57","0.12","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-Methyl-6-(piperidin-1-yl)pyrimidin-2-amine","","- C10 H16 N4 -","- C10 H16 N4 -","- C80 H128 N32 -","8","2","SJ5288","Sreenivasa, S.; ManojKumar, K. E.; Srinivasan, T.; Suchetan, P. A.; Palakshamurthy, B. S.; Velumurgan, D.","4-Methyl-6-(piperidin-1-yl)pyrimidin-2-amine","Acta Crystallographica Section E","2013","69","2","o197","","10.1107/S1600536812050982","","","0.71073","MoKα","","0.0723","0.0511","","","0.1566","0.1705","","","","","","1.099","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237396","7.4591","0.0013","8.2178","0.0019","10.0087","0.0018","85.202","0.017","77.346","0.015","89.278","0.017","596.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(<i>Z</i>)-3-(1-Hydroxy-3-oxobut-1-enyl)-6-nitro-2<i>H</i>-chromen-2-one","","- C13 H9 N O6 -","- C13 H9 N O6 -","- C26 H18 N2 O12 -","2","1","SJ5289","Topno, Nishith Saurav; Tangeti, Venkataswamy; Rao, H. Surya Prakash; Krishna, R.","(<i>Z</i>)-3-(1-Hydroxy-3-oxobut-1-enyl)-6-nitro-2<i>H</i>-chromen-2-one","Acta Crystallographica Section E","2013","69","2","o284","","10.1107/S1600536812051872","","","0.71073","MoKα","","0.075","0.0479","","","0.1414","0.1696","","","","","","0.934","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237397","17.0456","0.0004","7.6026","0.0001","15.5113","0.0003","90","","113.513","0.001","90","","1843.22","0.06","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2,3-Difluorophenyl)(4-tosylpiperazin-1-yl)methanone","","- C18 H18 F2 N2 O3 S -","- C18 H18 F2 N2 O3 S -","- C72 H72 F8 N8 O12 S4 -","4","1","SJ5290","Sreenivasa, S.; ManojKumar, K. E.; Suchetan, P. A.; Tonannavar, J.; Chavan, Yashshwita; Palakshamurthy, B. S.","(2,3-Difluorophenyl)(4-tosylpiperazin-1-yl)methanone","Acta Crystallographica Section E","2013","69","2","o185","","10.1107/S1600536812051690","","","0.71073","MoKα","","0.0426","0.0333","","","0.0852","0.0922","","","","","","1.059","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237398","14.464","0.003","6.7548","0.0015","21.381","0.005","90","","91.663","0.008","90","","2088.1","0.8","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-(Octyloxy)phenyl 2-oxo-2<i>H</i>-chromene-3-carboxylate","","- C24 H26 O5 -","- C24 H26 O5 -","- C96 H104 O20 -","4","1","SJ5291","Palakshamurthy, B. S.; Sreenivasa, S.; Srinivasa, H. T.; Roopashree, K. R.; Devarajegowda, H. C.","4-(Octyloxy)phenyl 2-oxo-2<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section E","2013","69","2","o212","","10.1107/S1600536813000214","","","0.71073","MoKα","","0.1271","0.0583","","","0.1248","0.1462","","","","","","0.937","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237399","10.627","0.002","14.986","0.002","15.19","0.003","90","","103.959","0.001","90","","2347.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[bis(μ~2~-1,4,7,10,13,16-hexaoxacyclooctadecane)dipotassium]-μ~2~-iodido-(iodidocadmium)-di-μ~2~-iodido-(iodidocadmium)-μ~2~-iodido]","","- C12 H24 Cd I3 K O6 -","- C12 H24 Cd I3 K O6 -","- C48 H96 Cd4 I12 K4 O24 -","4","1","SJ5295","Rajarajan, K.; Pugazhenthi, A.; NizamMohideen, M.","<i>catena</i>-Poly[[bis(μ~2~-1,4,7,10,13,16-hexaoxacyclooctadecane)dipotassium]-μ~2~-iodido-(iodidocadmium)-di-μ~2~-iodido-(iodidocadmium)-μ~2~-iodido]","Acta Crystallographica Section E","2013","69","2","m125","","10.1107/S1600536813002274","","","0.71073","MoKα","","0.0345","0.0277","","","0.062","0.0666","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237400","15.878","0.005","8.209","0.005","12.953","0.005","90","","91.016","0.005","90","","1688.1","1.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-[5-(4-Chlorophenyl)-3-methyl-1<i>H</i>-pyrazol-1-yl]benzenesulfonamide","","- C16 H14 Cl N3 O2 S -","- C16 H14 Cl N3 O2 S -","- C64 H56 Cl4 N12 O8 S4 -","4","1","SJ5296","Farrukh, Muhammad A.; Mohamed, Shaaban K.; Ahmed, Maqsood; Marzouk, Adel A.; El-Moghazy, Samir M.","4-[5-(4-Chlorophenyl)-3-methyl-1<i>H</i>-pyrazol-1-yl]benzenesulfonamide","Acta Crystallographica Section E","2013","69","2","o295","o296","10.1107/S1600536813002134","","","0.71073","MoKα","","0.0618","0.0413","","","0.1019","0.1145","","","","","","1.03","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237401","9.526","0.005","10.711","0.005","21.975","0.005","90","","97.397","0.005","90","","2223.5","1.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(6b<i>S</i>*,14<i>R</i>*,14a<i>R</i>*)-Methyl 14-(4-methylphenyl)-7-oxo-6b,6c,7,12b,14,14a-hexahydro-1<i>H</i>- pyrano[3,2-<i>c</i>:5,4-<i>c</i>']dichromene-14a-carboxylate","","- C28 H22 O6 -","- C28 H22 O6 -","- C112 H88 O24 -","4","1","SU2541","Ponnusamy, R.; Sabari, V.; Sivakumar, G.; Bakthadoss, M.; Aravindhan, S.","(6b<i>S</i>*,14<i>R</i>*,14a<i>R</i>*)-Methyl 14-(4-methylphenyl)-7-oxo-6b,6c,7,12b,14,14a-hexahydro-1<i>H</i>-pyrano[3,2-<i>c</i>:5,4-<i>c</i>']dichromene-14a-carboxylate","Acta Crystallographica Section E","2013","69","2","o267","o268","10.1107/S1600536813001244","","","0.71073","MoKα","","0.0702","0.0447","","","0.1159","0.1327","","","","","","1.011","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237402","12.9342","0.0006","7.5591","0.0002","18.7138","0.0008","90","","105.44","0.002","90","","1763.63","0.12","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 6-ethoxy-3-phenyl-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a- carboxylate","","- C20 H19 N O5 -","- C20 H19 N O5 -","- C80 H76 N4 O20 -","4","1","SU2543","Suresh, G.; Srinivasan, J.; Bakthadoss, M.; Aravindhan, S.","Methyl 6-ethoxy-3-phenyl-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carboxylate","Acta Crystallographica Section E","2013","69","2","o180","","10.1107/S1600536812051720","","","0.71073","MoKα","","0.0591","0.042","","","0.11","0.1245","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237403","19.326","0.003","10.7866","0.0017","6.9072","0.0011","90","","90","","90","","1439.9","0.4","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","3-(2-Methylphenyl)-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a- carbonitrile","","- C18 H14 N2 O2 -","- C18 H14 N2 O2 -","- C72 H56 N8 O8 -","4","1","SU2544","Suresh, G.; Srinivasan, J.; Bakthadoss, M.; Aravindhan, S.","3-(2-Methylphenyl)-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carbonitrile","Acta Crystallographica Section E","2013","69","2","o181","","10.1107/S1600536812051732","","","0.71073","MoKα","","0.1047","0.0594","","","0.1295","0.1464","","","","","","1.094","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237404","11.2379","0.0003","23.7075","0.0006","9.457","0.0002","90","","90.809","0.001","90","","2519.31","0.11","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diethyl [(2-chloroanilino)(1,3-diphenyl-1<i>H</i>-pyrazol-4-yl)methyl]phosphonate","","- C26 H27 Cl N3 O3 P -","- C26 H27 Cl N3 O3 P -","- C104 H108 Cl4 N12 O12 P4 -","4","1","SU2545","Suresh, G.; Nandakumar, A.; Sabari, V.; Perumal, P. T.; Aravindhan, S.","Diethyl [(2-chloroanilino)(1,3-diphenyl-1<i>H</i>-pyrazol-4-yl)methyl]phosphonate","Acta Crystallographica Section E","2013","69","2","o182","","10.1107/S1600536812051719","","","0.71073","MoKα","","0.0605","0.0445","","","0.117","0.1354","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237405","15.1034","0.0008","6.0676","0.0003","16.0865","0.001","90","","99.953","0.002","90","","1452","0.14","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","8-Bromo-3-phenyl-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carbonitrile","","- C17 H11 Br N2 O2 -","- C17 H11 Br N2 O2 -","- C68 H44 Br4 N8 O8 -","4","1","SU2547","Suresh, G.; Srinivasan, J.; Bakthadoss, M.; Aravindhan, S.","8-Bromo-3-phenyl-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carbonitrile","Acta Crystallographica Section E","2013","69","2","o312","","10.1107/S1600536813002511","","","0.71073","MoKα","","0.0849","0.0474","","","0.0882","0.1023","","","","","","1.091","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237406","43.0465","0.0015","5.7257","0.0002","18.2828","0.0006","90","","109.103","0.002","90","","4258","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-3-phenylpentane-1,5-dione","","- C26 H22 Cl F O2 -","- C26 H22 Cl F O2 -","- C208 H176 Cl8 F8 O16 -","8","1","SU2549","Srinivasan, Thothadri; Senthilkumar, Govindaraj; Manikandan, Haridoss; Neelakandan, Kaliaperumal; Velmurugan, Devadasan","5-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-3-phenylpentane-1,5-dione","Acta Crystallographica Section E","2013","69","2","o252","","10.1107/S1600536813001074","","","0.71073","MoKα","","0.0635","0.0446","","","0.1294","0.1455","","","","","","1.016","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237407","11.4135","0.0004","11.6663","0.0005","13.581","0.0006","69.265","0.003","73.868","0.002","64.998","0.005","1515.11","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-Chloro-8,8-dimethyl-8,9-dihydro-7<i>H</i>-chromeno[2,3-<i>b</i>]quinoline- 10,12-dione","","- C18 H14 Cl N O3 -","- C18 H14 Cl N O3 -","- C72 H56 Cl4 N4 O12 -","4","2","SU2550","Srinivasan, Thothadri; Yuvaraj, Panneerselvam; Reddy, Boreddy S. R.; Velmurugan, Devadasan","2-Chloro-8,8-dimethyl-8,9-dihydro-7<i>H</i>-chromeno[2,3-<i>b</i>]quinoline-10,12-dione","Acta Crystallographica Section E","2013","69","2","o253","","10.1107/S1600536813001062","","","0.71073","MoKα","","0.0753","0.0526","","","0.1488","0.1673","","","","","","0.988","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237408","9.0188","0.0005","11.6415","0.0009","16.0068","0.0012","90","","100.737","0.002","90","","1651.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(4,4'-Dibromo-[1,1'-biphenyl]-2-yl)benzamide","","- C19 H13 Br2 N O -","- C19 H13 Br2 N O -","- C76 H52 Br8 N4 O4 -","4","1","SU2551","Novina, J. Josephine; Vasuki, G.; Baheti, Abhishek; Thomas, K. R. Justin","<i>N</i>-(4,4'-Dibromo-[1,1'-biphenyl]-2-yl)benzamide","Acta Crystallographica Section E","2013","69","2","o222","","10.1107/S1600536813000597","","","0.71073","MoKα","","0.0681","0.0333","","","0.0648","0.0745","","","","","","1.008","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237409","8.9409","0.0017","9.5209","0.0018","14.323","0.003","106.973","0.004","92.373","0.004","113.778","0.004","1049.4","0.4","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","<i>rac</i>-Dichlorido[3-ethoxy-3-(1-ethyl-1<i>H</i>-benzimidazol-2-yl)-2,3- dihydro-1<i>H</i>-pyrrolo[1,2-<i>a</i>]benzimidazole]copper(II)","","- C21 H22 Cl2 Cu N4 O -","- C21 H22 Cl2 Cu N4 O -","- C42 H44 Cl4 Cu2 N8 O2 -","2","1","TK5184","Stibrany, Robert T.; Potenza, Joseph A.","<i>rac</i>-Dichlorido[3-ethoxy-3-(1-ethyl-1<i>H</i>-benzimidazol-2-yl)-2,3-dihydro-1<i>H</i>-pyrrolo[1,2-<i>a</i>]benzimidazole]copper(II)","Acta Crystallographica Section E","2013","69","2","m92","m93","10.1107/S1600536812051641","","","0.71073","MoKα","","0.0544","0.0437","","","0.1161","0.1241","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237410","7.657","0.003","15.799","0.005","17.425","0.006","90","","95.641","0.005","90","","2097.7","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5-(4- methylsulfanylbenzylidene)-1,3-thiazolidine-2,4-dione","","- C22 H18 F N O3 S2 -","- C22 H18 F N O3 S2 -","- C88 H72 F4 N4 O12 S8 -","4","1","TK5185","Suresh, J.; Venkateshan, M.; Ponnuchamy, S.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","3-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5-(4-methylsulfanylbenzylidene)-1,3-thiazolidine-2,4-dione","Acta Crystallographica Section E","2013","69","2","o188","","10.1107/S1600536812051987","","","0.71073","MoKα","","0.0834","0.0472","","","0.1245","0.1489","","","","","","1.022","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237411","13.5472","0.0002","14.4747","0.0004","35.7902","0.0006","90","","90","","90","","7018.2","0.2","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-[(2-Hydroxynaphthalen-1-yl)methylideneamino]-5,6,7,8-tetrahydro-4<i>H</i>-cyclohepta[<i>b</i>]thiophene-3-carbonitrile","","- C21 H18 N2 O S -","- C21 H18 N2 O S -","- C336 H288 N32 O16 S16 -","16","2","TK5186","Asiri, Abdullah M.; Arshad, Muhammad Nadeem; Sobahi, Tariq R.; Mustafa, Ghulam","2-[(2-Hydroxynaphthalen-1-yl)methylideneamino]-5,6,7,8-tetrahydro-4<i>H</i>-cyclohepta[<i>b</i>]thiophene-3-carbonitrile","Acta Crystallographica Section E","2013","69","2","o193","","10.1107/S160053681300007X","","","1.54184","CuKα","","0.0723","0.054","","","0.1441","0.1614","","","","","","1.02","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237412","7.0972","0.0015","8.7025","0.0019","11.968","0.003","104.238","0.004","100.986","0.003","100.425","0.004","682.9","0.3","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","[μ-6,9-Bis(carboxylatomethyl)-3,12-bis(carboxymethyl)-3,6,9,12- tetraazatetradecanedioato]bis[aquacobalt(II)] tetrahydrate","","- C18 H38 Co2 N4 O18 -","- C18 H38 Co2 N4 O18 -","- C18 H38 Co2 N4 O18 -","1","0.5","TK5188","Qian, Qi-feng; Wu, Jin-hui; Qian, Jin-liang","[μ-6,9-Bis(carboxylatomethyl)-3,12-bis(carboxymethyl)-3,6,9,12-tetraazatetradecanedioato]bis[aquacobalt(II)] tetrahydrate","Acta Crystallographica Section E","2013","69","2","m97","","10.1107/S1600536813000196","","","0.71073","Mokα","","0.0793","0.0532","","","0.1076","0.1172","","","","","","0.939","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237413","7.6272","0.0001","10.8453","0.0002","11.8454","0.0002","106.08","0.0008","96.2976","0.0008","108.431","0.0009","872.05","0.03","100","0.5","100","0.5","101.3","","","","","","","2","P -1","-P 1","2","","1-[3-(Naphthalen-1-yl)phenyl]naphthalene","","- C26 H18 -","- C26 H18 -","- C52 H36 -","2","1","TK5189","Tummala, Manorama; Dhar, Raj K.; Fronczek, Frank R.; Watkins, Steven F.","1-[3-(Naphthalen-1-yl)phenyl]naphthalene","Acta Crystallographica Section E","2013","69","2","o307","","10.1107/S1600536813002407","","","0.71073","MoKα","","","0.05","","","","0.1384","","","","","","1.046","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237414","6.377","0.002","6.642","0.002","12.979","0.005","79.669","0.01","79.963","0.011","64.911","0.008","486.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Hexaaquacobalt(II) 2,2'-[naphthalene-1,8-diylbis(oxy)]diacetate dihydrate","","- C14 H26 Co O14 -","- C14 H26 Co O14 -","- C14 H26 Co O14 -","1","0.5","VM2185","Shi, Hui Fang; Wu, Tao; Jiang, Peng Gang; Hao, Zhi; Zhang, Miao Miao","Hexaaquacobalt(II) 2,2'-[naphthalene-1,8-diylbis(oxy)]diacetate dihydrate","Acta Crystallographica Section E","2013","69","2","m103","m104","10.1107/S1600536813000512","","","0.71073","MoKα","","0.032","0.0308","","","0.0788","0.08","","","","","","1.088","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237415","6.6907","0.0013","9.166","0.002","11.839","0.002","78.628","0.008","78.352","0.009","79.054","0.009","688.6","0.2","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","5-(2,5-Dioxooxolan-3-yl)-8-methyl-3,3a,4,5-tetrahydro-1<i>H</i>- naphtho[1,2-<i>c</i>]furan-1,3-dione","","- C17 H14 O6 -","- C17 H14 O6 -","- C34 H28 O12 -","2","1","VM2186","Guo, Y. Z.; Liu, J. G.; Yang, S. Y.","5-(2,5-Dioxooxolan-3-yl)-8-methyl-3,3a,4,5-tetrahydro-1<i>H</i>-naphtho[1,2-<i>c</i>]furan-1,3-dione","Acta Crystallographica Section E","2013","69","2","o226","","10.1107/S1600536813000482","","","0.71073","MoKα","","0.0499","0.0456","","","0.1096","0.1128","","","","","","1.074","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237416","24.1739","0.0016","13.5238","0.0008","18.8108","0.0013","90","","103.215","0.002","90","","5986.8","0.7","223","2","223","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","{Bis[<i>N</i>,<i>N</i>'-dicyclohexyl-<i>N</i>'',<i>N</i>''-bis(trimethylsilyl)guanidinato-κ^2^<i>N</i>,<i>N</i>']neodymium(III)}di-μ-chlorido-[bis(tetrahydrofuran-κ<i>O</i>)lithium]","","- C46 H96 Cl2 Li N6 Nd O2 Si4 -","- C46 H96 Cl2 Li N6 Nd O2 Si4 -","- C184 H384 Cl8 Li4 N24 Nd4 O8 Si16 -","4","1","VN2064","Chi, Shu-Hui; Chen, Jue","{Bis[<i>N</i>,<i>N</i>'-dicyclohexyl-<i>N</i>'',<i>N</i>''-bis(trimethylsilyl)guanidinato-κ^2^<i>N</i>,<i>N</i>']neodymium(III)}di-μ-chlorido-[bis(tetrahydrofuran-κ<i>O</i>)lithium]","Acta Crystallographica Section E","2013","69","2","m121","","10.1107/S160053681300158X","","","0.71075","MoKα","","0.06","0.0505","","","0.1047","0.1106","","","","","","1.169","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237417","6.5948","0.0007","11.8018","0.0009","9.4692","0.0008","90","","96.52","0.01","90","","732.23","0.11","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Trisodium aluminium bis(arsenate)","","- Al As2 Na3 O8 -","- Al As2 Na3 O8 -","- Al4 As8 Na12 O32 -","4","1","VN2065","Fakhar Bourguiba, Noura; Zid, Mohamed Faouzi; Driss, Ahmed","Na~3~Al(AsO~4~)~2~","Acta Crystallographica Section E","2013","69","2","i14","","10.1107/S1600536813002213","","","0.71073","MoKα","","0.0247","0.0217","","","0.0569","0.0584","","","","","","1.085","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2237418","10.765","0.001","11.883","0.002","14.574","0.001","110.275","0.003","95.028","0.001","94.97","0.001","1728.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[[[triaqua[3-(4-carboxyphenoxy)phthalato- κ<i>O</i>^2^]manganese(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 4,4'-bipyridine monosolvate dihydrate]","","- C35 H34 Mn N4 O12 -","- C35 H34 Mn N4 O12 -","- C70 H68 Mn2 N8 O24 -","2","1","WM2704","Sun, Wei","<i>catena</i>-Poly[[[triaqua[3-(4-carboxyphenoxy)phthalato-κ<i>O</i>^2^]manganese(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 4,4'-bipyridine monosolvate dihydrate]","Acta Crystallographica Section E","2013","69","2","m124","","10.1107/S1600536813000585","","","0.71069","MoKα","","0.0405","0.0335","","","0.0913","0.0953","","","","","","1.068","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237419","7.2458","0.0001","22.2812","0.0002","9.6019","0.0001","90","","98.015","0.001","90","","1535.04","0.03","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetramethylammonium aquatrichloridooxalatostannate(IV) monohydrate","","- C6 H16 Cl3 N O6 Sn -","- C6 H16 Cl3 N O6 Sn -","- C24 H64 Cl12 N4 O24 Sn4 -","4","1","WM2712","Sow, Yaya; Diop, Libasse; Molloy, Kieran C.; Kociok-Köhn, Gabriele","Tetramethylammonium aquatrichloridooxalatostannate(IV) monohydrate","Acta Crystallographica Section E","2013","69","2","m106","m107","10.1107/S1600536813000895","","","0.71073","MoKα","","0.0333","0.0256","","","0.0588","0.0621","","","","","","1.082","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237420","14.0928","0.0005","12.6455","0.0003","21.2684","0.0006","90","","90.667","0.002","90","","3790","0.19","119.8","0.6","119.8","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Acetonyltriphenylphosphonium nitrate","","- C21 H20 N O4 P -","- C21 H20 N O4 P -","- C168 H160 N8 O32 P8 -","8","1","WM2713","Diop, Tidiane; Diop, Libasse; Kučeráková, Monika; Dušek, Michal","Acetonyltriphenylphosphonium nitrate","Acta Crystallographica Section E","2013","69","2","o303","","10.1107/S1600536813002110","","","1.5418","CuKα","","0.0381","0.0331","","","0.091","0.0941","","","","","","1.63","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237421","8.9765","0.0013","7.6431","0.0008","9.3451","0.0014","90","","91.888","0.018","90","","640.8","0.15","293","2","293","2","","","","","","","","3","P 1 c 1","P -2yc","7","dihydronium tetrachromate","Dihydronium tetrachromate(VI)","","- Cr4 H6 O15 -","- Cr4 O15 -","- Cr8 O30 -","2","1","WM2714","Kulikov, Vladislav; Meyer, Gerd","Dihydronium tetrachromate(VI), (H~3~O)~2~Cr~4~O~13~","Acta Crystallographica Section E","2013","69","2","i13","","10.1107/S1600536813001608","","","0.71073","MoKα","","0.0432","0.04","","","0.1072","0.11","","","","","","1.058","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237422","5.3599","0.0003","5.3599","0.0003","11.9425","0.0007","90","","90","","90","","343.09","0.03","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","lanthanum(III) molybdate(VI)","Lanthanum(III) <i>ortho</i>-tetraoxidomolybdate(VI)","","- La0.667 Mo O4 -","- La0.6676 Mo O4 -","- La2.6704 Mo4 O16 -","4","0.25","WM2715","Schustereit, Tanja; Schleid, Thomas; Hartenbach, Ingo","The defect scheelite-type lanthanum(III) <i>ortho</i>-oxidomolybdate(VI) La~0.667~[MoO~4~]","Acta Crystallographica Section E","2013","69","2","i7","","10.1107/S1600536813000731","","","0.71073","MoKα","","0.0339","0.0162","","","0.0289","0.0322","","","","","","0.982","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237423","8.6201","0.0004","8.6013","0.0004","14.7465","0.0007","90","","125.204","0.003","90","","893.39","0.08","290","1","290","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Trilithium divanadium(III) tris(orthophosphate)","","- Li3 O12 P3 V2 -","- Li3 O12 P3 V2 -","- Li12 O48 P12 V8 -","4","1","WM2716","Kee, Yongho; Yun, Hoseop","Reinvestigation of trilithium divanadium(III) tris(orthophosphate), Li~3~V~2~(PO~4~)~3~, based on single-crystal X-ray data","Acta Crystallographica Section E","2013","69","2","i11","i12","10.1107/S1600536813001499","","","0.71073","MoKα","","0.0301","0.0242","","","","0.062","","","","","","1.079","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237424","11.9233","0.0009","9.0768","0.0007","8.1737","0.0006","90","","90","","90","","884.6","0.12","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Dipotassium trichloridostannate(II) chloride monohydrate","","- Cl4 H2 K2 O Sn -","- Cl4 H2 K2 O Sn -","- Cl16 H8 K8 O4 Sn4 -","4","0.5","WM2717","Ye, Fei; Reuter, Hans","Redetermination of dipotassium trichloridostannate(II) chloride monohydrate","Acta Crystallographica Section E","2013","69","2","i10","","10.1107/S1600536813001372","","","0.71073","MoKα","","0.0152","0.0126","","","0.0271","0.0279","","","","","","1.116","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237425","7.8823","0.0002","12.7467","0.0002","13.6851","0.0003","90","","91.918","0.001","90","","1374.22","0.05","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(3-aminopyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)diaquacobalt(II)","","- C10 H12 Co N6 O6 -","- C10 H12 Co N6 O6 -","- C40 H48 Co4 N24 O24 -","4","0.5","WM2721","Bouchene, Rafika; Bouacida, Sofiane; Berrah, Fadila; Belhouas, Ratiba; Merazig, Hocine","Bis(3-aminopyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)diaquacobalt(II)","Acta Crystallographica Section E","2013","69","2","m129","m130","10.1107/S1600536813002183","","","0.71073","MoKα","","0.0636","0.034","","","0.0773","0.0824","","","","","","0.919","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237426","9.099","0.003","12.199","0.004","13.566","0.005","90","","104.905","0.005","90","","1455.1","0.9","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>Z</i>)-4-Bromo-<i>N</i>-{(<i>Z</i>)-3-[(4-bromo-2,6- diisopropylphenyl)imino]butan-2-ylidene}-2,6-diisopropylaniline","","- C28 H38 Br2 N2 -","- C28 H38 Br2 N2 -","- C56 H76 Br4 N4 -","2","0.5","XU5664","Zhang, Cun; Wu, Guo-Fan; Huang, Bao-Mei; Lu, Xiao-Quan","(<i>Z</i>)-4-Bromo-<i>N</i>-{(<i>Z</i>)-3-[(4-bromo-2,6-diisopropylphenyl)imino]butan-2-ylidene}-2,6-diisopropylaniline","Acta Crystallographica Section E","2013","69","2","o216","","10.1107/S160053681205194X","","","0.71073","MoKα","","0.114","0.0524","","","0.14","0.1787","","","","","","0.939","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237427","13.625","0.013","7.495","0.007","17.029","0.017","90","","90","","90","","1739","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(<i>E</i>)-4-Bromo-<i>N</i>-{(<i>E</i>)-3-[(4-bromo-2- methylphenyl)imino]butan-2-ylidene}-2-methylaniline","","- C18 H18 Br2 N2 -","- C18 H18 Br2 N2 -","- C72 H72 Br8 N8 -","4","0.5","XU5666","Yao, Jin-Li; Zhang, Xu; Li, Hong-Yan; Ye, Jian-Qing","(<i>E</i>)-4-Bromo-<i>N</i>-{(<i>E</i>)-3-[(4-bromo-2-methylphenyl)imino]butan-2-ylidene}-2-methylaniline","Acta Crystallographica Section E","2013","69","2","o199","","10.1107/S1600536812052087","","","0.71073","MoKα","","0.1264","0.0523","","","0.0884","0.1134","","","","","","1.047","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237428","9.17","0.0008","10.3863","0.001","11.9412","0.0011","98.133","0.007","90.854","0.006","91.841","0.007","1125.07","0.18","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","2-(2-Hydroxy-2-phenylethyl)-1-methylcyclopropan-1-ol","","- C12 H16 O2 -","- C12 H16 O2 -","- C48 H64 O8 -","4","2","XU5667","Mao, Hui; Tu, Ya-Wei; Li, Shi-Kun; Wang, Xiao-Juan; Wang, Peng-Peng","2-(2-Hydroxy-2-phenylethyl)-1-methylcyclopropan-1-ol","Acta Crystallographica Section E","2013","69","2","o189","","10.1107/S1600536812051768","","","0.71073","MoKα","","0.1497","0.0695","","","0.2026","0.2487","","","","","","1.043","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237429","8.557","0.007","9.212","0.008","9.367","0.008","91.18","0.014","96.215","0.014","111.136","0.014","683.2","1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Bis(2,2',2''-nitrilotriacetamide-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')nickel(II) dinitrate tetrahydrate","","- C12 H32 N10 Ni O16 -","- C12 H32 N10 Ni O16 -","- C12 H32 N10 Ni O16 -","1","0.5","XU5668","Deng, Xiao-Hui; Nie, Qi-Jun; Zhu, Feng-Juan","Bis(2,2',2''-nitrilotriacetamide-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')nickel(II) dinitrate tetrahydrate","Acta Crystallographica Section E","2013","69","2","m89","","10.1107/S160053681205177X","","","0.71073","MoKα","","0.0336","0.0317","","","0.087","0.0883","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237430","8.144","0.0003","12.308","0.0004","12.417","0.0004","86.894","0.003","75.163","0.003","79.529","0.003","1183.06","0.07","180","2","180","2","","","","","","","","5","P -1","-P 1","2","Diaqua(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)magnesium‒ 18-crown-6 (1/1)","Diaqua(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)magnesium‒ 1,4,7,10,13,16-hexaoxacyclooctadecane (1/1)","","- C56 H56 Mg N4 O8 -","- C56 H56 Mg N4 O8 -","- C56 H56 Mg N4 O8 -","1","0.5","XU5669","Ezzayani, Khaireddine; Nasri, Soumaya; Belkhiria, Mohamed Salah; Daran, Jean-Claude; Nasri, Habib","Diaqua(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)magnesium‒18-crown-6 (1/1)","Acta Crystallographica Section E","2013","69","2","m114","m115","10.1107/S1600536813001219","","","0.71073","MoKα","","0.0518","0.0444","","","0.1131","0.1184","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237431","17.094","0.002","5.4175","0.0007","16.31","0.002","90","","95.545","0.011","90","","1503.3","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Phenyl acridine-9-carboxylate","","- C20 H13 N O2 -","- C20 H13 N O2 -","- C80 H52 N4 O8 -","4","1","XU5671","Wera, Michał; Trzybiński, Damian; Krzymiński, Karol; Błażejowski, Jerzy","Phenyl acridine-9-carboxylate","Acta Crystallographica Section E","2013","69","2","o305","","10.1107/S1600536813002055","","","0.71073","MoKα","","0.1155","0.0729","","","0.1716","0.2031","","","","","","1.036","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237432","9.5934","0.0007","9.2266","0.0007","10.3565","0.0007","90","","96.172","0.004","90","","911.39","0.11","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","3,3'-dideoxy-myxochelin A","(<i>S</i>)-2,2'-Dihydroxy-<i>N</i>,<i>N</i>'-(6-hydroxyhexane- 1,5-diyl)dibenzamide","","- C20 H24 N2 O5 -","- C20 H24 N2 O5 -","- C40 H48 N4 O10 -","2","1","YK2084","Wilbrand, Sabine; Neis, Christian; Hegetschweiler, Kaspar","(<i>S</i>)-2,2'-Dihydroxy-<i>N</i>,<i>N</i>'-(6-hydroxyhexane-1,5-diyl)dibenzamide","Acta Crystallographica Section E","2013","69","2","o223","","10.1107/S1600536813000354","","","0.71073","MoKα","","0.0355","0.0309","","","0.0734","0.0759","","","","","","1.053","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237433","7.1236","0.0016","11.6305","0.0002","13.5496","0.0004","90","","90","","90","","1122.6","0.3","99.98","0.1","99.98","0.1","","","","","","","","5","P c c n","-P 2ab 2ac","56","Diaquabis(1<i>H</i>-imidazole-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>)cobalt(II)","","","- C8 H10 Co N4 O6 -","- C8 H10 Co N4 O6 -","- C32 H40 Co4 N16 O24 -","4","0.5","ZJ2099","Artetxe, Beñat; San Felices, Leire; Pache, Aroa; Reinoso, Santiago; Gutiérrez-Zorrilla, Juan M.","Diaquabis(1<i>H</i>-imidazole-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2013","69","2","m94","","10.1107/S1600536813000330","","","0.71073","MoKα","","0.0332","0.0273","","","0.06","0.0629","","","","","","1.084","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237434","5.6732","0.0004","23.257","0.002","7.4516","0.0005","90","","97.743","0.007","90","","974.21","0.13","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-Phenyl(pyridin-2-yl)methanone oxime","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C48 H40 N8 O4 -","4","1","ZJ2100","Rodríguez-Mora, Monserrath I.; Reyes-Martínez, Reyna; Flores-Alamo, Marcos; García, Juventino J.; Morales-Morales, David","A second monoclinic polymorph of (<i>E</i>)-phenyl(pyridin-2-yl)methanone oxime","Acta Crystallographica Section E","2013","69","2","o310","","10.1107/S1600536813002377","","","0.71073","MoKα","","0.0557","0.0417","","","0.0971","0.1068","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237435","11.3123","0.0012","4.7907","0.0004","15.1697","0.0016","90","","101.834","0.003","90","","804.63","0.14","298","2","298","2","","","","","","","","4","P 1 c 1","P -2yc","7","","(1<i>E</i>,4<i>E</i>)-1,5-Bis[2-(trifluoromethyl)phenyl]penta-1,4-dien-3-one","","- C19 H12 F6 O -","- C19 H12 F6 O -","- C38 H24 F12 O2 -","2","1","ZL2522","Park, Dong Ho; Ramkumar, V.; Parthiban, P.","(1<i>E</i>,4<i>E</i>)-1,5-Bis[2-(trifluoromethyl)phenyl]penta-1,4-dien-3-one","Acta Crystallographica Section E","2013","69","2","o177","","10.1107/S1600536812051586","","","0.71073","MoKα","","0.0589","0.0366","","","0.0821","0.0956","","","","","","1.038","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237436","11.8871","0.0009","31.824","0.002","18.5168","0.0014","90","","95.88","0.001","90","","6968","0.9","120","1","120","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","μ-2,3,5,6-Tetrakis(pyridin-2-yl)pyrazine-bis[(2,2':6',2''- terpyridine)ruthenium(II)] tetrakis(hexafluoridophosphate) acetonitrile tetrasolvate","","- C62 H50 F24 N16 P4 Ru2 -","- C62 H50 F24 N16 P4 Ru2 -","- C248 H200 F96 N64 P16 Ru8 -","4","1","ZL2523","Jude, Hershel; Scott, Brian L.; Rocha, Reginaldo C.","μ-2,3,5,6-Tetrakis(pyridin-2-yl)pyrazine-bis[(2,2':6',2''-terpyridine)ruthenium(II)] tetrakis(hexafluoridophosphate) acetonitrile tetrasolvate","Acta Crystallographica Section E","2013","69","2","m81","m82","10.1107/S1600536812051215","","","0.71073","MoKα","","0.082","0.0452","","","0.0888","0.1021","","","","","","1.103","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237437","5.843","0.002","9.383","0.003","10.126","0.004","97.209","0.012","96.014","0.013","100.703","0.019","536.5","0.3","170","2","170","2","","","","","","","","3","P -1","-P 1","2","","1,4,6,9-Tetra-<i>tert</i>-butyl-2,7-dioxatricyclo[6.3.0.0^3,6^]deca-3,8-diene","","- C24 H40 O2 -","- C24 H40 O2 -","- C24 H40 O2 -","1","0.5","ZL2528","Sorensen, Ted S.; Humayaun Kabir, S. M; Parvez, Masood","1,4,6,9-Tetra-<i>tert</i>-butyl-2,7-dioxatricyclo[6.3.0.0^3,6^]deca-3,8-diene","Acta Crystallographica Section E","2013","69","2","o204","","10.1107/S1600536813000147","","","0.71073","MoKα","","0.054","0.0408","","","0.0977","0.1043","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237438","9.7825","0.0006","10.6075","0.0006","16.8215","0.001","90","","90","","90","","1745.53","0.18","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","N-bac amine","<i>tert</i>-Butyl 4-(3,4-dichloroanilino)piperidine-1-carboxylate","","- C16 H22 Cl2 N2 O2 -","- C16 H22 Cl2 N2 O2 -","- C64 H88 Cl8 N8 O8 -","4","1","ZL2529","Mehr-un-Nisa; Munawar, Munawar Ali; Hall, Gabriel B.; Roberts, Sue A.; Hruby, Victor J.","<i>tert</i>-Butyl 4-(3,4-dichloroanilino)piperidine-1-carboxylate","Acta Crystallographica Section E","2013","69","2","o205","","10.1107/S1600536812051896","","","0.71073","MoKα","","0.0454","0.0339","","","0.0739","0.0786","","","","","","0.996","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237439","17.7622","0.0004","16.1667","0.0003","17.3787","0.0004","90","","98.045","0.001","90","","4941.29","0.18","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>',<i>N</i>''-Pentamethyl-<i>N</i>''-[3-(trimethylazaniumyl)propyl]guanidinium bis(tetraphenylborate)","","- C60 H70 B2 N4 -","- C60 H70 B2 N4 -","- C240 H280 B8 N16 -","4","1","ZL2530","Tiritiris, Ioannis","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>',<i>N</i>''-Pentamethyl-<i>N</i>''-[3-(trimethylazaniumyl)propyl]guanidinium bis(tetraphenylborate)","Acta Crystallographica Section E","2013","69","2","o292","","10.1107/S1600536813001992","","","0.71073","MoKα","","0.0727","0.0445","","","0.0947","0.1078","","","","","","1.018","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237440","11.248","0.0003","11.524","0.0003","14.164","0.0004","90.543","0.002","108.178","0.001","118.826","0.001","1499.73","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","<i>rac</i>-[2-(Dicyclohexylphosphanyl)phenyl](phenyl)phosphinic diisopropylamide‒borane hemihydrate","","- C60 H98 B2 N2 O3 P4 -","- C60 H98 B2 N2 O3 P4 -","- C60 H98 B2 N2 O3 P4 -","1","0.5","ZQ2191","Evans, Stephen J.; Renison, C. Alicia; Williams, D. Bradley G.; Muller, Alfred","<i>rac</i>-[2-(Dicyclohexylphosphanyl)phenyl](phenyl)phosphinic diisopropylamide‒borane hemihydrate","Acta Crystallographica Section E","2013","69","2","o282","o283","10.1107/S1600536813001839","","","0.71069","MoKα","","0.0777","0.0501","","","","0.1336","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237441","16.1206","0.0012","9.372","0.0007","14.6367","0.0011","90","","90","","90","","2211.3","0.3","273","2","273","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","Poly[bis(μ~2~-5-{4-[(1<i>H</i>-imidazol-1-yl)methyl]phenyl}tetrazolato)zinc]","","- C22 H18 N12 Zn -","- C22 H18 N12 Zn -","- C88 H72 N48 Zn4 -","4","0.5","ZQ2192","Song, Zhe","Poly[bis(μ~2~-5-{4-[(1<i>H</i>-imidazol-1-yl)methyl]phenyl}tetrazolato)zinc]","Acta Crystallographica Section E","2013","69","2","m85","","10.1107/S1600536812050672","","","0.71073","MoKα","","0.0323","0.0285","","","0.0786","0.0813","","","","","","1.069","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237442","6.6362","0.0008","11.384","0.003","13.022","0.003","99.64","0.03","103.61","0.02","92.44","0.017","939.2","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1<i>H</i>-Benzotriazol-1-yl 4-{(<i>E</i>)-[4-(dimethylamino)phenyl]diazenyl}benzoate","","- C21 H18 N6 O2 -","- C21 H18 N6 O2 -","- C42 H36 N12 O4 -","2","1","ZQ2193","El-Ghayoury, Abdelkrim; Zorina, Leokadiya; Khouili, Mostafa","1<i>H</i>-Benzotriazol-1-yl 4-{(<i>E</i>)-[4-(dimethylamino)phenyl]diazenyl}benzoate","Acta Crystallographica Section E","2013","69","2","o262","","10.1107/S1600536813000846","","","0.71073","MoKα","","0.1586","0.0619","","","0.1088","0.142","","","","","","1.035","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237443","5.6434","0.0004","9.2179","0.0006","16.5472","0.0009","90","","101.782","0.003","90","","842.65","0.09","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2<i>S</i>,4<i>R</i>)-2-[(1<i>R</i>)-1-(4-Bromophenyl)-2-nitroethyl]- 4-ethylcyclohexanone","","- C16 H20 Br N O3 -","- C16 H20 Br N O3 -","- C32 H40 Br2 N2 O6 -","2","1","ZQ2194","Zhang, Chi-Xiao; Zhang, Yan-Peng; Xia, Ai-Bao","(2<i>S</i>,4<i>R</i>)-2-[(1<i>R</i>)-1-(4-Bromophenyl)-2-nitroethyl]-4-ethylcyclohexanone","Acta Crystallographica Section E","2013","69","2","o263","","10.1107/S1600536813001426","","","0.71073","MoKα","","0.1233","0.0555","","","0.1306","0.1754","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237444","20.327","0.002","14.756","0.0015","18.9759","0.0019","90","","113.14","0.002","90","","5233.8","0.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","α-acetyl-α-parachlorobenzoylmethylenetris(<i>p</i>-tolyl)phosphorane","1-(4-Chlorophenyl)-2-[tris(4-methylphenyl)-λ^5^-phosphanylidene]butane- 1,3-dione","","- C31 H28 Cl O2 P -","- C31 H28 Cl O2 P -","- C248 H224 Cl8 O16 P8 -","8","1","ZS2244","Sabounchei, Seyyed Javad; Shahriary, Parisa; Hosseini Fashami, Faegheh; Morales-Morales, David; Hernandez-Ortega, Simon","1-(4-Chlorophenyl)-2-[tris(4-methylphenyl)-λ^5^-phosphanylidene]butane-1,3-dione","Acta Crystallographica Section E","2013","69","2","o183","","10.1107/S1600536812051689","","","0.71073","MoKα","","0.0569","0.0397","","","0.0937","0.0985","","","","","","1","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237445","7.7529","0.0004","11.279","0.0007","11.7563","0.0011","117.232","0.003","98.475","0.003","101.301","0.002","862.6","0.11","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","<i>rac</i>-4a,10-<i>cis</i>,10b,5c-<i>trans</i>-5-(7-Methyl-2-oxo-2<i>H</i>-chromen-4-yl)-3,4,4a,5,6,10b-hexahydro-2<i>H</i>-pyrano[3,2-<i>c</i>]quinoline","","- C22 H21 N O3 -","- C22 H21 N O3 -","- C44 H42 N2 O6 -","2","1","ZS2247","Kayalvizhi, M.; Vasuki, G.; Samant, Shriniwas D.; Sanap, Kailas K.","<i>rac</i>-4a,10b-<i>cis</i>,10b,5c-<i>trans</i>-5-(7-Methyl-2-oxo-2<i>H</i>-chromen-4-yl)-3,4,4a,5,6,10b-hexahydro-2<i>H</i>-pyrano[3,2-<i>c</i>]quinoline","Acta Crystallographica Section E","2013","69","2","o280","","10.1107/S1600536813001876","","","0.71073","MoKα","","0.079","0.0545","","","0.1484","0.1767","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237446","10.6848","0.0003","10.6848","0.0003","47.9935","0.0017","90","","90","","90","","5479.2","0.3","147","2","147","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","2,2'-[(1<i>S</i>,2<i>S</i>)-1,2-Bis(2-hydroxyphenyl)ethane-1,2-diyl]bis(isoindoline-1,3-dione) ethanol monosolvate hemihydrate","","- C32 H27 N2 O7.5 -","- C32 H27 N2 O7.5 -","- C256 H216 N16 O60 -","8","1","AA2082","Chin, Jik; Koh, Dongsoo; Lough, Alan J.","2,2'-[(1<i>S</i>,2<i>S</i>)-1,2-Bis(2-hydroxyphenyl)ethane-1,2-diyl]bis(isoindoline-1,3-dione) ethanol monosolvate hemihydrate","Acta Crystallographica Section E","2013","69","3","o406","o407","10.1107/S1600536813003978","","","1.54178","CuKα","","0.0289","0.0287","","","0.0751","0.0754","","","","","","1.12","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237447","9.414","0.001","14.226","0.002","9.551","0.001","90","","117.26","0.007","90","","1137","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(Pyridine-2-aldoximato-κ^2^<i>N</i>,<i>N</i>')bis[2-(pyridin-2-yl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]iridium(III)","","- C28 H21 Ir N4 O -","- C28 H21 Ir N4 O -","- C56 H42 Ir2 N8 O2 -","2","1","BG2497","Pal, Satyanarayan; Singh, Bimal Chandra","(Pyridine-2-aldoximato-κ^2^<i>N</i>,<i>N</i>')bis[2-(pyridin-2-yl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]iridium(III)","Acta Crystallographica Section E","2013","69","3","m159","","10.1107/S1600536813004297","","","0.71073","MoKα","","0.0479","0.0366","","","0.0595","0.0627","","","","","","0.964","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237448","14.53","0.0015","16.819","0.0014","13.8491","0.0017","90","","111.656","0.013","90","","3145.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(1<i>H</i>-Benzimidazol-2-yl)iminomethyl]-4,6-dibromophenol ethanol hemisolvate","","- C30 H24 Br4 N6 O3 -","- C30 H24 Br4 N6 O3 -","- C120 H96 Br16 N24 O12 -","4","1","BH2461","Liu, Jie; Liu, Zheng; Yuan, Shuai","2-[(1<i>H</i>-Benzimidazol-2-yl)iminomethyl]-4,6-dibromophenol ethanol hemisolvate","Acta Crystallographica Section E","2013","69","3","o362","","10.1107/S1600536813002031","","","0.71073","MoKα","","0.089","0.051","","","0.1133","0.1333","","","","","","1.034","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237449","12.1455","0.0003","3.9884","0.0001","14.3837","0.0004","90","","90","","90","","696.76","0.03","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","BaEr2S4","Barium dierbium(III) tetrasulfide","","- Ba Er2 S4 -","- Ba Er2 S4 -","- Ba4 Er8 S16 -","4","0.5","BR2222","Mesbah, Adel; Stojko, Wojciech; Ibers, James. A","Barium dierbium(III) tetrasulfide","Acta Crystallographica Section E","2013","69","3","i17","","10.1107/S1600536813003541","","","0.71073","MoKα","","0.0169","0.0166","","","0.0491","0.0502","","","","","","1.866","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237450","8.2088","0.0005","8.4755","0.0005","13.7031","0.0008","80.669","0.003","81.832","0.003","76.681","0.003","910","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5-[1-(4-Methylphenyl)-2-nitrobutyl]-4-phenyl-1,2,3-selenadiazole","","- C19 H19 N3 O2 Se -","- C19 H19 N3 O2 Se -","- C38 H38 N6 O4 Se2 -","2","1","BT6877","Sugumar, P.; Sankari, S.; Manisankar, P.; Ponnuswamy, M. N.","5-[1-(4-Methylphenyl)-2-nitrobutyl]-4-phenyl-1,2,3-selenadiazole","Acta Crystallographica Section E","2013","69","3","o430","","10.1107/S1600536813004662","","","0.71073","MoKα","","0.0462","0.0314","","","0.0769","0.0825","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237451","27.2997","0.0015","9.7923","0.0006","15.8557","0.001","90","","90","","90","","4238.7","0.4","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","Methyl (1<i>R</i>,3'<i>S</i>)-1',1''-dimethyl-2,2''-dioxo-2<i>H</i>-dispiro[acenaphthylene-1,2'-pyrrolidine-3',3''-indoline]-4'-carboxylate","","- C26 H22 N2 O4 -","- C26 H22 N2 O4 -","- C208 H176 N16 O32 -","8","1","BT6885","Ganesh, Gnanavelu; Yuvaraj, PanneerSelvam; Kannan, Piskala Subburaman; Reddy, Boreddy Siva Rami; SubbiahPandi, Arunachalathevar","A diastereomer of methyl (1<i>R</i>,3'<i>S</i>)-1',1''-dimethyl-2,2''-dioxo-2<i>H</i>-dispiro[acenaphthylene-1,2'-pyrrolidine-3',3''-indoline]-4'-carboxylate","Acta Crystallographica Section E","2013","69","3","o441","","10.1107/S1600536813004868","","","0.71073","MoKα","","0.0916","0.0467","","","0.1117","0.1354","","","","","","1.015","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237452","7.8847","0.0004","8.0627","0.0004","12.6526","0.0005","102.78","0.003","99.936","0.004","92.58","0.004","769.76","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>cis</i>-Chlorido(ethylamine)bis(propane-1,3-diamine)cobalt(III) dichloride","","- C8 H27 Cl3 Co N5 -","- C8 H27 Cl3 Co N5 -","- C16 H54 Cl6 Co2 N10 -","2","1","BT6888","Maheshwaran, Velusamy; Thiruselvam, Viswanathan; Manjunathan, Munisamy; Anbalagan, Krishnamoorthy; Ponnuswamy, Mondikalipudur Nanjappa Gounder","<i>cis</i>-Chlorido(ethylamine)bis(propane-1,3-diamine)cobalt(III) dichloride","Acta Crystallographica Section E","2013","69","3","m170","m171","10.1107/S1600536813004650","","","0.71073","MoKα","","0.0319","0.0249","","","0.0587","0.0601","","","","","","0.993","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237453","10.903","0.0005","11.8792","0.0005","22.4457","0.001","90","","93.963","0.003","90","","2900.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 11-hydroxy-9-[1-(4-methoxyphenyl)-4-oxo-3-phenylazetidin-2-yl]-18-oxo-10-oxa-2-azapentacyclo[9.7.0.0^1,8^.0^2,6^.0^12,17^]octadeca-12(17),13,15-triene-8-carboxylate","","- C34 H32 N2 O7 -","- C34 H32 N2 O7 -","- C136 H128 N8 O28 -","4","1","BT6889","Suhitha, Sivasubramanian; Srinivasan, Thothadri; Rajesh, Raju; Raghunathan, Raghavachary; Velmurugan, Devadasan","Methyl 11-hydroxy-9-[1-(4-methoxyphenyl)-4-oxo-3-phenylazetidin-2-yl]-18-oxo-10-oxa-2-azapentacyclo[9.7.0.0^1,8^.0^2,6^.0^12,17^]octadeca-12(17),13,15-triene-8-carboxylate","Acta Crystallographica Section E","2013","69","3","o438","o439","10.1107/S1600536813004789","","","0.71073","MoKα","","0.0744","0.0465","","","0.111","0.1267","","","","","","1.016","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237454","9.0976","0.0006","16.9797","0.0011","17.2713","0.0009","62.59","0.002","88.44","0.002","78.092","0.002","2310.4","0.2","293","2","295","2","","","","","","","","3","P -1","-P 1","2","","(3<i>E</i>)-11,16-Dioxatricyclo[15.4.0.0^5,10^]henicosa-1(21),3,5,7,9,17,19- heptaen-2-one","","- C19 H14 O3 -","- C19 H18.001 O3.001 -","- C114 H108.006 O18.006 -","6","3","BX2434","Ganesh, Gnanavelu; Purushothaman, Santhanagopalan; Kannan, Piskala Subburaman; Raghunathan, Raghavachary; SubbiahPandi, Arunachalathevar","(3<i>E</i>)-11,16-Dioxatricyclo[15.4.0.0^5,10^]henicosa-1(21),3,5,7,9,17,19-heptaen-2-one","Acta Crystallographica Section E","2013","69","3","o442","","10.1107/S1600536813000299","","","0.71073","MoKα","","0.0905","0.0445","","","0.112","0.1431","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237455","12.5963","0.0008","14.301","0.0008","9.8693","0.0008","90","","108.672","0.008","90","","1684.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-(2,5-Difluorobenzyl)[(2-ethoxynaphthalen-1-yl)methylidene]amine","","- C20 H17 F2 N O -","- C20 H17 F2 N O -","- C80 H68 F8 N4 O4 -","4","1","CV5376","Pekdemir, Merve; Işık, Şamil; Macit, Mustafa; Alaman Ağar, Ayşen; Soylu, Mustafa Serkan","(<i>E</i>)-(2,5-Difluorobenzyl)[(2-ethoxynaphthalen-1-yl)methylidene]amine","Acta Crystallographica Section E","2013","69","3","o361","","10.1107/S1600536813001967","","","0.71073","MoKα","","0.0869","0.0583","","","0.1307","0.151","","","","","","1.062","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237456","14.1341","0.0016","14.1341","0.0016","14.1341","0.0016","90","","90","","90","","2823.6","0.6","295","2","295","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","Poly[tris(dimethylformamide)(μ~3~-2,4,6-triiodobenzene-1,3,5-tricarboxylato)samarium(III)]","","- C18 H21 I3 N3 O9 Sm -","- C18 H21 I3 N3 O9 Sm -","- C72 H84 I12 N12 O36 Sm4 -","4","0.333333","CV5378","Yan, Bin; Sheng, Daopeng; Yang, Yanzhao","Poly[tris(dimethylformamide)(μ~3~-2,4,6-triiodobenzene-1,3,5-tricarboxylato)samarium(III)]","Acta Crystallographica Section E","2013","69","3","m149","","10.1107/S1600536813003358","","","0.71073","MoKα","","0.0233","0.021","","","0.0475","0.049","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237457","5.679","0.001","7.326","0.0012","35.02","0.004","93.74","0.01","91.877","0.006","94.436","0.001","1448.5","0.4","113","2","113","2","","","","","","","","3","P -1","-P 1","2","","(4-Methoxyphenyl)(4-propylcyclohexyl)methanone","","- C17 H24 O2 -","- C17 H24 O2 -","- C68 H96 O8 -","4","2","CV5385","Wang, Ling; Chang, Zi-Qian; Zhang, Jie; Li, Cheng-Min","(4-Methoxyphenyl)(4-propylcyclohexyl)methanone","Acta Crystallographica Section E","2013","69","3","o404","","10.1107/S1600536813003644","","","0.71075","MoKα","","0.0566","0.0448","","","0.1193","0.1292","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237458","27.447","0.013","8.886","0.004","28.861","0.014","90","","98.348","0.008","90","","6964","6","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1-(5-Bromo-2-chlorophenyl)-2,2-dichloro-1-(4-ethoxyphenyl)cyclopropane","","- C17 H14 Br Cl3 O -","- C17 H14 Br Cl3 O -","- C272 H224 Br16 Cl48 O16 -","16","2","CV5386","Han, Shuwen; Shi, Yongheng; Yuli, Wang; Zhao, Guilong; Xu, Weiren","1-(5-Bromo-2-chlorophenyl)-2,2-dichloro-1-(4-ethoxyphenyl)cyclopropane","Acta Crystallographica Section E","2013","69","3","o405","","10.1107/S1600536813003735","","","0.71073","MoKα","","0.0811","0.0674","","","0.1688","0.1801","","","","","","1.092","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237459","26.1146","0.0013","9.6961","0.0004","20.5638","0.0009","90","","121.592","0.0015","90","","4435.3","0.4","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(<i>E</i>)-2,2'-[3-(4-Fluorophenyl)prop-2-ene-1,1-diyl]bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one)","","- C25 H29 F O4 -","- C25 H29 F O4 -","- C200 H232 F8 O32 -","8","1","CV5387","Cha, Joo Hwan; Min, Sun-Joon; Cho, Yong Seo; Lee, Jae Kyun; Park, Junghwan","(<i>E</i>)-2,2'-[3-(4-Fluorophenyl)prop-2-ene-1,1-diyl]bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one)","Acta Crystallographica Section E","2013","69","3","o397","","10.1107/S1600536813004364","","","0.71075","MoKα","","","0.048","","","","0.158","","","","","","1.089","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237460","12.1588","0.0009","10.4087","0.0008","16.3165","0.0012","90","","92.72","0.001","90","","2062.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","{[(1<i>Z</i>)-3-Chloro-1<i>H</i>-isoindol-1-ylidene]methyl}dimethylamine","","- C11 H11 Cl N2 -","- C11 H11 Cl N2 -","- C88 H88 Cl8 N16 -","8","2","CV5388","Wang, Zhao-Yun; Yu, Chang-Jiang","{[(1<i>Z</i>)-3-Chloro-1<i>H</i>-isoindol-1-ylidene]methyl}dimethylamine","Acta Crystallographica Section E","2013","69","3","o448","","10.1107/S160053681300500X","","","0.71073","MoKα","","0.0375","0.0323","","","0.0871","0.0923","","","","","","1.022","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237461","7.9801","0.0008","18.9087","0.0014","12.6222","0.001","90","","104.279","0.0009","90","","1845.8","0.3","203","2","203","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","<i>anti</i>-2,2,3,3,6,6,7,7,10,10,11,11,14,14,15,15-Hexadecamethyl-2,3,6,7,10,11,14,15-octasilapentacyclo[10.4.2.2^4,9^.0^5,8^.0^13,16^]icosa-1(17),4,8,12(18),13(16),19-hexaene","","- C28 H52 Si8 -","- C28 H52 Si8 -","- C56 H104 Si16 -","2","0.5","DS2224","Toma, Yuki; Otsuka, Kyohei; Kyushin, Soichiro","<i>anti</i>-2,2,3,3,6,6,7,7,10,10,11,11,14,14,15,15-Hexadecamethyl-2,3,6,7,10,11,14,15-octasilapentacyclo[10.4.2.2^4,9^.0^5,8^.0^13,16^]icosa-1(17),4,8,12(18),13(16),19-hexaene","Acta Crystallographica Section E","2013","69","3","o341","","10.1107/S1600536813002584","","","0.71073","MoKα","","0.0293","0.0291","","","0.0754","0.0756","","","","","","1.109","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237462","12.697","0.005","9.179","0.005","7.662","0.005","90","0.005","123.315","0.005","90","0.005","746.2","0.7","90","2","90","2","","","","","","","","4","C 1 c 1","C -2yc","9","","2,4-Dinitrophenylhydrazine","","- C6 H6 N4 O4 -","- C6 H6 N4 O4 -","- C24 H24 N16 O16 -","4","1","DS2226","Amimoto, Kiichi; Nishiguchi, Hiromitsu","A polymorph of 2,4-dinitrophenylhydrazine","Acta Crystallographica Section E","2013","69","3","o425","","10.1107/S1600536813004571","","","0.71069","MoKα","","0.0271","0.027","","","","0.0722","","","","","","1.062","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237463","16.109","0.002","7.2931","0.0011","12.8708","0.0017","90","","90","","90","","1512.1","0.4","296","2","296","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","4-(1<i>H</i>-Tetrazol-5-yl)benzene-1,3-diol","","- C7 H6 N4 O2 -","- C7 H6 N4 O2 -","- C56 H48 N32 O16 -","8","1","FF2096","Kim, Youngjo","4-(1<i>H</i>-Tetrazol-5-yl)benzene-1,3-diol","Acta Crystallographica Section E","2013","69","3","o380","","10.1107/S160053681300411X","","","0.71073","MoKα","","0.1431","0.0568","","","0.1189","0.1676","","","","","","1.049","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237464","4.6082","0.0003","10.4219","0.0006","26.4468","0.0017","90","","90.428","0.001","90","","1270.1","0.14","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(3-Nitrobenzyl)-4<i>H</i>-chromen-4-one","","- C16 H11 N O4 -","- C16 H11 N O4 -","- C64 H44 N4 O16 -","4","1","FF2097","Gopaul, Kaalin; Koorbanally, Neil Anthony; Shaikh, Mahidansha; Su, Hong; Ramjugernath, Deresh","3-(3-Nitrobenzyl)-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2013","69","3","o364","","10.1107/S1600536813003589","","","0.71073","MoKα","","0.0691","0.0469","","","0.1229","0.1379","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237465","7.454","0.003","8.07","0.004","12.078","0.005","81.449","0.01","74.676","0.01","88.062","0.013","692.9","0.5","93","","93","","","","","","","","","4","P -1","-P 1","2","","<i>N</i>,<i>N</i>-Bis(4-nitrophenyl)acetamide","","- C14 H11 N3 O5 -","- C14 H11 N3 O5 -","- C28 H22 N6 O10 -","2","1","FF2098","Nanaura, Kokichi; Okuno, Tsunehisa","<i>N</i>,<i>N</i>-Bis(4-nitrophenyl)acetamide","Acta Crystallographica Section E","2013","69","3","o457","","10.1107/S1600536813005175","","","0.71075","MoKα","","","0.0526","","","","0.1384","","","","","","1.063","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237466","18.4688","0.001","11.294","0.0006","10.9676","0.0005","90","","96.082","0.005","90","","2274.8","0.2","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 6-(6-methoxynaphthalen-2-yl)-4-(naphthalen-2-yl)-2-oxocyclohex-3-ene-1-carboxylate","","- C30 H26 O4 -","- C30 H26 O4 -","- C120 H104 O16 -","4","1","FJ2612","Kaur, Manpreet; Jasinski, Jerry P.; Keeley, Amanda C.; Yathirajan, H. S.; Mayekar, Anil N.","Ethyl 6-(6-methoxynaphthalen-2-yl)-4-(naphthalen-2-yl)-2-oxocyclohex-3-ene-1-carboxylate","Acta Crystallographica Section E","2013","69","3","o352","","10.1107/S1600536813002857","","","1.54184","CuKα","","0.0709","0.0548","","","0.1559","0.1661","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237467","7.9103","0.0005","8.6054","0.0007","11.8779","0.0007","92.834","0.006","92.448","0.005","115.822","0.007","725.06","0.1","123.01","0.1","123.01","0.1","","","","","","","","3","P -1","-P 1","2","","Methyl 3',4',5'-trimethoxybiphenyl-4-carboxylate","","- C17 H18 O5 -","- C17 H18 O5 -","- C34 H36 O10 -","2","1","FJ2614","Lahtinen, Manu; Nättinen, Kalle; Nummelin, Sami","Methyl 3',4',5'-trimethoxybiphenyl-4-carboxylate","Acta Crystallographica Section E","2013","69","3","o383","","10.1107/S1600536813004133","","","1.5418","CuKα","","0.0364","0.0341","","","0.0937","0.096","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237468","14.7121","0.0015","17.5133","0.0019","28.912","0.003","90","","90","","90","","7449.4","1.4","296","2","296","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","5,17-Diformyl-25,26,27,28-tetrapropoxycalix[4]arene","","- C42 H48 O6 -","- C42 H48 O6 -","- C336 H384 O48 -","8","1","FJ2615","Li, Zhengyi; Ma, Hongzhao; Lai, Yuan; Chen, Liang; Sun, Xiaoqiang","5,17-Diformyl-25,26,27,28-tetrapropoxycalix[4]arene","Acta Crystallographica Section E","2013","69","3","o424","","10.1107/S1600536813004625","","","0.71073","MoKα","","0.1179","0.0655","","","0.1903","0.22","","","","","","1.001","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237469","6.099","0.0009","7.1622","0.0016","16.2408","0.0018","96.589","0.014","91.472","0.011","112.493","0.018","649.3","0.2","123.01","0.1","123.01","0.1","","","","","","","","3","P -1","-P 1","2","","Methyl 3',5'-dimethoxybiphenyl-4-carboxylate","","- C16 H16 O4 -","- C16 H16 O4 -","- C32 H32 O8 -","2","1","FJ2616","Lahtinen, Manu; Nättinen, Kalle; Nummelin, Sami","Methyl 3',5'-dimethoxybiphenyl-4-carboxylate","Acta Crystallographica Section E","2013","69","3","o460","","10.1107/S1600536813005333","","","1.5418","CuKα","","0.0477","0.0399","","","0.1021","0.1106","","","","","","1.053","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237470","5.4849","0.0011","14.302","0.002","18.354","0.003","111.4","0.02","90.35","0.02","94.03","0.02","1336.4","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1,4-Bis(pyridin-4-yl)buta-1,3-diyne‒1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1)","","- C22 H8 F16 I2 N2 -","- C22 H8 F16 I2 N2 -","- C44 H16 F32 I4 N4 -","2","1","FY2080","Cavallo, Gabriella; Marras, Giovanni; Metrangolo, Pierangelo; Pilati, Tullio; Terraneo, Giancarlo","The halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne‒1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1)","Acta Crystallographica Section E","2013","69","3","o328","o329","10.1107/S1600536813001888","","","0.71073","MoKα","","0.053","0.0386","","","0.1047","0.1135","","","","","","1.018","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237471","12.333","0.0009","18.2182","0.0014","18.149","0.0014","90","","97.253","0.001","90","","4045.2","0.5","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Di-μ-acetato-κ^4^<i>O</i>:<i>O</i>'-μ-oxido-κ^2^<i>O</i>:<i>O</i>'-bis[<i>cis</i>-(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')-<i>trans</i>-(pyridine-κ<i>N</i>)ruthenium(III)] bis(hexafluoridophosphate)","","- C34 H32 F12 N6 O5 P2 Ru2 -","- C34 H32 F12 N6 O5 P2 Ru2 -","- C136 H128 F48 N24 O20 P8 Ru8 -","4","1","GG2109","Ido, Yohei; Fujihara, Takashi; Nagasawa, Akira","Di-μ-acetato-κ^4^<i>O</i>:<i>O</i>'-μ-oxido-κ^2^<i>O</i>:<i>O</i>'-bis[<i>cis</i>-(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')-<i>trans</i>-(pyridine-κ<i>N</i>)ruthenium(III)] bis(hexafluoridophosphate)","Acta Crystallographica Section E","2013","69","3","m145","m146","10.1107/S1600536813003334","","","0.71073","MoKα","","0.031","0.024","","","0.0601","0.0632","","","","","","1.024","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237472","5.4854","0.0003","7.3498","0.0005","12.1871","0.0007","90","","90","","90","","491.34","0.05","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3-Methylenedihydrofuran-2,5-dione","3-Methylideneoxolane-2,5-dione","","- C5 H4 O3 -","- C5 H4 O3 -","- C20 H16 O12 -","4","1","GG2110","Beginn, Uwe; Frosinn, Martin; Reichelt, Martin; Reuter, Hans","3-Methylideneoxolane-2,5-dione","Acta Crystallographica Section E","2013","69","3","o321","","10.1107/S1600536813002924","","","0.71073","MoKα","","0.0324","0.0258","","","0.062","0.0648","","","","","","1.101","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237473","9.799","0.0002","10.7316","0.0004","13.7395","0.0004","110.797","0.003","100.338","0.002","96.323","0.002","1304.81","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl 4-(4-fluoroanilino)-1,2,6-tris(4-fluorophenyl)-1,2,5,6-tetrahydropyridine-3-carboxylate","","- C31 H24 F4 N2 O2 -","- C31 H24 F4 N2 O2 -","- C62 H48 F8 N4 O4 -","2","1","GK2551","Anthal, Sumati; Brahmachari, Goutam; Das, Suvankar; Kant, Rajni; Gupta, Vivek K.","Methyl 4-(4-fluoroanilino)-1,2,6-tris(4-fluorophenyl)-1,2,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E","2013","69","3","o373","o374","10.1107/S160053681300370X","","","0.71073","MoKα","","0.0731","0.0461","","","0.1052","0.1184","","","","","","1.047","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237474","14.7196","0.0002","8.4891","0.0001","28.1096","0.0004","90","","90","","90","","3512.47","0.08","150","2","150","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C16 H16 F2 N6 O5 -","- C16 H16 F2 N6 O5 -","- C128 H128 F16 N48 O40 -","8","1","GK2552","Kastelic, Jože; Kikelj, Danijel; Leban, Ivan; Lah, Nina","Fluconazole‒malonic acid (1/1)","Acta Crystallographica Section E","2013","69","3","o378","o379","10.1107/S1600536813003656","","","0.71073","MoKα","","0.0575","0.0382","","","0.0898","0.0997","","","","","","1.028","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237475","10.9512","0.0002","15.883","0.0003","11.2184","0.0002","90","","92.46","0.001","90","","1949.51","0.06","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2,7-Dimethoxynaphthalen-1-yl)(4-phenoxyphenyl)methanone","","- C25 H20 O4 -","- C25 H20 O4 -","- C100 H80 O16 -","4","1","GK2553","Sasagawa, Kosuke; Sakamoto, Rei; Hijikata, Daichi; Yonezawa, Noriyuki; Okamoto, Akiko","(2,7-Dimethoxynaphthalen-1-yl)(4-phenoxyphenyl)methanone","Acta Crystallographica Section E","2013","69","3","o440","","10.1107/S1600536813004820","","","1.54187","CuKα","","0.0406","0.0373","","","0.0946","0.0974","","","","","","1.046","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237476","10.0851","0.0006","12.434","0.0008","14.2414","0.001","113.405","0.006","102.233","0.005","101.194","0.005","1522.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 2,6-bis(4-chlorophenyl)-4-(4-methylanilino)-1-(4-methylphenyl)-1,2,5,6-tetrahydropyridine-3-carboxylate","","- C34 H32 Cl2 N2 O2 -","- C34 H32 Cl2 N2 O2 -","- C68 H64 Cl4 N4 O4 -","2","1","GK2555","Anthal, Sumati; Brahmachari, Goutam; Das, Suvankar; Kant, Rajni; Gupta, Vivek K.","Ethyl 2,6-bis(4-chlorophenyl)-4-(4-methylanilino)-1-(4-methylphenyl)-1,2,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E","2013","69","3","o454","o455","10.1107/S1600536813005126","","","0.71073","MoKα","","0.1481","0.0529","","","0.0804","0.1093","","","","","","0.893","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237477","8.875","0.003","17.266","0.005","9.174","0.003","90","","95.401","0.015","90","","1399.5","0.8","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(4-Methoxybenzoyl)-6-nitrocoumarin","","- C17 H11 N O6 -","- C17 H11 N O6 -","- C68 H44 N4 O24 -","4","1","GO2080","Vazquez-Rodriguez, Saleta; Uriarte, Eugenio; Santana, Lourdes","3-(4-Methoxybenzoyl)-6-nitrocoumarin","Acta Crystallographica Section E","2013","69","3","o345","","10.1107/S1600536813002948","","","0.7107","MoKα","","0.0651","0.0431","","","0.1111","0.1258","","","","","","0.914","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237478","8.3184","0.0004","13.1554","0.0006","12.0452","0.0005","90","","109.959","0.005","90","","1238.96","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Acetamidophenoxy)-2-methylpropanoic acid","","- C12 H15 N O4 -","- C12 H15 N O4 -","- C48 H60 N4 O16 -","4","1","GW2131","Navarrete-Vázquez, Gabriel; Colín-Lozano, Blanca; Tlahuext, Hugo; Tapia-Benavides, Antonio R.","2-(4-Acetamidophenoxy)-2-methylpropanoic acid","Acta Crystallographica Section E","2013","69","3","o443","","10.1107/S1600536813004856","","","0.71073","MoKα","","0.0497","0.0365","","","0.0897","0.098","","","","","","1.037","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237479","8.59506","0.00018","9.4435","0.0002","18.264","0.0004","90","","92.614","0.002","90","","1480.9","0.05","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3,3'-(1-Oxopropane-1,3-diyl)bis(1,3-thiazolidine-2-thione) chlorobenzene hemisolvate","","- C12 H14.5 Cl0.5 N2 O S4 -","- C9 H12 N2 O S4 -","- C36 H48 N8 O4 S16 -","4","1","HB7002","Franzel, Christine; Purdy, Andrew; Butcher, Ray J.","3,3'-(1-Oxopropane-1,3-diyl)bis(1,3-thiazolidine-2-thione) chlorobenzene hemisolvate","Acta Crystallographica Section E","2013","69","3","o375","","10.1107/S1600536813003292","","","1.54184","CuKα","","0.05","0.0436","","","0.1118","0.1156","","","","","","1.051","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237480","17.55","0.003","8.0828","0.0012","15.425","0.002","90","","100.558","0.002","90","","2151","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[bis(1,3-dimethylimidazolidin-2-one)(μ~2~-2,5-dioxidoterephthalato)zirconium(IV)]","","- C18 H22 N4 O8 Zr -","- C18 H22 N4 O8 Zr -","- C72 H88 N16 O32 Zr4 -","4","0.5","HB7025","Maercz, Matthias; Wragg, David Stephen; Dietzel, Pascal Daniel Croumbie; Fjellvåg, Helmer","Poly[bis(1,3-dimethylimidazolidin-2-one)(μ~2~-2,5-dioxidoterephthalato)zirconium(IV)]","Acta Crystallographica Section E","2013","69","3","m152","","10.1107/S1600536813003449","","","0.71073","MoKα","","0.0539","0.0377","","","0.0871","0.0956","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237481","18.761","0.002","8.4049","0.001","14.8816","0.0017","90","","102.239","0.001","90","","2293.3","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[bis(1,3-dimethyl-1,3-diazinan-2-one)(2,5-dioxidoterephthalato)zirconium(IV)]","","- C20 H26 N4 O8 Zr -","- C20 H26 N4 O8 Zr -","- C80 H104 N16 O32 Zr4 -","4","0.5","HB7026","Maercz, Matthias; Wragg, David Stephen; Dietzel, Pascal Daniel Croumbie; Fjellvåg, Helmer","Poly[bis(1,3-dimethyl-1,3-diazinan-2-one)(2,5-dioxidoterephthalato)zirconium(IV)]","Acta Crystallographica Section E","2013","69","3","m153","","10.1107/S1600536813003437","","","0.71073","MoKα","","0.0445","0.0377","","","0.0911","0.0961","","","","","","1.071","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237482","11.608","0.002","24.157","0.004","11.354","0.002","90","","114.38","0.002","90","","2899.9","0.9","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis{2-bromo-4-chloro-6-[(<i>E</i>)-(2,6-dimethylphenyl)iminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>}cobalt(II)","","- C30 H24 Br2 Cl2 Co N2 O2 -","- C30 H24 Br2 Cl2 Co N2 O2 -","- C120 H96 Br8 Cl8 Co4 N8 O8 -","4","1","HB7032","Zhu, Gang; Jiao, Bao-Juan","Bis{2-bromo-4-chloro-6-[(<i>E</i>)-(2,6-dimethylphenyl)iminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>}cobalt(II)","Acta Crystallographica Section E","2013","69","3","m156","","10.1107/S1600536813003747","","","0.71073","MoKα","","0.053","0.0438","","","0.1126","0.1194","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237483","13.2407","0.0017","11.9355","0.0016","9.8644","0.0013","90","","101.158","0.001","90","","1529.4","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis{5-(pyridin-2-yl-κ<i>N</i>)-3-[4-(pyridin-4-yl)phenyl]-1<i>H</i>-1,2,4-triazol-1-ido-κ<i>N</i>^1^}cobalt(II)","","- C36 H28 Co N10 O2 -","- C36 H28 Co N10 O2 -","- C72 H56 Co2 N20 O4 -","2","0.5","HB7033","Li, Bin","Diaquabis{5-(pyridin-2-yl-κ<i>N</i>)-3-[4-(pyridin-4-yl)phenyl]-1<i>H</i>-1,2,4-triazol-1-ido-κ<i>N</i>^1^}cobalt(II)","Acta Crystallographica Section E","2013","69","3","m141","","10.1107/S1600536813003243","","","0.71073","MoKα","","0.0571","0.046","","","0.1291","0.1386","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237484","8.7813","0.0012","9.5432","0.0013","11.977","0.0015","80.722","0.002","78.531","0.002","70.181","0.002","920.6","0.2","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","(<i>Z</i>)-<i>N</i>-[2-(<i>N</i>'-Hydroxycarbamimidoyl)phenyl]acetamide","","- C9 H11 N3 O2 -","- C9 H11 N3 O2 -","- C36 H44 N12 O8 -","4","2","HB7034","Fun, Hoong-Kun; Ooi, Chin Wei; Dinesha; Viveka, S.; Nagaraja, G.K.","(<i>Z</i>)-<i>N</i>-[2-(<i>N</i>'-Hydroxycarbamimidoyl)phenyl]acetamide","Acta Crystallographica Section E","2013","69","3","o370","o371","10.1107/S1600536813003371","","","0.71073","MoKα","","0.0525","0.0421","","","0.1089","0.1156","","","","","","1.068","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237485","5.6155","0.0004","9.9804","0.0007","11.7302","0.0009","79.532","0.006","78.508","0.006","83.55","0.006","631.54","0.08","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2,2-Dibenzylhydrazin-1-ium chloride","","- C14 H17 Cl N2 -","- C14 H17 Cl N2 -","- C28 H34 Cl2 N4 -","2","1","HB7036","Tayamon, Shahedeh; Ravoof, Thahira Begum S. A.; Tahir, Mohamed Ibrahim Mohamed; Crouse, Karen A.; Tiekink, Edward R. T.","2,2-Dibenzylhydrazin-1-ium chloride","Acta Crystallographica Section E","2013","69","3","o382","","10.1107/S1600536813003966","","","1.5418","CuKα","","0.0565","0.0467","","","0.1199","0.1294","","","","","","1.069","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237486","4.9346","0.0002","11.7542","0.0006","11.9727","0.0005","90","","96.782","0.003","90","","689.58","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","5-Fluoroanthranilic acid","2-Amino-5-fluorobenzoic acid","","- C7 H6 F N O2 -","- C7 H6 F N O2 -","- C28 H24 F4 N4 O8 -","4","1","HB7040","Sreenivasa, S.; ManojKumar, K.E.; Suchetan, P.A.; Palakshamurthy, B. S.; Gunasekaran, K.","2-Amino-5-fluorobenzoic acid","Acta Crystallographica Section E","2013","69","3","o387","","10.1107/S160053681300408X","","","0.71073","MoKα","","0.0382","0.034","","","0.0967","0.1004","","","","","","1.087","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237487","12.7408","0.0014","7.852","0.0009","14.4194","0.0018","90","","115.163","0.014","90","","1305.6","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Dimethylamino-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1<i>H</i>-pyrrole-3-carbonitrile","","- C14 H13 N3 O3 -","- C14 H13 N3 O3 -","- C56 H52 N12 O12 -","4","1","HB7042","Abdel-Wahab, Bakr F.; Mohamed, Hanan A.; Farahat, Abdelbasset A.; Ng, Seik Weng; Tiekink, Edward R. T.","4-Dimethylamino-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1<i>H</i>-pyrrole-3-carbonitrile","Acta Crystallographica Section E","2013","69","3","o437","","10.1107/S1600536813004893","","","0.71073","MoKα","","0.0996","0.0535","","","0.1285","0.1525","","","","","","1.037","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237488","10.0815","0.0007","10.2956","0.0007","10.5403","0.0007","71.013","0.006","78.697","0.005","70.412","0.006","969.99","0.12","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","(2<i>E</i>)-1-(2-Methyl-4-phenylquinolin-3-yl)-3-(3-methylthiophen-2-yl)prop-2-en-1-one","","- C24 H19 N O S -","- C24 H19 N O S -","- C48 H38 N2 O2 S2 -","2","1","HB7043","Prasath, R.; Bhavana, P.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-1-(2-Methyl-4-phenylquinolin-3-yl)-3-(3-methylthiophen-2-yl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","3","o426","o427","10.1107/S1600536813004753","","","0.71073","MoKα","","0.0637","0.0478","","","0.1205","0.1352","","","","","","1.03","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237489","5.4114","0.0002","10.7602","0.0004","15.1837","0.0005","90","","90","","90","","884.11","0.05","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(2-Nitrophenylsulfinyl)acetonitrile","","- C8 H6 N2 O3 S -","- C8 H6 N2 O3 S -","- C32 H24 N8 O12 S4 -","4","1","HB7044","Benmebarek, Sabrina; Boudraa, Mhamed; Bouacida, Sofiane; Merazig, Hocine","2-(2-Nitrophenylsulfinyl)acetonitrile","Acta Crystallographica Section E","2013","69","3","o432","","10.1107/S1600536813004832","","","0.71073","MoKα","","0.0303","0.0269","","","0.0657","0.0695","","","","","","1.051","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237490","10.5414","0.0011","4.9335","0.0006","20.0943","0.0019","90","","99.127","0.01","90","","1031.79","0.19","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methylsulfanyl-1,2,4-triazolo[1,5-<i>a</i>]quinazoline-5(4<i>H</i>)-thione","","- C10 H8 N4 S2 -","- C10 H8 N4 S2 -","- C40 H32 N16 S8 -","4","1","HB7045","Al-Salahi, Rashad; Marzouk, Mohamed; Al-Omar, Mohamed A.; Amr, Abd El-Galil E.; Ng, Seik Weng; Tiekink, Edward R. T.","2-Methylsulfanyl-1,2,4-triazolo[1,5-<i>a</i>]quinazoline-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2013","69","3","o434","","10.1107/S1600536813004881","","","0.71073","MoKα","","0.0645","0.0399","","","0.0877","0.0975","","","","","","0.933","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237491","7.232","0.0003","10.4857","0.0006","18.9398","0.001","90","","90","","90","","1436.25","0.13","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(Quinolin-8-ol-κ^2^<i>N</i>,<i>O</i>)(quinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)silver(I)","","- C18 H13 Ag N2 O2 -","- C18 H13 Ag N2 O2 -","- C72 H52 Ag4 N8 O8 -","4","1","HG5282","Jia, Zhen-Bin; Zhao, Yi; Wen, Qiu-Jia; Ma, Ai-Qing","The non-centrosymmetric polymorph of (quinolin-8-ol-κ^2^<i>N</i>,<i>O</i>)(quinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)silver(I)","Acta Crystallographica Section E","2013","69","3","m133","","10.1107/S160053681300281X","","","0.71073","MoKα","","0.0338","0.0274","","","0.0545","0.0569","","","","","","1.078","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237492","14.196","0.0007","4.805","0.0002","22.128","0.001","90","","90.653","0.001","90","","1509.29","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 5-bromo-3-ethoxycarbonylamino-1-benzofuran-2-carboxylate","","- C14 H14 Br N O5 -","- C14 H14 Br N O5 -","- C56 H56 Br4 N4 O20 -","4","1","HG5285","Karunakar, Prashantha; Krishnamurthy, V.; Girija, C. R.; Krishna, V.; Vaidya, V. P.; Yamuna, A. J.","Ethyl 5-bromo-3-ethoxycarbonylamino-1-benzofuran-2-carboxylate","Acta Crystallographica Section E","2013","69","3","o342","","10.1107/S1600536813002997","","","0.71073","MoKα","","0.0606","0.0377","","","0.0886","0.1023","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237493","17.2064","0.0008","20.7984","0.0009","15.6102","0.0007","90","","101.213","0.004","90","","5479.7","0.4","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(3,4-Dichlorophenyl)-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro- 1<i>H</i>-pyrazol-4-yl)acetamide","","- C19 H17 Cl2 N3 O2 -","- C19 H17 Cl2 N3 O2 -","- C228 H204 Cl24 N36 O24 -","12","3","HG5286","Mahan, Aneeka; Butcher, Ray J.; Nayak, Prakash S.; Narayana, B.; Yathirajan, H. S.","2-(3,4-Dichlorophenyl)-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)acetamide","Acta Crystallographica Section E","2013","69","3","o402","o403","10.1107/S1600536813002341","","","0.71073","MoKα","","0.2322","0.1194","","","0.2654","0.3448","","","","","","1.024","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237494","15.325","0.002","7.1744","0.0009","17.965","0.002","90","","93.577","0.009","90","","1971.4","0.4","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(±)-(4a<i>R</i>,5<i>R</i>,8<i>S</i>,8a<i>R</i>)-8-(<i>tert</i>-Butyldimethylsilyloxy)-2,5,8a-trimethyl-4a,5,8,8a-tetrahydronaphthalene-1,4-dione","","- C19 H30 O3 Si -","- C19 H30 O3 Si -","- C76 H120 O12 Si4 -","4","1","HG5287","Delling, Felix N.; Zukerman-Schpector, Julio; Brocksom, Timothy J.; Brocksom, Ursula; Finelli, Fernanda G.; Tiekink, Edward R. T.","(±)-(4a<i>R</i>,5<i>R</i>,8<i>S</i>,8a<i>R</i>)-8-(<i>tert</i>-Butyldimethylsilyloxy)-2,5,8a-trimethyl-4a,5,8,8a-tetrahydronaphthalene-1,4-dione","Acta Crystallographica Section E","2013","69","3","o325","","10.1107/S1600536813002973","","","0.71073","MoKα","","0.2472","0.0621","","","0.1182","0.1653","","","","","","0.925","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237495","7.613","0.002","5.7513","0.0015","31.085","0.009","90","","94.674","0.004","90","","1356.5","0.6","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(4-Ethylcyclohexyl)(4-methoxyphenyl)methanone","","- C16 H22 O2 -","- C16 H22 O2 -","- C64 H88 O8 -","4","1","HG5288","Ding, Chun-Lei; Wu, Yong-Jie; Zhang, Yi; Zhou, Li","(4-Ethylcyclohexyl)(4-methoxyphenyl)methanone","Acta Crystallographica Section E","2013","69","3","o348","","10.1107/S1600536813003279","","","0.71073","MoKα","","0.0656","0.0498","","","0.1273","0.1393","","","","","","1.057","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237496","8.3015","0.0007","8.3053","0.0007","14.4374","0.0013","97.18","0.007","92.644","0.007","118.996","0.009","857.25","0.15","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","2-(2,4-Dichlorophenoxymethyl)-5-(4-methylphenyl)imidazo[2,1-<i>b</i>][1,3,4]thiadiazole","","- C18 H13 Cl2 N3 O S -","- C18 H13 Cl2 N3 O S -","- C36 H26 Cl4 N6 O2 S2 -","2","1","HG5290","Abdel-Wahab, Bakr F.; Mohamed, Hanan A.; Ng, Seik Weng; Tiekink, Edward R. T.","2-(2,4-Dichlorophenoxymethyl)-5-(4-methylphenyl)imidazo[2,1-<i>b</i>][1,3,4]thiadiazole","Acta Crystallographica Section E","2013","69","3","o377","","10.1107/S160053681300384X","","","0.71073","MoKα","","0.0784","0.0478","","","0.1345","0.1718","","","","","","0.983","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237497","14.4154","0.001","11.3197","0.0009","9.5575","0.0008","90","","103.991","0.008","90","","1513.3","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(4-Fluorophenyl)-3-(4-methylphenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","","- C17 H16 F N3 S -","- C17 H16 F N3 S -","- C68 H64 F4 N12 S4 -","4","1","HG5291","Abdel-Wahab, Bakr F.; Mohamed, Hanan A.; Khidre, Rizk E.; Ng, Seik Weng; Tiekink, Edward R. T.","5-(4-Fluorophenyl)-3-(4-methylphenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","Acta Crystallographica Section E","2013","69","3","o385","o386","10.1107/S1600536813004194","","","0.71073","MoKα","","0.0775","0.0465","","","0.1021","0.1222","","","","","","1.036","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237498","5.7563","0.0003","24.1214","0.0012","15.1827","0.0008","90","","90.948","0.005","90","","2107.83","0.19","295","2","295","2","","","","","","","","5","P 1 c 1","P -2yc","7","","2-[5-(4-Fluorophenyl)-3-(4-methylphenyl)-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]-4-phenyl-1,3-thiazole","","- C25 H20 F N3 S -","- C25 H20 F N3 S -","- C100 H80 F4 N12 S4 -","4","2","HG5292","Abdel-Wahab, Bakr F.; Mohamed, Hanan A.; Ng, Seik Weng; Tiekink, Edward R. T.","2-[5-(4-Fluorophenyl)-3-(4-methylphenyl)-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]-4-phenyl-1,3-thiazole","Acta Crystallographica Section E","2013","69","3","o392","o393","10.1107/S1600536813004339","","","0.71073","MoKα","","0.0854","0.0477","","","0.0958","0.117","","","","","","0.991","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237499","14.5402","0.0009","11.27","0.0008","9.5169","0.0006","90","","103.85","0.006","90","","1514.17","0.18","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","","- C16 H13 Cl F N3 S -","- C16 H13 Cl F N3 S -","- C64 H52 Cl4 F4 N12 S4 -","4","1","HG5293","Abdel-Wahab, Bakr F.; Mohamed, Hanan A.; Ng, Seik Weng; Tiekink, Edward R. T.","3-(4-Chlorophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","Acta Crystallographica Section E","2013","69","3","o414","o415","10.1107/S1600536813004492","","","0.71073","MoKα","","0.0622","0.0413","","","0.0925","0.1109","","","","","","1.014","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237500","11.1295","0.0009","11.5764","0.0008","13.3989","0.0011","96.176","0.006","112.9","0.008","96.533","0.006","1558","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","(2<i>E</i>)-1-(2,4-Dimethylquinolin-3-yl)-3-phenylprop-2-en-1-one","","- C20 H17 N O -","- C20 H17 N O -","- C80 H68 N4 O4 -","4","2","HG5294","Prasath, R.; Bhavana, P.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-1-(2,4-Dimethylquinolin-3-yl)-3-phenylprop-2-en-1-one","Acta Crystallographica Section E","2013","69","3","o428","o429","10.1107/S1600536813004765","","","0.71073","MoKα","","0.14","0.0656","","","0.1478","0.1895","","","","","","1.046","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237501","13.1543","0.0014","16.811","0.0018","9.3672","0.0012","90","","96.628","0.01","90","","2057.6","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-amino-4-(4-bromophenyl)-6-methoxy-4<i>H</i>-benzo[<i>h</i>]chromene-3-carboxylate","","- C23 H20 Br N O4 -","- C23 H20 Br N O4 -","- C92 H80 Br4 N4 O16 -","4","1","HG5295","El-Agrody, Ahmed M.; Fouda, Ahmed M.; Al-Omar, Mohamed A.; Amr, Abd El-Galil E.; Ng, Seik Weng; Tiekink, Edward R. T.","Ethyl 2-amino-4-(4-bromophenyl)-6-methoxy-4<i>H</i>-benzo[<i>h</i>]chromene-3-carboxylate","Acta Crystallographica Section E","2013","69","3","o435","o436","10.1107/S160053681300490X","","","0.71073","MoKα","","0.1256","0.0596","","","0.1278","0.1642","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237502","10.292","0.0005","12.5518","0.0006","22.5857","0.0009","90","","90","","90","","2917.7","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,3-Dimethyl-1<i>H</i>-1,2,3-benzotriazol-3-ium tetrachloridoferrate(III)","","- C8 H10 Cl4 Fe N3 -","- C8 H10 Cl4 Fe N3 -","- C64 H80 Cl32 Fe8 N24 -","8","1","HY2615","Sun, Zan; Hu, Dong-Cheng; Liu, Jia-Cheng","1,3-Dimethyl-1<i>H</i>-1,2,3-benzotriazol-3-ium tetrachloridoferrate(III)","Acta Crystallographica Section E","2013","69","3","m148","","10.1107/S1600536813003711","","","0.71073","MoKα","","0.0923","0.0566","","","0.1516","0.1825","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237503","7.3052","0.001","11.7997","0.0017","13.5156","0.0019","90","","90","","90","","1165","0.3","298","2","298","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Diaquabis(1<i>H</i>-imidazole-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>^4^)manganese(II)","","- C8 H10 Mn N4 O6 -","- C8 H10 Mn N4 O6 -","- C32 H40 Mn4 N16 O24 -","4","0.5","HY2616","Xiong, Zhi-Yong; Li, Lin; Zhao, Xiang-Jie; Chen, Hai-Ming","Diaquabis(1<i>H</i>-imidazole-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>^4^)manganese(II)","Acta Crystallographica Section E","2013","69","3","m172","","10.1107/S1600536813004091","","","0.71073","MoKα","","0.0451","0.0388","","","0.1026","0.109","","","","","","1.07","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237504","9.561","0.004","10.594","0.005","12.436","0.005","107.095","0.007","102.454","0.006","106.551","0.006","1090.7","0.8","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Poly[[bis{μ~2~-1,2-bis[(1<i>H</i>-imidazol-1-yl)methyl]benzene}(μ~4~- 9,10-dioxo-9,10-dihydroanthracene-1,4,5,8-tetracarboxylato)dicobalt(II)] monohydrate]","","- C46 H36 Co2 N8 O12 -","- C46 H36 Co2 N8 O12 -","- C46 H36 Co2 N8 O12 -","1","0.5","IM2380","Sheng, Xiao-Li; Xu, Duo-Hui; Cai, Bin; Liu, Jian-Lan","Poly[[bis{μ~2~-1,2-bis[(1<i>H</i>-imidazol-1-yl)methyl]benzene}(μ~4~-9,10-dioxo-9,10-dihydroanthracene-1,4,5,8-tetracarboxylato)dicobalt(II)] dihydrate]","Acta Crystallographica Section E","2013","69","3","m136","","10.1107/S160053681202716X","","","0.71073","MoKα","","0.0375","0.0324","","","0.0871","0.0905","","","","","","1.044","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237505","9.7126","0.0003","11.593","0.0003","12.5989","0.0005","115.013","0.002","107.126","0.002","97.431","0.001","1174.6","0.07","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Diethyl 1,8-diphenyl-11-oxatricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene-9,10-dicarboxylate","","- C28 H26 O5 -","- C28 H26 O5 -","- C56 H52 O10 -","2","1","IM2416","Balakrishnan, B.; Nandakumar, Meganathan; Seshadri, P. R.; Mohanakrishnan, Arasambattu K.","Diethyl 1,8-diphenyl-11-oxatricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene-9,10-dicarboxylate","Acta Crystallographica Section E","2013","69","3","o323","","10.1107/S1600536813002791","","","0.71073","MoKα","","0.054","0.0411","","","0.1","0.11","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237506","12.309","0.002","17.189","0.003","8.1837","0.0013","90","","101.632","0.008","90","","1695.9","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1<i>H</i>-2λ^6^,1-benzothiazine-2,2-dione","","- C16 H13 Cl2 N3 O2 S -","- C16 H13 Cl2 N3 O2 S -","- C64 H52 Cl8 N12 O8 S4 -","4","1","IM2417","Ahmad, Saeed; Shafiq, Muhammad; Tahir, M. Nawaz; Harrison, William T. A.; Khan, Islam Ullah","3-Chloro-4-[2-(4-chlorobenzylidene)hydrazinylidene]-1-methyl-3,4-dihydro-1<i>H</i>-2λ^6^,1-benzothiazine-2,2-dione","Acta Crystallographica Section E","2013","69","3","o422","o423","10.1107/S1600536813004443","","","0.71073","MoKα","","0.1258","0.0559","","","0.1109","0.1398","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237507","24.701","0.002","4.853","0.0004","25.063","0.002","90","","95.321","0.003","90","","2991.5","0.4","297","2","297","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","5-Amino-6-methylquinolin-1-ium hydrogen malonate‒malonic acid (2/1)","5-Amino-6-methylquinolin-1-ium 2-carboxyacetate‒malonic acid (2/1)","","- C29 H32 N4 O12 -","- C29 H32 N4 O12 -","- C116 H128 N16 O48 -","4","0.5","IS5233","Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Arshad, Suhana; Razak, Ibrahim Abdul","5-Amino-6-methylquinolin-1-ium hydrogen malonate‒malonic acid (2/1)","Acta Crystallographica Section E","2013","69","3","o319","o320","10.1107/S1600536813002547","","","0.71073","MoKα","","0.0719","0.0455","","","0.1113","0.13","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237508","22.3118","0.0015","15.2053","0.001","7.4166","0.0005","90","","100.924","0.001","90","","2470.5","0.3","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Amino-6-methylpyridinium 3-chlorobenzoate","","- C13 H13 Cl N2 O2 -","- C13 H13 Cl N2 O2 -","- C104 H104 Cl8 N16 O16 -","8","1","IS5234","Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Arshad, Suhana; Razak, Ibrahim Abdul","2-Amino-6-methylpyridinium 3-chlorobenzoate","Acta Crystallographica Section E","2013","69","3","o318","","10.1107/S1600536813002559","","","0.71073","MoKα","","0.0735","0.0449","","","0.1107","0.1284","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237509","29.0274","0.0016","14.5512","0.0008","5.8686","0.0003","90","","90","","90","","2478.8","0.2","273","2","273","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","5-Chloro-2-(4-methoxyphenyl)-1,3-benzothiazole","","- C14 H10 Cl N O S -","- C14 H10 Cl N O S -","- C112 H80 Cl8 N8 O8 S8 -","8","1","IS5237","Yousuf, Sammer; Shah, Shazia; Ambreen, Nida; Khan, Khalid M.; Ahmad, Shakil","5-Chloro-2-(4-methoxyphenyl)-1,3-benzothiazole","Acta Crystallographica Section E","2013","69","3","o360","","10.1107/S1600536813001955","","","0.71073","MoKα","","0.0849","0.0761","","","0.2004","0.2081","","","","","","1.149","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237510","7.9969","0.0001","9.1336","0.0001","14.774","0.0002","96.22","0.001","105.43","0.001","105.06","0.001","986.05","0.02","100","","100","0.1","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-2-[4-(Diethylamino)styryl]-1-ethylpyridinium iodide monohydrate","","- C19 H27 I N2 O -","- C19 H27 I N2 O -","- C38 H54 I2 N4 O2 -","2","1","IS5238","Chantrapromma, Suchada; Boonnak, Nawong; Kaewmanee, Narissara; Quah, Ching Kheng; Fun, Hoong-Kun","(<i>E</i>)-2-[4-(Diethylamino)styryl]-1-ethylpyridinium iodide monohydrate","Acta Crystallographica Section E","2013","69","3","o458","o459","10.1107/S160053681300528X","","","0.71073","MoKα","","0.0302","0.025","","","0.0528","0.0548","","","","","","1.076","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237511","12.5649","0.001","19.0531","0.0014","7.493","0.0006","90","","103.932","0.003","90","","1741.1","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(E)-3-(2-(2-hydroxyethoxy)ferrocenyl)-1-phenylprop-2-en-1-one","(<i>E</i>)-1-Ferrocenyl-3-[2-(2-hydroxyethoxy)phenyl]prop-2-en-1-one","","- C21 H20 Fe O3 -","- C21 H20 Fe O3 -","- C84 H80 Fe4 O12 -","4","1","IS5242","Paramasivam, S.; Purushothaman, Santhanagopalan; Seshadri, P. R.; Raghunathan, Raghavachary","(<i>E</i>)-1-Ferrocenyl-3-[2-(2-hydroxyethoxy)phenyl]prop-2-en-1-one","Acta Crystallographica Section E","2013","69","3","m144","","10.1107/S1600536813003395","","","0.71073","MoKα","","0.0455","0.0346","","","0.0901","0.096","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237512","13.1965","0.0017","12.0279","0.0016","9.9006","0.0013","90","","100.998","0.001","90","","1542.6","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis{5-(pyridin-2-yl-κ<i>N</i>)-3-[4-(pyridin-4-yl)phenyl]-1<i>H</i>-1,2,4-triazol-1-ido-κ<i>N</i>^1^}iron(II)","","- C36 H28 Fe N10 O2 -","- C36 H28 Fe N10 O2 -","- C72 H56 Fe2 N20 O4 -","2","0.5","IS5245","Li, Bin","Diaquabis{5-(pyridin-2-yl-κ<i>N</i>)-3-[4-(pyridin-4-yl)phenyl]-1<i>H</i>-1,2,4-triazol-1-ido-κ<i>N</i>^1^}iron(II)","Acta Crystallographica Section E","2013","69","3","m168","","10.1107/S1600536813004601","","","0.71073","MoKα","","0.0718","0.0587","","","0.1708","0.1838","","","","","","0.999","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237513","26.1151","0.001","4.9484","0.0002","11.3933","0.0004","90","","90","","90","","1472.33","0.1","273","2","273","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","(<i>E</i>)-2,4-Dimethyl-<i>N</i>'-(2-methylbenzylidene)benzohydrazide","","- C17 H18 N2 O -","- C17 H18 N2 O -","- C68 H72 N8 O4 -","4","1","IS5246","Taha, Muhammad; Ismail, Nor Hadiani; Jaafar, Faridahanim Mohd; Khan, Khalid M.; Yousuf, Sammer","(<i>E</i>)-2,4-Dimethyl-<i>N</i>'-(2-methylbenzylidene)benzohydrazide","Acta Crystallographica Section E","2013","69","3","o400","","10.1107/S1600536813004388","","","0.71073","MoKα","","0.0314","0.03","","","0.0786","0.0798","","","","","","1.043","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237514","15.0413","0.0002","7.7866","0.0001","19.6443","0.0003","90","","96.231","0.001","90","","2287.16","0.06","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","Stevioside","Stevioside methanol tetrasolvate","","- C42 H76 O22 -","- C42 H76 O22 -","- C84 H152 O44 -","2","1","JJ2161","Wu, Yunshan; Rodenburg, Douglas L.; Ibrahim, Mohamed A.; McChesney, James D.; Avery, Mitchell A.","Stevioside methanol tetrasolvate","Acta Crystallographica Section E","2013","69","3","o410","o411","10.1107/S1600536813003954","","","1.54178","CuKα","","0.0304","0.0297","","","0.0754","0.0759","","","","","","1.048","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237515","16.8771","0.0003","7.53713","0.00016","26.2404","0.0006","90","","97.2938","0.0018","90","","3310.9","0.12","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetraethylammonium toluene-4-sulfonate","","- C15 H27 N O3 S -","- C14.9985 H27 N O2.9955 S0.9985 -","- C119.988 H216 N8 O23.964 S7.988 -","8","2","KP2445","Brus, Diana Malgorzata; Czyrko, Justyna; Brzezinski, Krzysztof","Tetraethylammonium toluene-4-sulfonate","Acta Crystallographica Section E","2013","69","3","o324","","10.1107/S1600536813002961","","","0.71073","MoKα","","0.0841","0.0755","","","0.1592","0.1629","","","","","","1.188","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237516","14.046","0.005","9.607","0.005","5.903","0.003","90","","90","","90","","796.6","0.6","293","2","293","2","","","","","","","","4","C m c 21","C 2c -2","36","","2-Nitro-1,3-dinitrooxypropane","","- C3 H5 N3 O8 -","- C3 H5 N3 O8 -","- C12 H20 N12 O32 -","4","0.5","LD2094","Breiner, Megan M.; Chavez, David E.; Parrish, Damon A.","2-Nitro-1,3-dinitrooxypropane","Acta Crystallographica Section E","2013","69","3","o384","","10.1107/S1600536813004170","","","0.71073","MoKα","","0.0676","0.0377","","","0.0716","0.0828","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237517","11.948","0.0005","11.8649","0.0005","11.1416","0.0005","90","","108.918","0.002","90","","1494.14","0.11","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","bisthiochromanone","3-[(4-Oxo-4<i>H</i>-thiochromen-3-yl)methyl]-4<i>H</i>-thiochromen-4-one","","- C19 H12 O2 S2 -","- C19 H12 O2 S2 -","- C76 H48 O8 S8 -","4","0.5","LH5551","Somasundaram, M.; Athavan, S.; Balasubramanian, K. K.; Saiganesh, R.; Kabilan, S.","3-[(4-Oxo-4<i>H</i>-thiochromen-3-yl)methyl]-4<i>H</i>-thiochromen-4-one","Acta Crystallographica Section E","2013","69","3","o358","","10.1107/S1600536813001906","","","0.71073","MoKα","","0.0388","0.0332","","","0.1102","0.1183","","","","","","0.884","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237518","7.9474","0.0006","13.0122","0.001","13.4215","0.0011","87.734","0.006","77.014","0.007","86.945","0.007","1350","0.19","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","1-(2-Furoyl)-3-(2-methoxy-4-nitrophenyl)thiourea","","- C13 H11 N3 O5 S -","- C13 H11 N3 O5 S -","- C52 H44 N12 O20 S4 -","4","2","LH5568","Pratap, Seema; Singh, Durga P.; Gupta, Sushil K.; Yildirim, Sema Öztürk; Butcher, Ray J.","1-(2-Furoyl)-3-(2-methoxy-4-nitrophenyl)thiourea","Acta Crystallographica Section E","2013","69","3","o330","o331","10.1107/S1600536813002894","","","1.54184","CuKα","","0.0641","0.0461","","","0.1188","0.1335","","","","","","1.032","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237519","17.0305","0.0008","9.5638","0.0006","7.1651","0.0004","90","","104.199","0.004","90","","1131.37","0.11","298","2","298","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2-(4-Oxo-3-phenyl-1,3-thiazolidin-2-ylidene)malononitrile","","- C12 H7 N3 O S -","- C12 H7 N3 O S -","- C48 H28 N12 O4 S4 -","4","1","LH5577","Sakka, Ola K.; Fleita, Daisy H.; Harrison, William T. A.","2-(4-Oxo-3-phenyl-1,3-thiazolidin-2-ylidene)malononitrile","Acta Crystallographica Section E","2013","69","3","o350","","10.1107/S160053681300216X","","","0.71073","MoKα","","0.0938","0.0429","","","0.0725","0.0858","","","","","","1.014","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237520","8.273","0.0002","8.4881","0.0002","10.4288","0.0002","95.178","0.001","103.507","0.001","94.109","0.001","705.91","0.03","180","2","180","2","","","","","","","","5","P -1","-P 1","2","LY-4","4-Nitrophenyl <i>N</i>-(2-sulfamoylphenyl)carbamate","","- C13 H11 N3 O6 S -","- C13 H11 N3 O6 S -","- C26 H22 N6 O12 S2 -","2","1","LH5580","Yu, Wenying; Li, Chenglong","4-Nitrophenyl <i>N</i>-(2-sulfamoylphenyl)carbamate","Acta Crystallographica Section E","2013","69","3","o355","","10.1107/S1600536813003310","","","0.71073","MoKα","","0.0554","0.0366","","","0.09","0.0982","","","","","","1.054","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237521","19.7286","0.0011","11.5659","0.0014","17.8088","0.0018","90","","90","","90","","4063.6","0.7","291","2","291","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl){3-[(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)carbonyl]-5-methylindolizin-1-yl}methanone","","- C21 H21 N5 O2 -","- C21 H21 N5 O2 -","- C168 H168 N40 O16 -","8","2","LH5581","Song, Xiang-Yun; Gu, Wei-Jin; Jiang, Yu-Liang; Wang, Bing-Xiang","(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl){3-[(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)carbonyl]-5-methylindolizin-1-yl}methanone","Acta Crystallographica Section E","2013","69","3","o450","","10.1107/S1600536813005060","","","0.71073","MoKα","","0.0561","0.0502","","","0.1281","0.1293","","","","","","1.071","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237522","11.9045","0.0004","14.6235","0.0004","7.61672","0.00015","90","","105.483","0.002","90","","1277.84","0.06","298","","298","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,4'-Diisocyano-3,3'-dimethylbiphenyl","","- C16 H12 N2 -","- C16 H12 N2 -","- C64 H48 N8 -","4","1","LH5582","Rukiah, Mwaffak; Al-Ktaifani, Mahmoud","Powder X-ray investigation of 4,4'-diisocyano-3,3'-dimethylbiphenyl","Acta Crystallographica Section E","2013","69","3","o412","o413","10.1107/S1600536813004315","powder diffraction","","1.5406","CuKα~1~","","","","","","","","","","1.32","","","","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2237523","9.804","0.0002","10.287","0.0002","11.826","0.0002","74.727","0.001","82.761","0.001","71.817","0.001","1091.87","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>,<i>N</i>-Diethylanilinium 5-(5-chloro-2,4-dinitrophenyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate","","- C20 H20 Cl N5 O7 -","- C20 H20 Cl N5 O7 -","- C40 H40 Cl2 N10 O14 -","2","1","LH5583","Babykala, R.; Kalaivani, D.","<i>N</i>,<i>N</i>-Diethylanilinium 5-(5-chloro-2,4-dinitrophenyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate","Acta Crystallographica Section E","2013","69","3","o398","o399","10.1107/S1600536813004352","","","0.71073","MoKα","","0.0528","0.0418","","","0.1073","0.1171","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237524","23.7543","0.0006","9.3871","0.0002","15.8857","0.0004","90","","94.704","0.002","90","","3530.33","0.15","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Amino-7,7-dimethyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-4<i>H</i>-chromene-3-carbonitrile","","- C19 H17 F3 N2 O2 -","- C19 H17 F3 N2 O2 -","- C152 H136 F24 N16 O16 -","8","1","LH5585","Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Patil, D. R.; Chandam, D. R.; Deshmukh, Madhukar B.","2-Amino-7,7-dimethyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-4<i>H</i>-chromene-3-carbonitrile","Acta Crystallographica Section E","2013","69","3","o417","o418","10.1107/S1600536813004522","","","0.71073","MoKα","","0.0862","0.0611","","","0.1157","0.1263","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237525","4.0368","0.0003","15.5642","0.001","10.85","0.0007","90","","97.488","0.006","90","","675.89","0.08","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-[(Dimethylamino)methylidene]propanedinitrile","","- C6 H7 N3 -","- C6 H7 N3 -","- C24 H28 N12 -","4","1","LH5587","Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Patil, D. R.; Deshmukh, Madhukar B.","2-[(Dimethylamino)methylidene]propanedinitrile","Acta Crystallographica Section E","2013","69","3","o433","","10.1107/S1600536813004960","","","0.71073","MoKα","","0.0993","0.0659","","","0.1807","0.2057","","","","","","1.052","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237526","13.724","0.005","9.861","0.008","27.742","0.003","90","","112.693","0.012","90","","3464","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(4-{2-[4-(diethylamino)phenyl]ethenyl}pyridine-κ<i>N</i>)diiodididozinc","","- C34 H40 I2 N4 Zn -","- C34 H40 I2 N4 Zn -","- C136 H160 I8 N16 Zn4 -","4","1","LR2093","Nie, Cui-Yun; Tian, Yu-Peng","Bis(4-{2-[4-(diethylamino)phenyl]ethenyl}pyridine-κ<i>N</i>)diiodidozinc","Acta Crystallographica Section E","2013","69","3","m135","","10.1107/S1600536813001736","","","0.71069","MoKα","","0.1117","0.0631","","","0.163","0.197","","","","","","1.044","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237527","11.8535","0.0007","12.3769","0.0009","20.8721","0.0011","98.549","0.005","103.074","0.005","105.134","0.006","2808.2","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-<i>N</i>'-(4-Fluorobenzylidene)-2-(3-methylphenyl)acetohydrazide","","- C16 H15 F N2 O -","- C16 H15 F N2 O -","- C128 H120 F8 N16 O8 -","8","4","LX2277","Praveen, A. S.; Jasinski, Jerry P.; Keeley, Amanda C.; Yathirajan, H. S.; Narayana, B.","(<i>E</i>)-<i>N</i>'-(4-Fluorobenzylidene)-2-(3-methylphenyl)acetohydrazide","Acta Crystallographica Section E","2013","69","3","o421","","10.1107/S1600536813004467","","","1.54184","CuKα","","0.107","0.0511","","","0.1467","0.1905","","","","","","0.993","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237528","25.5516","0.0005","6.325","0.0001","27.9899","0.0006","90","","90.639","0.001","90","","4523.27","0.15","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Benzylammoniumdiheptanoate","Benzylammonium heptanoate‒heptanoic acid (1/1)","","- C21 H37 N O4 -","- C21 H37 N O4 -","- C168 H296 N8 O32 -","8","1","MW2101","Wood, Mary H.; Clarke, Stuart M.","Benzylammonium heptanoate‒heptanoic acid (1/1)","Acta Crystallographica Section E","2013","69","3","o346","o347","10.1107/S1600536813003012","","","0.71073","MoKα","","0.1675","0.0678","","","0.1812","0.2384","","","","","","0.976","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237529","12.413","0.003","9.3936","0.0019","16.202","0.003","90","","111.65","0.03","90","","1755.9","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-{(<i>E</i>)-4-[4-(Trifluoromethyl)phenoxy]but-2-enyloxy}phenyl <i>N</i>-methylcarbamate","","- C19 H18 F3 N O4 -","- C19 H18 F3 N O4 -","- C76 H72 F12 N4 O16 -","4","1","MW2102","Ma, Hong-Ju; Xu, Meng-Han; Zhang, Jian-Hua; Li, Jian-Hong; Ning, Jun","2-{(<i>E</i>)-4-[4-(Trifluoromethyl)phenoxy]but-2-enyloxy}phenyl <i>N</i>-methylcarbamate","Acta Crystallographica Section E","2013","69","3","o326","o327","10.1107/S1600536813001347","","","1.54178","CuKα","","0.0542","0.0437","","","0.1017","0.107","","","","","","1.074","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237530","6.6562","0.0005","14.1","0.0014","60.756","0.005","90","","90","","90","","5702.1","0.9","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3,7,11-Tris{4-[(1<i>R</i>,3<i>S</i>,4<i>S</i>)-neomenthyloxy]phenyl}tri[1,2,4]triazolo[4,3-<i>a</i>:4',3'-<i>c</i>:4'',3''-<i>e</i>][1,3,5]triazine‒chloroform‒ethanol (1/1/1)","","- C57 H76 Cl3 N9 O4 -","- C57 H76 Cl3 N9 O4 -","- C228 H304 Cl12 N36 O16 -","4","1","NC2304","Herget, Karoline; Schollmeyer, Dieter; Detert, Heiner","3,7,11-Tris{4-[(1<i>R</i>,3<i>S</i>,4<i>S</i>)-neomenthyloxy]phenyl}tri[1,2,4]triazolo[4,3-<i>a</i>:4',3'-<i>c</i>:4'',3''-<i>e</i>][1,3,5]triazine‒chloroform‒ethanol (1/1/1)","Acta Crystallographica Section E","2013","69","3","o365","o366","10.1107/S1600536813003498","","","0.71073","MoKα","","0.2552","0.0609","","","0.1007","0.1525","","","","","","0.783","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237531","10.8594","0.0001","13.7414","0.0002","21.1929","0.0003","90","","90","","90","","3162.48","0.07","160","1","160","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>S</i>)-<i>N</i>-[(4-{(<i>S</i>)-1-[2-(4-Methoxybenzamido)-2-methylpropanoyl]pyrrolidine-2-carboxamido}-3,4,5,6-tetrahydro-2<i>H</i>-pyran-4-yl)carbonyl]proline dimethyl sulfoxide monosolvate","","- C30 H44 N4 O9 S -","- C30 H44 N4 O9 S -","- C120 H176 N16 O36 S4 -","4","1","NC2305","Stoykova, Svetlana A.; Linden, Anthony; Heimgartner, Heinz","(<i>S</i>)-<i>N</i>-[(4-{(<i>S</i>)-1-[2-(4-Methoxybenzamido)-2-methylpropanoyl]pyrrolidine-2-carboxamido}-3,4,5,6-tetrahydro-2<i>H</i>-pyran-4-yl)carbonyl]proline dimethyl sulfoxide monosolvate (4-MeBz-Aib-Pro-Thp-Pro-OH)","Acta Crystallographica Section E","2013","69","3","o419","o420","10.1107/S1600536813004546","","","0.71073","MoKα","","0.0565","0.0421","","","0.0952","0.1026","","","","","","1.015","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237532","13.0418","0.0004","17.8453","0.0007","21.8391","0.0009","106.915","0.003","104.977","0.003","104.125","0.003","4408.5","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tris[dimethyl (benzoylamido)phosphato-κ^2^<i>O</i>,<i>O</i>'](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')neodymium(III)","","- C39 H41 N5 Nd O12 P3 -","- C39 H41 N5 Nd O12 P3 -","- C156 H164 N20 Nd4 O48 P12 -","4","2","NG5315","Kariaka, Nataliia S.; Trush, Victor A.; Medviediev, Volodymyr V.; Sliva, Tetyana Yu.; Amirkhanov, Vladimir M.","Tris[dimethyl (benzoylamido)phosphato-κ^2^<i>O</i>,<i>O</i>'](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')neodymium(III)","Acta Crystallographica Section E","2013","69","3","m143","","10.1107/S1600536813003462","","","0.7107","MoKα","","0.0659","0.0355","","","0.0801","0.0888","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237533","7.862","0.0002","9.20164","0.00018","13.3027","0.0003","82.4472","0.0018","74.803","0.002","66.012","0.002","848.16","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","2-Chloro-6-[(2,4-dimethoxybenzyl)amino]-9-isopropyl-9<i>H</i>-purine","","- C17 H20 Cl N5 O2 -","- C17 H20 Cl N5 O2 -","- C34 H40 Cl2 N10 O4 -","2","1","NG5316","Novotná, Radka; Trávníček, Zdeněk","2-Chloro-6-[(2,4-dimethoxybenzyl)amino]-9-isopropyl-9<i>H</i>-purine","Acta Crystallographica Section E","2013","69","3","o390","","10.1107/S1600536813004121","","","0.71073","MoKα","","0.0316","0.0291","","","0.0783","0.0793","","","","","","1.096","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237534","19.7898","0.0008","19.7898","0.0008","12.4416","0.0011","90","","90","","90","","4872.6","0.5","295","","295","","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>N</i>-[(1<i>E</i>)-5-(3-Chlorophenyl)-3-methylcyclohex-2-en-1-ylidene]hydroxylamine","","- C13 H14 Cl N O -","- C13 H14 Cl N O -","- C208 H224 Cl16 N16 O16 -","16","1","NK2191","Ganesh, G.; Murugavel, K.; Kannan, P. S.; Amirthaganesan, S.; SubbiahPandi, A.","<i>N</i>-[(1<i>E</i>)-5-(3-Chlorophenyl)-3-methylcyclohex-2-en-1-ylidene]hydroxylamine","Acta Crystallographica Section E","2013","69","3","o449","","10.1107/S1600536813004698","","","0.71073","MoKα","","0.1024","0.0803","","","0.2168","0.2417","","","","","","1.053","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237535","11.6827","0.001","11.1912","0.0011","11.1789","0.0011","90","","109.118","0.002","90","","1381","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[4-(4-Methoxyphenyl)-1-methyl-3-nitropyrrolidin-3-yl]methanol","","- C13 H18 N2 O4 -","- C13 H18 N2 O4 -","- C52 H72 N8 O16 -","4","1","NK2193","Prathebha, K.; Sathya, S.; Usha, G.; Sivakumar, N.; Bakthadoss, M.","[4-(4-Methoxyphenyl)-1-methyl-3-nitropyrrolidin-3-yl]methanol","Acta Crystallographica Section E","2013","69","3","o372","","10.1107/S1600536813003073","","","0.71073","MoKα","","0.073","0.0454","","","0.1385","0.1616","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237536","13.247","0.004","12.075","0.004","20.822","0.007","90","","90.979","0.005","90","","3330.1","1.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[(tetrahydrofuran-κ<i>O</i>)potassium]-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-aluminium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-potassium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-aluminium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>]","","- C20 H56 Al2 K2 N8 O -","- C20 H56 Al2 K2 N8 O -","- C80 H224 Al8 K8 N32 O4 -","4","0.5","NK2195","Purdy, Andrew; Parrish, Damon","<i>catena</i>-Poly[[(tetrahydrofuran-κ<i>O</i>)potassium]-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-aluminium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-potassium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>-aluminium-di-μ-dimethylamido-κ^4^<i>N</i>:<i>N</i>]","Acta Crystallographica Section E","2013","69","3","m147","","10.1107/S1600536813003553","","","0.71073","MoKα","","0.0475","0.0361","","","0.1005","0.1068","","","","","","1.027","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237537","8.274","0.003","13.745","0.004","17.113","0.005","90","","90","","90","","1946.2","1.1","93","","93","","","","","","","","","3","P n a 21","P 2c -2n","33","","2-(2,5-Dimethylphenoxy)ethanol","","- C10 H14 O2 -","- C10 H14 O2 -","- C80 H112 O16 -","8","2","NK2198","Ukai, Miho; Okuno, Tsunehisa","2-(2,5-Dimethylphenoxy)ethanol","Acta Crystallographica Section E","2013","69","3","o456","","10.1107/S1600536813005187","","","0.71075","MoKα","","","0.0457","","","","0.1214","","","","","","1.089","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237538","9.6647","0.0013","9.7281","0.001","23.684","0.003","90","","90","","90","","2226.7","0.5","296","1","296","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Hydroxy-1,1'-bis[(<i>S</i>)-1-phenylethyl]-5,5',6,6'-tetrahydro-3,4'-bipyridine-2,2'(1<i>H</i>,1'<i>H</i>)-dione","","- C26 H28 N2 O3 -","- C26 H28 N2 O3 -","- C104 H112 N8 O12 -","4","1","NR2039","Romero, Nancy; Gnecco, Dino; Terán, Joel; Bernès, Sylvain","4-Hydroxy-1,1'-bis[(<i>S</i>)-1-phenylethyl]-5,5',6,6'-tetrahydro-3,4'-bipyridine-2,2'(1<i>H</i>,1'<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","3","o408","o409","10.1107/S1600536813004017","","","0.71073","MoKα","","0.0533","0.0387","","","0.0881","0.0953","","","","","","1.042","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237539","10.1676","0.0002","10.1676","0.0002","18.9701","0.0003","90","","90","","120","","1698.39","0.05","295","","295","","","","","","","","","3","R -3 :H","-R 3","148","","Magnesium hexatellurate(IV)","","- Mg O13 Te6 -","- Mg O13 Te6 -","- Mg6 O78 Te36 -","6","0.333333","PJ2001","Shirkhanlou, Mahdi; Weil, Matthias","The Mg member of the isotypic series <i>M</i>Te~6~O~13~","Acta Crystallographica Section E","2013","69","3","i18","","10.1107/S1600536813003875","","","0.71073","MoKα","","0.0184","0.017","","","0.0335","0.0339","","","","","","1.357","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237540","15.917","0.015","13.768","0.013","17.808","0.016","90","","105.216","0.015","90","","3766","6","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Chlorido[2,3,5,6-tetrakis(<i>tert</i>-butylsulfanylmethyl)phenyl-κ^3^<i>S</i>^2^,<i>C</i>^1^,<i>S</i>^6^]palladium(II) dichloromethane monosolvate","","- C27 H47 Cl3 Pd S4 -","- C27 H47 Cl3 Pd S4 -","- C108 H188 Cl12 Pd4 S16 -","4","1","PK2463","Paz-Morales, Evelyn; Hernández-Ortega, Simón; Morales-Morales, David","Chlorido[2,3,5,6-tetrakis(<i>tert</i>-butylsulfanylmethyl)phenyl-κ^3^<i>S</i>^2^,<i>C</i>^1^,<i>S</i>^6^]palladium(II) dichloromethane monosolvate","Acta Crystallographica Section E","2013","69","3","m139","m140","10.1107/S1600536813003036","","","0.71073","MoKα","","0.0676","0.0476","","","0.1026","0.1098","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237541","14.9638","0.0002","7.9191","0.0001","13.6394","0.0002","90","","92.56","","90","","1614.65","0.04","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2,7-Dimethoxynaphthalen-1-yl)(4-methoxyphenyl)methanone","","- C20 H18 O4 -","- C20 H18 O4 -","- C80 H72 O16 -","4","1","PK2464","Sasagawa, Kosuke; Sakamoto, Rei; Hijikata, Daichi; Okamoto, Akiko; Yonezawa, Noriyuki","(2,7-Dimethoxynaphthalen-1-yl)(4-methoxyphenyl)methanone","Acta Crystallographica Section E","2013","69","3","o363","","10.1107/S1600536813003218","","","1.5418","CuKα","","0.0408","0.0383","","","0.102","0.1056","","","","","","1.047","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237542","8.84367","0.00012","8.839","0.00012","17.2662","0.0002","90","","103.674","0.0014","90","","1311.43","0.03","100.1","","100.1","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Di-μ~2~-chlorido-bis[chlorido(η^5^-2,3,4,5-tetramethyl-1-propylcyclopentadienyl)iridium(III)]","","- C24 H38 Cl4 Ir2 -","- C24 H38 Cl4 Ir2 -","- C48 H76 Cl8 Ir4 -","2","0.5","PK2466","Merola, Joseph S.; Morris, David; De Weerd, Nicholas","Di-μ~2~-chlorido-bis[chlorido(η^5^-2,3,4,5-tetramethyl-1-propylcyclopentadienyl)iridium(III)]","Acta Crystallographica Section E","2013","69","3","m176","","10.1107/S1600536813005072","","","0.7107","MoKα","","0.0244","0.0194","","","0.038","0.0396","","","","","","1.056","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237543","7.6372","0.001","13.7067","0.0016","17.083","0.002","90","","90","","90","","1788.3","0.4","113","2","113","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1β,15α-Dihydroxy-16α,17-epoxypregn-4-ene-3,20-dione","","- C21 H28 O5 -","- C21 H28 O5 -","- C84 H112 O20 -","4","1","PV2620","Shen, Yan-Bing; Wang, Yi-Bo; Luo, Jian-Mei; Wang, Min","1β,15α-Dihydroxy-16α,17-epoxypregn-4-ene-3,20-dione","Acta Crystallographica Section E","2013","69","3","o447","","10.1107/S1600536813005023","","","0.71073","MoKα","","0.0568","0.0433","","","0.0711","0.0769","","","","","","0.941","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237544","8.858","0.003","10.536","0.004","8.16","0.003","90","","116.213","0.012","90","","683.2","0.4","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","3,4-Diaminobenzonitrile","3,4-Diaminobenzonitrile","","- C7 H7 N3 -","- C7 H7 N3 -","- C28 H28 N12 -","4","1","QK2053","Geiger, David K.; Parsons, Dylan E.","3,4-Diaminobenzonitrile","Acta Crystallographica Section E","2013","69","3","o452","","10.1107/S1600536813005151","","","0.71073","MoKα","","0.1103","0.0522","","","0.1061","0.1278","","","","","","0.956","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237545","12.064","0.0005","31.81","0.002","21.9207","0.0015","90","","98.029","0.005","90","","8329.7","0.9","90","0.5","90","0.5","","","","","","","","7","P 1 21 1","P 2yb","4","","Chlorido{4-ethyl-1-[1-(pyrazin-2-yl)ethylidene]thiosemicabazidato-κ<i>S</i>}bis(triphenylphosphane-κ<i>P</i>)silver(I)","","- C45 H43 Ag Cl N5 P2 S -","- C45 H43 Ag Cl N5 P2 S -","- C360 H344 Ag8 Cl8 N40 P16 S8 -","8","4","RK2386","Venkatraman, Ramaiyer; Ruddock, Kleopatra D.; Das, Himangshu S.; Hossain, Md. Alamgir; Fronczek, Frank R.","Chlorido{4-ethyl-1-[1-(pyrazin-2-yl)ethylidene]thiosemicabazidato-κ<i>S</i>}bis(triphenylphosphane-κ<i>P</i>)silver(I)","Acta Crystallographica Section E","2013","69","3","m137","m138","10.1107/S1600536813003152","","","0.71073","MoKα","","0.06","0.042","","","0.094","0.103","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237546","7.8608","0.0003","11.82","0.0005","11.9356","0.0004","105.096","0.002","98.086","0.002","101.854","0.002","1025.53","0.07","100","0.1","100","0.1","","","","","","","","3","P -1","-P 1","2","","<i>N</i>-(Pyrazin-2-yl)-1,8-naphthyridin-2-amine","","- C12 H9 N5 -","- C12 H9 N5 -","- C48 H36 N20 -","4","2","RK2390","Duan, Yan-Shan; Wang, Wen-Zhen; Wen, Yuh-Sheng; Zhu, Yu-Qin; Peng, Shie-Ming","<i>N</i>-(Pyrazin-2-yl)-1,8-naphthyridin-2-amine","Acta Crystallographica Section E","2013","69","3","o349","","10.1107/S160053681300319X","","","0.71073","MoKα","","0.045","0.0307","","","0.0721","0.0744","","","","","","0.925","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237547","10.824","0.0003","10.8382","0.0003","13.9127","0.0004","70.29","0.001","88.946","0.002","73.578","0.001","1468.47","0.07","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","1'-(1,3-Diphenyl-1<i>H</i>-pyrazol-4-yl)-1''-methyl-2',3',5',6',7',7a'-octahydro-1'<i>H</i>-dispiro[1-benzopyran-3,2'-pyrrolizine-3',3''-indoline]-2'',4-dione","","- C38 H32 N4 O3 -","- C38 H32 N4 O3 -","- C76 H64 N8 O6 -","2","1","RK2391","Jagadeesan, G.; Sethusankar, K.; Kathirvelan, D.; Haribabu, J.; Reddy, B. S. R.","1'-(1,3-Diphenyl-1<i>H</i>-pyrazol-4-yl)-1''-methyl-2',3',5',6',7',7a'-octahydro-1'<i>H</i>-dispiro[1-benzopyran-3,2'-pyrrolizine-3',3''-indoline]-2'',4-dione","Acta Crystallographica Section E","2013","69","3","o317","","10.1107/S1600536813002043","","","0.71073","MoKα","","0.0946","0.0554","","","0.1439","0.1664","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237548","12.403","0.003","16.534","0.003","15.37","0.003","90","","90","","90","","3151.9","1.1","291","2","291","2","","","","","","","","5","C c c a :2","-C 2a 2ac","68","","4,4'-(Ethene-1,2-diyl)dipyridinium 4-[2-(pyridin-4-yl)ethenyl]pyridinium octacyanidomolybdate(V) tetrahydrate","","- C32 H31 Mo N12 O4 -","- C32 H31 Mo N12 O4 -","- C128 H124 Mo4 N48 O16 -","4","0.25","RZ5039","Yang, Xiao-Zhen; Hu, Ai-Yun; Yuan, Ai-Hua","4,4'-(Ethene-1,2-diyl)dipyridinium 4-[2-(pyridin-4-yl)ethenyl]pyridinium octacyanidomolybdate(V) tetrahydrate","Acta Crystallographica Section E","2013","69","3","m132","","10.1107/S1600536813002985","","","0.71073","MoKα","","0.0215","0.0205","","","0.051","0.0516","","","","","","1.085","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237549","15.7186","0.0002","11.6533","0.0002","6.8618","0.0001","90","","91.734","0.001","90","","1256.32","0.03","100","1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","bis(3,5-diamino-4<i>H</i>-1,2,4-triazol-1-ium) 3,4-dioxocyclobutane-1,2-diolate","","- C8 H12 N10 O4 -","- C8 H12 N10 O4 -","- C32 H48 N40 O16 -","4","1","RZ5040","Fun, Hoong-Kun; Loh, Wan-Sin; Johnson, Atim; Yousuf, Sammer; Eno, Ededet","Bis(3,5-diamino-4<i>H</i>-1,2,4-triazol-1-ium) 3,4-dioxocyclobutane-1,2-diolate","Acta Crystallographica Section E","2013","69","3","o353","o354","10.1107/S160053681300322X","","","0.71073","MoKα","","0.0548","0.0396","","","0.0985","0.1081","","","","","","1.033","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237550","6.5776","0.0009","10.7119","0.0014","16.516","0.002","78.459","0.003","79.743","0.003","80.765","0.003","1112.5","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-Ethyl 2-anilino-5-[3-(dimethylamino)acryloyl]-4-phenylthiophene-3-carboxylate","","- C24 H24 N2 O3 S -","- C24 H24 N2 O3 S -","- C48 H48 N4 O6 S2 -","2","1","RZ5041","Mabkhot, Yahia Nasser; Barakat, Assem; Alatibi, Fatima; Choudhary, M. Iqbal; Yousuf, Sammer","(<i>E</i>)-Ethyl 2-anilino-5-[3-(dimethylamino)acryloyl]-4-phenylthiophene-3-carboxylate","Acta Crystallographica Section E","2013","69","3","o351","","10.1107/S1600536813003231","","","0.71073","MoKα","","0.0567","0.047","","","0.1283","0.1418","","","","","","1.05","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237551","12.836","0.002","14.458","0.002","16.645","0.003","97.216","0.002","110.934","0.002","112.179","0.002","2547.6","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Tris(3,4,7,8-tetramethyl-1,10-phenanthrolin-1-ium) hexacyanidocobaltate(III) pentahydrate","","- C54 H61 Co N12 O5 -","- C54 H61 Co N12 O5 -","- C108 H122 Co2 N24 O10 -","2","1","RZ5042","Hu, Ai-Yun; Yu, Deng-Yong; Yuan, Ai-Hua","Tris(3,4,7,8-tetramethyl-1,10-phenanthrolin-1-ium) hexacyanidocobaltate(III) pentahydrate","Acta Crystallographica Section E","2013","69","3","m142","","10.1107/S1600536813003632","","","0.71073","MoKα","","0.1029","0.0575","","","0.1384","0.1545","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237552","7.86946","0.00014","27.1458","0.0005","12.849","0.0002","90","","102.267","0.001","90","","2682.17","0.08","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,8-bis(2-naphthoyl)-2,7-diethoxynaphthalene","{2,7-Diethoxy-8-[(naphthalen-2-yl)carbonyl]naphthalen-1-yl}(naphthalen-2-yl)methanone","","- C36 H28 O4 -","- C36 H28 O4 -","- C144 H112 O16 -","4","1","RZ5043","Tsumuki, Takehiro; Okamoto, Akiko; Oike, Hideaki; Yonezawa, Noriyuki","{2,7-Diethoxy-8-[(naphthalen-2-yl)carbonyl]naphthalen-1-yl}(naphthalen-2-yl)methanone","Acta Crystallographica Section E","2013","69","3","o369","","10.1107/S1600536813003577","","","1.54187","CuKα","","0.0448","0.036","","","0.0915","0.0966","","","","","","1.087","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237553","10.7654","0.0011","13.1295","0.0012","13.5498","0.0011","90.746","0.002","101.902","0.001","109.257","0.002","1762.3","0.3","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')[bis(diphenylthiophosphinoyl)methyl]lithium(I) benzene monosolvate","","- C41 H35 Li N2 P2 S2 -","- C41 H35 Li N2 P2 S2 -","- C82 H70 Li2 N4 P4 S4 -","2","1","RZ5044","Ren, Wenshan; Chantrapromma, Suchada; Fun, Hoong-Kun","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')[bis(diphenylthiophosphinoyl)methyl]lithium(I) benzene monosolvate","Acta Crystallographica Section E","2013","69","3","m160","m161","10.1107/S160053681300456X","","","0.71073","MoKα","","0.0662","0.0496","","","0.1054","0.1148","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237554","18.8076","0.0013","5.3007","0.0004","10.1439","0.0008","90","","103.425","0.007","90","","983.65","0.13","223","2","223","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(<i>Z</i>)-3-Hydroxy-4-(4-methoxyphenyl)but-3-en-2-one","","- C11 H12 O3 -","- C11 H12 O3 -","- C44 H48 O12 -","4","1","SJ5292","Fang, Wei; Hu, Jun-Ping; Wang, Mei; Chen, Mu-Zi","(<i>Z</i>)-3-Hydroxy-4-(4-methoxyphenyl)but-3-en-2-one","Acta Crystallographica Section E","2013","69","3","o359","","10.1107/S1600536813002262","","","0.71073","MoKα","","0.0528","0.0424","","","0.1069","0.113","","","","","","1.006","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237555","11.3779","0.0008","8.0954","0.0006","27.3371","0.0018","90","","90","","90","","2518","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-[3-Methoxy-5-(pyrimidin-2-yl)phenyl]pyrimidine","","- C15 H12 N4 O -","- C15 H12 N4 O -","- C120 H96 N32 O8 -","8","1","SJ5297","Hu, Jiena; Wu, Yang; Zhang, Dengqing; Li, Xianying; Jin, Wusong","2-[3-Methoxy-5-(pyrimidin-2-yl)phenyl]pyrimidine","Acta Crystallographica Section E","2013","69","3","o333","","10.1107/S1600536813002663","","","0.71073","MoKα","","0.051","0.0441","","","0.1154","0.1226","","","","","","1.039","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237556","12.5055","0.0004","5.4409","0.0002","19.5178","0.0006","90","","90.859","0.002","90","","1327.86","0.08","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(2-Bromoacetyl)phenyl benzoate","","- C15 H11 Br O3 -","- C15 H11 Br O3 -","- C60 H44 Br4 O12 -","4","1","SJ5298","Ambekar, Sachin P.; Devarajegowda, H. C.; ShylajaKumari, J.; Kumar, K. Mahesh; Kotresh, O.","3-(2-Bromoacetyl)phenyl benzoate","Acta Crystallographica Section E","2013","69","3","o322","","10.1107/S1600536813002900","","","0.71073","MoKα","","0.0437","0.0331","","","0.0889","0.0924","","","","","","1.05","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237557","25.4905","0.0011","8.6166","0.0004","23.2902","0.001","90","","92.235","0.002","90","","5111.6","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Diethyl 2,6-dimethyl-4-[4-(3-phenylacryloyloxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate hemihydrate","","- C28 H30 N O6.5 -","- C28 H30 N O6.5 -","- C224 H240 N8 O52 -","8","1","SU2546","Sharmila, P.; Suresh Kumar, C.; Ananth, Karthik; Narasimhan, S.; Aravindhan, S.","Diethyl 2,6-dimethyl-4-[4-(3-phenylacryloyloxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate hemihydrate","Acta Crystallographica Section E","2013","69","3","o389","","10.1107/S1600536813004108","","","0.71073","MoKα","","0.0782","0.0481","","","0.134","0.1462","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2237558","13.9211","0.0008","8.6383","0.0004","21.5316","0.0007","90","","90","","90","","2589.3","0.2","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Ethyl 5-methoxy-2-trifluoromethyl-1<i>H</i>-indole-3-carboxylate","","- C13 H12 F3 N O3 -","- C13 H12 F3 N O3 -","- C104 H96 F24 N8 O24 -","8","1","SU2553","Crochet, Aurelien; Alimi, Isak; Bochet, Christian G.; Fromm, Katharina M.","Ethyl 5-methoxy-2-trifluoromethyl-1<i>H</i>-indole-3-carboxylate","Acta Crystallographica Section E","2013","69","3","o339","","10.1107/S1600536813002614","","","1.54186","CuKα","","0.0411","0.0373","","","0.0948","0.0966","","","","","","1.093","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237559","10.389","0.002","11.092","0.001","12.105","0.002","63.47","0.03","79.75","0.02","71.08","0.03","1179.7","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[[aquacopper(II)]-bis[μ-<i>N</i>,<i>N</i>'-bis(pyridin-4-yl)isophthalamide]-[aquacopper(II)]-di-μ-sulfato] dimethylformamide disolvate]","","- C21 H23 Cu N5 O8 S -","- C21 H23 Cu N5 O8 S -","- C42 H46 Cu2 N10 O16 S2 -","2","1","SU2555","Zhang, Er-Peng; Wang, Li-Ping; Wang, Yu-Fei","<i>catena</i>-Poly[[[aquacopper(II)]-bis[μ-<i>N</i>,<i>N</i>'-bis(pyridin-4-yl)isophthalamide]-[aquacopper(II)]-di-μ-sulfato] dimethylformamide disolvate]","Acta Crystallographica Section E","2013","69","3","m150","m151","10.1107/S1600536813003413","","","0.71073","MoKα","","0.0643","0.0517","","","0.1153","0.1237","","","","","","1.07","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237560","9.1932","0.0004","9.8139","0.0004","17.6979","0.0007","90","","91.198","0.001","90","","1596.38","0.11","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(1'<i>S</i>,4'<i>S</i>)-5-(2,5-Dimethylphenyl)-4'-methoxy-6-oxa-3-azaspiro[bicyclo[3.1.0]hexane-2,1'-cyclohexan]-4-one","","- C18 H23 N O3 -","- C18 H23 N O3 -","- C72 H92 N4 O12 -","4","1","SU2559","He, Xing-Rui; Xu, Bing-Rong; Cheng, Jing-Li; Zhao, Jin-Hao","(1'<i>S</i>,4'<i>S</i>)-5-(2,5-Dimethylphenyl)-4'-methoxy-6-oxa-3-azaspiro[bicyclo[3.1.0]hexane-2,1'-cyclohexan]-4-one","Acta Crystallographica Section E","2013","69","3","o453","","10.1107/S1600536813005138","","","0.71073","MoKα","","0.0721","0.0451","","","0.1024","0.1221","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237561","7.636","0.002","8.082","0.002","14.599","0.004","88.689","0.004","84.24","0.004","70.148","0.004","843.1","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(1<i>RS</i>,2<i>RS</i>)-4,4'-(1-Azaniumyl-2-hydroxyethane-1,2-diyl)dipyridinium tetrachloridoplatinate(II) chloride","","- C12 H16 Cl5 N3 O Pt -","- C12 H16 Cl5 N3 O Pt -","- C24 H32 Cl10 N6 O2 Pt2 -","2","1","SU2560","Campos-Gaxiola, José J.; Almaral-Sanchez, Jorge L.; Cruz-Enríquez, Adriana; Höpfl, Herbert; Parra-Hake, Miguel","(1<i>RS</i>,2<i>RS</i>)-4,4'-(1-Azaniumyl-2-hydroxyethane-1,2-diyl)dipyridinium tetrachloridoplatinate(II) chloride","Acta Crystallographica Section E","2013","69","3","m157","m158","10.1107/S160053681300425X","","","0.71073","MoKα","","0.0396","0.0375","","","0.0903","0.0913","","","","","","1.047","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237562","15.966","0.002","5.5741","0.0015","15.629","0.004","90","","98.25","0.02","90","","1376.5","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-Bis(thiophen-3-yl)quinoxaline","","- C16 H10 N2 S2 -","- C16 H10 N2 S2 -","- C64 H40 N8 S8 -","4","1","SU2562","Crundwell, Guy; de Freitas, Jorge","2,3-Bis(thiophen-3-yl)quinoxaline","Acta Crystallographica Section E","2013","69","3","o394","","10.1107/S1600536813004248","","","0.71073","MoKα","","0.0979","0.0569","","","0.1645","0.1833","","","","","","0.923","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237563","10.9988","0.0002","25.8702","0.0005","19.2062","0.0004","90","","100.338","0.001","90","","5376.24","0.18","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","{2,7-Dimethoxy-8-[4-(propan-2-yloxy)benzoyl]naphthalen-1-yl}[4-(propan-2-yloxy)phenyl]methanone","","- C32 H32 O6 -","- C32 H32 O6 -","- C256 H256 O48 -","8","2","SU2564","Sasagawa, Kosuke; Takeuchi, Ryo; Kusakabe, Taro; Yonezawa, Noriyuki; Okamoto, Akiko","{2,7-Dimethoxy-8-[4-(propan-2-yloxy)benzoyl]naphthalen-1-yl}[4-(propan-2-yloxy)phenyl]methanone","Acta Crystallographica Section E","2013","69","3","o444","o445","10.1107/S1600536813004959","","","1.54187","CuKα","","0.0476","0.0414","","","0.1165","0.1209","","","","","","0.935","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237564","6.725","0.0007","9.3876","0.0011","14.4434","0.0014","90","","117.75","0.004","90","","806.96","0.15","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(4-Bromophenyl)acetamide","","- C8 H8 Br N O -","- C8 H8 Br N O -","- C32 H32 Br4 N4 O4 -","4","1","SU2566","Jasinski, Jerry P.; Guild, Curtis J.; Yathirajan, H. S.; Narayana, B.; Samshuddin, S.","<i>N</i>-(4-Bromophenyl)acetamide: a new polymorph","Acta Crystallographica Section E","2013","69","3","o461","","10.1107/S1600536813005448","","","0.71073","MoKα","","0.051","0.0326","","","0.0665","0.073","","","","","","1.036","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237565","4.981","0.0002","26.652","0.001","10.0545","0.0003","90","","92.139","0.002","90","","1333.84","0.08","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-[(1,3-Benzodioxol-5-yl)methyl]-4-methylbenzamide","","- C16 H15 N O3 -","- C16 H15 N O3 -","- C64 H60 N4 O12 -","4","1","TK5191","Maganhi, Stella H.; Damião, Mariana C. F. C. B.; Tavares, Maurício T.; Parise Filho, Roberto","<i>N</i>-[(1,3-Benzodioxol-5-yl)methyl]-4-methylbenzamide: an analogue of capsaicin","Acta Crystallographica Section E","2013","69","3","o332","","10.1107/S1600536813002201","","","0.71073","MoKα","","0.0851","0.05","","","0.1265","0.1489","","","","","","1.028","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237566","5.9949","0.0002","6.4007","0.0002","18.5642","0.0006","90","","90","","90","","712.34","0.04","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl)propionic acid","","- C4 H2 F6 O3 -","- C4 H2 F6 O3 -","- C16 H8 F24 O12 -","4","1","TK5193","Gerber, Thomas; Betz, Richard","3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl)propionic acid","Acta Crystallographica Section E","2013","69","3","o335","","10.1107/S1600536813003103","","","0.71073","MoKα","","0.0301","0.0292","","","0.0748","0.076","","","","","","1.05","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237567","9.1486","0.0011","9.3592","0.0013","10.2823","0.0008","69.212","0.01","82.91","0.008","77.22","0.011","801.73","0.17","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","2-[<i>N</i>-(2,4-Dimethoxyphenyl)acetamido]-1,3-thiazol-4-yl acetate","","- C15 H16 N2 O5 S -","- C15 H16 N2 O5 S -","- C30 H32 N4 O10 S2 -","2","1","TK5194","Horishny, Volodymyr; Lesyk, Roman; Kowiel, Marcin; Gzella, Andrzej K.","2-[<i>N</i>-(2,4-Dimethoxyphenyl)acetamido]-1,3-thiazol-4-yl acetate","Acta Crystallographica Section E","2013","69","3","o356","o357","10.1107/S1600536813003474","","","0.71073","MoKα","","0.0422","0.0345","","","0.0876","0.093","","","","","","1.057","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237568","8.9445","0.0005","9.5736","0.0008","9.9078","0.0009","115.509","0.009","93.381","0.006","108.144","0.006","708.96","0.12","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","2-[<i>N</i>-(4-Methoxyphenyl)acetamido]-1,3-thiazol-4-yl acetate","","- C14 H14 N2 O4 S -","- C14 H14 N2 O4 S -","- C28 H28 N4 O8 S2 -","2","1","TK5195","Horishny, Volodymyr; Lesyk, Roman; Gzella, Andrzej K.","2-[<i>N</i>-(4-Methoxyphenyl)acetamido]-1,3-thiazol-4-yl acetate","Acta Crystallographica Section E","2013","69","3","o391","","10.1107/S1600536813004236","","","0.71073","MoKα","","0.0401","0.0349","","","0.0905","0.0948","","","","","","1.059","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237569","8.9082","0.0004","13.3632","0.0006","5.833","0.0003","90","","103.403","0.005","90","","675.46","0.06","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Bromo-1<i>H</i>-pyrrolo[2,3-<i>b</i>]pyridine","","- C7 H5 Br N2 -","- C7 H5 Br N2 -","- C28 H20 Br4 N8 -","4","1","TK5196","Štarha, Pavel; Trávníček, Zdeněk","5-Bromo-1<i>H</i>-pyrrolo[2,3-<i>b</i>]pyridine","Acta Crystallographica Section E","2013","69","3","o381","","10.1107/S1600536813004157","","","0.71073","MoKα","","0.0385","0.0347","","","0.0913","0.0922","","","","","","1.128","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237570","22.9422","0.001","7.5828","0.0003","22.7319","0.001","90","","112.576","0.002","90","","3651.5","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-(4-Methoxyphenyl)-6-methylamino-5-nitro-2-phenyl-4<i>H</i>-pyran-3-carbonitrile","","- C20 H17 N3 O4 -","- C20 H17 N3 O4 -","- C160 H136 N24 O32 -","8","1","TK5197","Vishnupriya, R.; Suresh, J.; Sivakumar, S.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","4-(4-Methoxyphenyl)-6-methylamino-5-nitro-2-phenyl-4<i>H</i>-pyran-3-carbonitrile","Acta Crystallographica Section E","2013","69","3","o451","","10.1107/S1600536813004923","","","0.71073","MoKα","","0.0618","0.04","","","0.0999","0.116","","","","","","1.047","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237571","8.3246","0.0003","14.9567","0.0006","16.4461","0.0007","90","","90","","90","","2047.68","0.14","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-Allyl-5-nitro-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","","- C10 H9 N3 O3 -","- C10 H9 N3 O3 -","- C80 H72 N24 O24 -","8","1","TK5200","Ouzidan, Younès; Kandri Rodi, Youssef; Kandri Rodi, Adiba; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen","1-Allyl-5-nitro-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","3","o431","","10.1107/S1600536813004790","","","0.71073","MoKα","","0.0725","0.0565","","","0.1533","0.1681","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237572","8.19645","0.0001","11.5051","0.0002","26.4916","0.0004","90","","90","","90","","2498.18","0.07","193","2","193","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(8-Benzoyl-2,7-dimethoxynaphthalen-1-yl)(4-phenoxyphenyl)methanone","","- C32 H24 O5 -","- C32 H24 O5 -","- C128 H96 O20 -","4","1","VM2188","Sasagawa, Kosuke; Sakamoto, Rei; Takeuchi, Ryo; Yonezawa, Noriyuki; Okamoto, Akiko","(8-Benzoyl-2,7-dimethoxynaphthalen-1-yl)(4-phenoxyphenyl)methanone","Acta Crystallographica Section E","2013","69","3","o395","o396","10.1107/S1600536813004303","","","1.54187","CuKα","","0.0319","0.0315","","","0.085","0.0854","","","","","","1.044","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237573","9.622","0.005","18.404","0.005","9.734","0.005","90","","90","","90","","1723.7","1.3","293","2","293","2","","","","","","","","4","C m c m","-C 2c 2","63","","<i>catena</i>-Poly[[bis[4-(dimethylamino)pyridine-κ<i>N</i>^1^]cobalt(II)]-di-μ-azido-κ^4^<i>N</i>^1^,<i>N</i>^3^]","","- C14 H20 Co N10 -","- C14 H20 Co N10 -","- C56 H80 Co4 N40 -","4","0.25","VM2189","Guenifa, Fatiha; Zeghouan, Ouahida; Hadjadj, Nasreddine; Bendjeddou, Lamia; Merazig, Hocine","<i>catena</i>-Poly[[bis[4-(dimethylamino)pyridine-κ<i>N</i>^1^]cobalt(II)]-di-μ-azido-κ^4^<i>N</i>^1^:<i>N</i>^3^]","Acta Crystallographica Section E","2013","69","3","m175","","10.1107/S1600536813005205","","","0.71073","MoKα","","0.0479","0.032","","","0.077","0.0862","","","","","","1.073","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237574","12.253","0.0009","14.6114","0.0003","23.2442","0.0004","71.681","0.001","87.688","0.002","82.627","0.007","3917.9","0.3","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-carboxy-<i>N</i>-{[1-(2-hydroxyethyl)-3,3-dimethylindolin-2-ylidene]methylimino}anilinium) sulfate monohydrate","","- C40 H46 N6 O11 S -","- C40 H44 N6 O11 S -","- C160 H176 N24 O44 S4 -","4","2","WM2718","Gainsford, Graeme J.; Ashraf, Mohamed; Kay, Andrew J.","Bis(2-carboxy-<i>N</i>-{[1-(2-hydroxyethyl)-3,3-dimethylindolin-2-ylidene]methylimino}anilinium) sulfate monohydrate","Acta Crystallographica Section E","2013","69","3","o343","o344","10.1107/S1600536813003188","","","1.54178","CuKα","","0.0589","0.0531","","","0.1355","0.1521","","","","","","1.095","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2237575","8.9391","0.0004","9.4694","0.0004","16.9374","0.0008","90","","90","","90","","1433.72","0.11","296","2","296","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","Dineodymium(III) tricarbonate octahydrate","","- C3 H16 Nd2 O17 -","- C3 Nd2 O17 -","- C12 Nd8 O68 -","4","0.5","WM2719","Morrison, Shaunna M.; Andrade, Marcelo B.; Wenz, Michelle D.; Domanik, Kenneth J.; Downs, Robert T.","Lanthanite-(Nd), Nd~2~(CO~3~)~3~·8H~2~O","Acta Crystallographica Section E","2013","69","3","i15","i16","10.1107/S1600536813003164","","","0.71073","MoKα","","0.0232","0.0198","","","0.0537","0.0566","","","","","","1.124","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237576","9.9043","0.0002","10.2078","0.0002","18.5358","0.0004","100.773","0.002","92.019","0.002","91.458","0.002","1838.84","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis{2-[(guanidinoimino)methyl]phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}cobalt(III) chloride hemihydrate","","- C16 H19 Cl Co N8 O2.5 -","- C16 H19 Cl Co N8 O2.5 -","- C64 H76 Cl4 Co4 N32 O10 -","4","2","WM2724","Buvaylo, Elena A.; Kokozay, Vladimir N.; Vassilyeva, Olga Yu.; Skelton, Brian W.","Bis{2-[(guanidinoimino)methyl]phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}cobalt(III) chloride hemihydrate","Acta Crystallographica Section E","2013","69","3","m165","m166","10.1107/S1600536813004534","","","0.71073","MoKα","","0.0518","0.0408","","","0.1009","0.1065","","","","","","1.059","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237577","7.7501","0.0016","12.783","0.003","15.164","0.003","90","","100.35","0.03","90","","1477.8","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Butane-1,2,3,4-tetraol-κ^3^<i>O</i>^1^,<i>O</i>^2^,<i>O</i>^3^)(ethanol-κ<i>O</i>)tris(nitrato-κ^2^<i>O</i>,<i>O</i>')holmium(III)","","- C6 H16 Ho N3 O14 -","- C6 H16 Ho N3 O14 -","- C24 H64 Ho4 N12 O56 -","4","1","XU5656","Hua, Xiao-Hui; Xue, Jun-Hui; Yang, Li-Min; Xu, Yi-Zhuang; Wu, Jin-Guang","(Butane-1,2,3,4-tetraol-κ^3^<i>O</i>^1^,<i>O</i>^2^,<i>O</i>^3^)(ethanol-κ<i>O</i>)tris(nitrato-κ^2^<i>O</i>,<i>O</i>')holmium(III)","Acta Crystallographica Section E","2013","69","3","m162","m163","10.1107/S160053681300305X","","","0.71073","MoKα","","0.0319","0.0291","","","0.0595","0.0606","","","","","","1.186","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237578","8.7544","0.0004","8.0112","0.0002","20.9382","0.0009","90","","101.352","0.005","90","","1439.74","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[2-(1<i>H</i>-benzotriazol-1-yl)-1<i>H</i>-benzimidazol-1-ido]diethanolcadmium","","- C30 H28 Cd N10 O2 -","- C30 H28 Cd N10 O2 -","- C60 H56 Cd2 N20 O4 -","2","0.5","XU5670","Cao, Ping; Liu, Jia-Cheng; Hu, Dong-Cheng","Bis[2-(1<i>H</i>-benzotriazol-1-yl)-1<i>H</i>-benzimidazol-1-ido]diethanolcadmium","Acta Crystallographica Section E","2013","69","3","m134","","10.1107/S1600536813001827","","","0.71073","MoKα","","0.0976","0.0887","","","0.2167","0.2206","","","","","","1.195","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2237579","14.819","0.005","9.61","0.005","14.555","0.005","90","","118.158","0.005","90","","1827.5","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(azido-κ<i>N</i>)bis[4-(dimethylamino)pyridine-κ<i>N</i>]zinc","","- C14 H20 N10 Zn -","- C14 H20 N10 Zn -","- C56 H80 N40 Zn4 -","4","1","XU5676","Guenifa, Fatiha; Hadjadj, Nasreddine; Zeghouan, Ouahida; Bendjeddou, Lamia; Merazig, Hocine","Bis(azido-κ<i>N</i>)bis[4-(dimethylamino)pyridine-κ<i>N</i>]zinc","Acta Crystallographica Section E","2013","69","3","m169","","10.1107/S1600536813004686","","","0.71073","MoKα","","0.0483","0.033","","","0.0878","0.0977","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237580","7.8679","0.0002","17.9522","0.0003","9.8492","0.0002","90","","106.637","0.003","90","","1332.92","0.05","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquabis(2-chlorobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>^1^)cobalt(II)","","- C26 H24 Cl2 Co N4 O8 -","- C26 H24 Cl2 Co N4 O8 -","- C52 H48 Cl4 Co2 N8 O16 -","2","0.5","XU5678","Dincel, Öznur; Tercan, Barış; Öztürkkan, Füreya Elif; Necefoğlu, Hacali; Hökelek, Tuncer","Diaquabis(2-chlorobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>^1^)cobalt(II)","Acta Crystallographica Section E","2013","69","3","m173","m174","10.1107/S1600536813004984","","","0.71073","MoKα","","0.1173","0.0876","","","0.2234","0.2368","","","","","","1.227","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237581","5.2173","0.0009","8.7011","0.0015","11.1453","0.0019","75.545","0.002","81.854","0.002","76.427","0.002","474.39","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","6,7-Difluoro-1,2,3,4-tetrahydroquinoxaline-5,8-dicarbonitrile","","- C10 H6 F2 N4 -","- C10 H6 F2 N4 -","- C20 H12 F4 N8 -","2","1","YK2078","Qu, Bao-Hua; Jia, Xiao-Chuan; Li, Jing; He, Ming-Yang","6,7-Difluoro-1,2,3,4-tetrahydroquinoxaline-5,8-dicarbonitrile","Acta Crystallographica Section E","2013","69","3","o376","","10.1107/S1600536813003206","","","0.71073","MoKα","","0.0486","0.0432","","","0.1321","0.1398","","","","","","1.057","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237582","11.2047","0.0001","11.2337","0.0001","15.0317","0.0002","91.125","0.001","94.936","0.001","95.496","0.001","1875.62","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis[(<i>E</i>)-3-(4-methoxyphenyl)prop-2-enoato]triphenylantimony(V) benzene monosolvate","","- C44 H39 O6 Sb -","- C44 H39 O6 Sb -","- C88 H78 O12 Sb2 -","2","1","YK2083","Andreev, Pavel V.; Somov, Nikolay V.; Kalistratova, Olga S.; Gushchin, Alexey V.; Chuprunov, Evgeny V.","Bis[(<i>E</i>)-3-(4-methoxyphenyl)prop-2-enoato]triphenylantimony(V) benzene monosolvate","Acta Crystallographica Section E","2013","69","3","m167","","10.1107/S1600536813004674","","","0.71073","MoKα","","0.0212","0.0198","","","","0.0515","","","","","","1.091","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237583","9.55","0.002","22.698","0.005","8.748","0.002","90","","107.511","0.005","90","","1808.4","0.7","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>N</i>,<i>N</i>'-Bis(4-bromophenyl)pyridine-2,6-dicarboxamide","","- C19 H13 Br2 N3 O2 -","- C19 H13 Br2 N3 O2 -","- C76 H52 Br8 N12 O8 -","4","0.5","YK2085","Waris, Ghulam; Siddiqi, Humaira Masood; Flörke, Ulrich; Hussain, Rizwan; Butt, M. Saeed","<i>N</i>,<i>N</i>'-Bis(4-bromophenyl)pyridine-2,6-dicarboxamide","Acta Crystallographica Section E","2013","69","3","o416","","10.1107/S1600536813002705","","","0.71073","MoKα","","0.0557","0.0392","","","0.0951","0.1046","","","","","","1.015","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237584","7.9987","0.0003","7.6297","0.0002","14.35","0.0004","90","","101.386","0.003","90","","858.51","0.05","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Hydroxy-1,2-dihydro-4<i>H</i>-pyrrolo[3,2,1-<i>ij</i>]quinolin-4-one","","- C11 H9 N O2 -","- C11 H9 N O2 -","- C44 H36 N4 O8 -","4","1","YK2087","Rybakov, Victor B.; Shishkina, Svitlana V.; Ukrainets, Igor V.; Gorokhova, Olga V.; Andreeva, Xeniya V.","6-Hydroxy-1,2-dihydro-4<i>H</i>-pyrrolo[3,2,1-<i>ij</i>]quinolin-4-one","Acta Crystallographica Section E","2013","69","3","o340","","10.1107/S1600536813003000","","","0.71073","MoKα","","0.0637","0.0435","","","0.1121","0.1251","","","","","","1.066","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237585","19.863","0.0005","18.3212","0.0004","16.5349","0.0003","90","","110.763","0.001","90","","5626.5","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethyl-<i>N</i>''-[3-(trimethylazaniumyl)propyl]guanidinium bis(tetraphenylborate) acetone disolvate","","- C65 H80 B2 N4 O2 -","- C65 H80 B2 N4 O2 -","- C260 H320 B8 N16 O8 -","4","1","ZL2531","Tiritiris, Ioannis","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethyl-<i>N</i>''-[3-(trimethylazaniumyl)propyl]guanidinium bis(tetraphenylborate) acetone disolvate","Acta Crystallographica Section E","2013","69","3","o337","o338","10.1107/S1600536813003024","","","0.71073","MoKα","","0.0753","0.0454","","","0.0991","0.1133","","","","","","1.015","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237586","10.586","0.003","9.248","0.003","10.826","0.003","90","","90","","90","","1059.9","0.5","200","2","200","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","<i>rac</i>-3,3,3-Trifluorolactic acid","<i>rac</i>-3,3,3-Trifluoro-2-hydroxypropanoic acid","","- C3 H3 F3 O3 -","- C3 H3 F3 O3 -","- C24 H24 F24 O24 -","8","1","ZL2532","Gerber, Thomas; Betz, Richard","<i>rac</i>-3,3,3-Trifluorolactic acid","Acta Crystallographica Section E","2013","69","3","o336","","10.1107/S1600536813003097","","","0.71073","MoKα","","0.0368","0.0306","","","0.0768","0.0813","","","","","","1.056","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237587","9.8354","0.0008","8.0938","0.0007","25.435","0.002","90","","99.344","0.001","90","","1997.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-<i>tert</i>-Butyl 2-ethyl 5-chloro-3-(2-furoyl)-1<i>H</i>-indole-1,2-dicarboxylate","","- C21 H20 Cl N O6 -","- C21 H20 Cl N O6 -","- C84 H80 Cl4 N4 O24 -","4","1","ZL2535","Hassam, Mohammad; Smith, Vincent J.","1-<i>tert</i>-Butyl 2-ethyl 5-chloro-3-(2-furoyl)-1<i>H</i>-indole-1,2-dicarboxylate","Acta Crystallographica Section E","2013","69","3","o446","","10.1107/S1600536813005059","","","0.71073","MoKα","","0.0397","0.0335","","","0.0805","0.0839","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237588","11.022","0.002","22.606","0.005","12.123","0.002","90","","95.65","0.03","90","","3005.9","1","223.15","","223.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[aqua(μ~2~-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')(ethane-1,2-diol-κ<i>O</i>)(μ~2~-sulfato-κ^2^<i>O</i>:<i>O</i>')nickel(II)]","","- C12 H16 N2 Ni O7 S -","- C12 H16 N2 Ni O7 S -","- C96 H128 N16 Ni8 O56 S8 -","8","1","ZQ2195","Zhong, Kai-Long","Poly[aqua(μ~2~-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')(ethane-1,2-diol-κ<i>O</i>)(μ~2~-sulfato-κ^2^<i>O</i>:<i>O</i>')nickel(II)]","Acta Crystallographica Section E","2013","69","3","m154","m155","10.1107/S1600536813003772","","","0.71073","MoKα","","0.0436","0.0331","","","0.0812","0.0864","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237589","14.1249","0.0019","13.1972","0.0016","13.739","0.002","90","","102.991","0.015","90","","2495.5","0.6","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Bis[2-(thiophen-2-yl)quinoxaline-κ<i>N</i>^4^]silver(I) tetrafluoridoborate","","- C24 H16 Ag B F4 N4 S2 -","- C24 H16 Ag B F4 N4 S2 -","- C96 H64 Ag4 B4 F16 N16 S8 -","4","0.5","ZS2248","Crundwell, Guy","Bis[2-(thiophen-2-yl)quinoxaline-κ<i>N</i>^4^]silver(I) tetrafluoridoborate","Acta Crystallographica Section E","2013","69","3","m164","","10.1107/S1600536813004510","","","0.71073","MoKα","","0.0889","0.0544","","","0.1864","0.2036","","","","","","0.929","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237590","9.7919","0.0012","13.7559","0.0018","13.2761","0.0017","90","","96.165","0.003","90","","1777.9","0.4","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-1-(1-Hydroxynaphthalen-2-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one","","- C22 H20 O5 -","- C22 H20 O5 -","- C88 H80 O20 -","4","1","AA2085","Koh, Dongsoo","(<i>E</i>)-1-(1-Hydroxynaphthalen-2-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","4","o542","","10.1107/S1600536813006843","","","0.71073","MoKα","","0.1037","0.0529","","","0.1277","0.1874","","","","","","1.097","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237591","10.3074","0.0007","10.7942","0.0005","13.9432","0.001","103.554","0.005","106.487","0.006","96.846","0.005","1417.12","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Ethyl 2,6-bis(4-chlorophenyl)-4-(4-fluoroanilino)-1-(4-fluorophenyl)-1,2,5,6-tetrahydropyridine-3-carboxylate","","- C32 H26 Cl2 F2 N2 O2 -","- C32 H26 Cl2 F2 N2 O2 -","- C64 H52 Cl4 F4 N4 O4 -","2","1","BG2498","Anthal, Sumati; Brahmachari, Goutam; Das, Suvankar; Kant, Rajni; Gupta, Vivek K.","Ethyl 2,6-bis(4-chlorophenyl)-4-(4-fluoroanilino)-1-(4-fluorophenyl)-1,2,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E","2013","69","4","o506","o507","10.1107/S1600536813006090","","","0.71073","MoKα","","0.1596","0.0615","","","0.1003","0.1326","","","","","","0.933","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237592","4.5315","0.0003","16.3228","0.0007","21.7622","0.0012","90","","93.025","0.004","90","","1607.44","0.15","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-{(<i>E</i>)-[4-Bromo-2-(trifluoromethoxy)phenyl]iminomethyl}naphthalen-2-ol","","- C18 H11 Br F3 N O2 -","- C18 H11 Br F3 N O2 -","- C72 H44 Br4 F12 N4 O8 -","4","1","BG2500","Kargılı, Hakan; Macit, Mustafa; Alpaslan, Gökhan; Büyükgüngör, Orhan; Erdönmez, Ahmet","1-{(<i>E</i>)-[4-Bromo-2-(trifluoromethoxy)phenyl]iminomethyl}naphthalen-2-ol","Acta Crystallographica Section E","2013","69","4","o535","","10.1107/S160053681300679X","","","0.71073","MoKα","","0.0995","0.05","","","0.08","0.0921","","","","","","1.022","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237593","15.559","0.003","8.212","0.0016","14.665","0.003","90","","93.23","0.03","90","","1870.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2-Acetoxy-3-(naphthalen-1-yloxy)propyl](propan-2-yl)azanium chloride monohydrate","","- C18 H26 Cl N O4 -","- C18 H26 Cl N O4 -","- C72 H104 Cl4 N4 O16 -","4","1","BQ2383","Liu, Yuan-Yuan; Xu, Guang-Hui; Li, Zheng-Jie; Xu, Hong-Yu; Gu, Chang-Qing","[2-Acetoxy-3-(naphthalen-1-yloxy)propyl](propan-2-yl)azanium chloride monohydrate","Acta Crystallographica Section E","2013","69","4","o512","","10.1107/S1600536813005515","","","0.71073","MoKα","","0.1219","0.0697","","","0.1727","0.1998","","","","","","0.993","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237594","12.053","0.002","13.374","0.003","14.511","0.003","102.02","0.03","112.07","0.03","93.04","0.03","2097.8","0.9","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Bis{2,2'-[methylazanediylbis(methylene)]bis(4,6-dimethylphenolato)-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}titanium(IV) toluene sesquisolvate","","- C48.5 H58 N2 O4 Ti -","- C48.5 H57.5 N2 O4 Ti -","- C97 H115 N4 O8 Ti2 -","2","1","BR2221","Chung, Yongseog; Kim, Youngjo","Bis{2,2'-[methylazanediylbis(methylene)]bis(4,6-dimethylphenolato)-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}titanium(IV) toluene sesquisolvate","Acta Crystallographica Section E","2013","69","4","m222","","10.1107/S1600536813007022","","","0.71073","MoKα","","0.0959","0.0717","","","0.2114","0.223","","","","","","1.016","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2237595","27.883","0.005","6.001","0.005","17.256","0.005","90","","94.02","0.005","90","","2880","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Ethyl (2<i>E</i>,4<i>E</i>)-5-(3-bromophenylsulfonyl)penta-2,4-dienoate","","- C13 H13 Br O4 S -","- C13 H13 Br O4 S -","- C104 H104 Br8 O32 S8 -","8","1","BT6881","Sabari, V.; Sankar, Ulaganathan; Uma, Ramakrishnan; Aravindhan, S.","Ethyl (2<i>E</i>,4<i>E</i>)-5-(3-bromophenylsulfonyl)penta-2,4-dienoate","Acta Crystallographica Section E","2013","69","4","o488","","10.1107/S1600536813005771","","","0.71073","MoKα","","0.0719","0.0391","","","0.1003","0.1159","","","","","","1.011","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237596","7.7089","0.0006","16.3668","0.0013","8.0649","0.0006","90","","109.689","0.004","90","","958.06","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Methyl-2-vinylpyridinium phosphate","","- C8 H12 N O4 P -","- C8 H12 N O4 P -","- C32 H48 N4 O16 P4 -","4","1","BT6887","Kalaiselvi, Ganesan; Sabari, Vijayakumar; Balasubramanian, Sengottuvelan; Aravindhan, Sanmargam","3-Methyl-2-vinylpyridinium phosphate","Acta Crystallographica Section E","2013","69","4","o487","","10.1107/S160053681300576X","","","0.71073","MoKα","","0.0436","0.0373","","","0.1091","0.1135","","","","","","1.081","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237597","8.278","0.002","9.714","0.003","11.847","0.003","90","","90.578","0.009","90","","952.6","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","N-Dichloroacetyl-t-3,t-5-dimethyl-r-2,c-6-diphenylpiperidin-4-one","1-Dichloroacetyl-<i>t</i>-3,<i>t</i>-5-dimethyl-<i>r</i>-2,<i>c</i>-6-diphenylpiperidin-4-one","","- C21 H21 Cl2 N O2 -","- C21 H21 Cl2 N O2 -","- C42 H42 Cl4 N2 O4 -","2","1","BT6893","Sugumar, P.; Kayalvizhi, R.; Mini, R.; Ponnuswamy, S.; Ponnuswamy, M. N.","1-Dichloroacetyl-<i>t</i>-3,<i>t</i>-5-dimethyl-<i>r</i>-2,<i>c</i>-6-diphenylpiperidin-4-one","Acta Crystallographica Section E","2013","69","4","o609","","10.1107/S1600536813007927","","","0.71073","MoKα","","0.0353","0.032","","","0.0847","0.0878","","","","","","1.033","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237598","7.4752","0.0006","7.9065","0.0006","14.4663","0.0013","76.022","0.006","76.907","0.007","73.779","0.004","784.96","0.12","292","","292","","","","","","","","","6","P -1","-P 1","2","","<i>cis</i>-Chlorido(methylamine)bis(propane-1,3-diamine)cobalt(III) dichloride monohydrate","","- C7 H27 Cl3 Co N5 O -","- C7 H27 Cl3 Co N5 O -","- C14 H54 Cl6 Co2 N10 O2 -","2","1","BT6894","Maheshwaran, Velusamy; Manjunathan, Munisamy; Anbalagan, Krishnamoorthy; Thiruselvam, Viswanathan; Ponnuswamy, Mondikalipudur Nanjappagounder","<i>cis</i>-Chlorido(methylamine)bis(propane-1,3-diamine)cobalt(III) dichloride monohydrate","Acta Crystallographica Section E","2013","69","4","m205","m206","10.1107/S1600536813006442","","","0.71073","MoKα","","0.0474","0.0299","","","0.0527","0.0547","","","","","","0.922","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237599","11.511","0.0008","15.8583","0.0009","14.8025","0.0012","90","","109.77","0.008","90","","2542.9","0.3","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diaquabis[bis(pyrazin-2-yl) sulfide-κ<i>N</i>^4^]bis(thiocyanato-κ<i>N</i>)iron(II) monohydrate","","- C18 H18 Fe N10 O3 S4 -","- C18 H18 Fe N10 O3 S4 -","- C72 H72 Fe4 N40 O12 S16 -","4","0.5","BT6895","Wöhlert, Susanne; Jess, Inke; Näther, Christian","Diaquabis[bis(pyrazin-2-yl) sulfide-κ<i>N</i>^4^]bis(thiocyanato-κ<i>N</i>)iron(II) monohydrate","Acta Crystallographica Section E","2013","69","4","m196","","10.1107/S1600536813006314","","","0.71073","MoKα","","0.0529","0.0376","","","0.0839","0.0901","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237600","5.7151","0.0006","6.7625","0.0008","11.2915","0.0013","76.895","0.009","82.639","0.009","73.068","0.008","405.7","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[bis(2-chloropyrazine-κ<i>N</i>^4^)cadmium]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]","","- C10 H6 Cd Cl2 N6 S2 -","- C10 H6 Cd Cl2 N6 S2 -","- C10 H6 Cd Cl2 N6 S2 -","1","0.5","BT6896","Wöhlert, Susanne; Jess, Inke; Näther, Christian","<i>catena</i>-Poly[[bis(2-chloropyrazine-κ<i>N</i>^4^)cadmium]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]","Acta Crystallographica Section E","2013","69","4","m195","","10.1107/S1600536813006338","","","0.71073","MoKα","","0.0315","0.0286","","","0.0704","0.0718","","","","","","1.021","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237601","35.007","0.008","19.76","0.005","24.826","0.01","90","","127.681","0.006","90","","13591","7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-(4-Bromo-3,5,5,6,8,8-hexamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one","","- C18 H25 Br O -","- C18 H25 Br O -","- C576 H800 Br32 O32 -","32","4","BT6897","Kuhlich, Paul; Emmerling, Franziska; Kraus, Werner; Nehls, Irene; Piechotta, Christian","1-(4-Bromo-3,5,5,6,8,8-hexamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one: a precursor for phase-I metabolite of AHTN","Acta Crystallographica Section E","2013","69","4","o545","","10.1107/S1600536813006934","","","0.71073","MoKα","","0.1448","0.0634","","","0.1268","0.1468","","","","","","1.165","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237602","19.184","0.001","9.7854","0.0004","17.3468","0.0009","90","","108.624","0.004","90","","3085.9","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[[bis(methanol-κ<i>O</i>)bis(selenocyanato-κ<i>N</i>)manganese(II)]-μ-1,2-bis(pyridin-4-yl)ethane-κ^2^<i>N</i>:<i>N</i>'] 1,2-bis(pyridin-4-yl)ethane monosolvate]","","- C28 H32 Mn N6 O2 Se2 -","- C28 H32 Mn N6 O2 Se2 -","- C112 H128 Mn4 N24 O8 Se8 -","4","0.5","BT6898","Wöhlert, Susanne; Jess, Inke; Näther, Christian","<i>catena</i>-Poly[[[bis(methanol-κ<i>O</i>)bis(selenocyanato-κ<i>N</i>)manganese(II)]-μ-1,2-bis(pyridin-4-yl)ethane-κ^2^<i>N</i>:<i>N</i>'] 1,2-bis(pyridin-4-yl)ethane monosolvate]","Acta Crystallographica Section E","2013","69","4","m223","","10.1107/S1600536813007150","","","0.71073","MoKα","","0.0529","0.0424","","","0.0896","0.0938","","","","","","1.059","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237603","26.6884","0.0013","5.765","0.0003","8.7054","0.0004","90","","90","","90","","1339.4","0.11","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-Boc-L-pyroglutamic acid ethyl ester","<i>N</i>-Butoxycarbonyl-5-oxo-<i>L</i>-proline ethyl ester","","- C12 H19 N O5 -","- C12 H19 N O5 -","- C48 H76 N4 O20 -","4","1","BX2436","Rajalakshmi, P.; Srinivasan, N.; Krishnakumar, R.V.; Razak, Ibrahim Abdul; Rosli, Mohd Mustaqim","<i>N</i>-Butoxycarbonyl-5-oxo-<small>L</small>-proline ethyl ester","Acta Crystallographica Section E","2013","69","4","o567","o568","10.1107/S1600536813007265","","","1.54178","CuKα","","0.0618","0.0602","","","0.1655","0.1661","","","","","","1.09","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237604","13.2879","0.0012","5.1329","0.0005","21.149","0.0018","90","","96.622","0.002","90","","1432.9","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-<i>N</i>-(2,4-Dichlorobenzylidene)-2,5-dimethoxyaniline","","- C15 H13 Cl2 N O2 -","- C15 H13 Cl2 N O2 -","- C60 H52 Cl8 N4 O8 -","4","1","CQ2001","Pan, Yong; Guo, Hai-Fu; Ma, De-Yun","(<i>E</i>)-<i>N</i>-(2,4-Dichlorobenzylidene)-2,5-dimethoxyaniline","Acta Crystallographica Section E","2013","69","4","o469","","10.1107/S1600536813005552","","","0.71073","MoKα","","0.0373","0.0299","","","0.086","0.0929","","","","","","1.042","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237605","10.503","0.003","10.386","0.003","11.89","0.004","90","","93.484","0.003","90","","1294.6","0.7","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>cis</i>-Dichloridobis(ethyl methyl sulfide-κ<i>S</i>)oxidovanadium(IV)","","- C6 H16 Cl2 O S2 V -","- C6 H16 Cl2 O S2 V -","- C24 H64 Cl8 O4 S8 V4 -","4","1","CQ2002","Matsuura, Masatoshi; Fujihara, Takashi; Nagasawa, Akira","<i>cis</i>-Dichloridobis(ethyl methyl sulfide-κ<i>S</i>)oxidovanadium(IV)","Acta Crystallographica Section E","2013","69","4","m209","","10.1107/S1600536813006703","","","0.71073","MoKα","","0.0431","0.0305","","","0.0625","0.0655","","","","","","1.241","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237606","3.8346","0.0004","9.4848","0.0011","37.236","0.004","90","","91.81","0.002","90","","1353.6","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3-Bromo-7-methoxy-2-phenylimidazo[2,1-<i>b</i>][1,3]benzothiazole","","- C16 H11 Br N2 O S -","- C16 H11 Br N2 O S -","- C64 H44 Br4 N8 O4 S4 -","4","1","CV5391","Bunev, Alexander S.; Sukhonosova, Elena V.; Syrazhetdinova, Dinara R.; Statsyuk, Vladimir E.; Ostapenko, Gennady I.; Khrustalev, Victor N.","3-Bromo-7-methoxy-2-phenylimidazo[2,1-<i>b</i>][1,3]benzothiazole","Acta Crystallographica Section E","2013","69","4","o531","","10.1107/S1600536813006582","","","0.71073","MoKα","","0.037","0.0321","","","0.068","0.0696","","","","","","1","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237607","10.5304","0.0005","12.6363","0.0005","10.7246","0.0005","90","","92.865","0.001","90","","1425.29","0.11","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Ethyl 23-benzyl-8,11,14-trioxa-23,28,29-triazapentacyclo[19.7.1.0^2,7^.0^15,20^.0^22,27^]nonacosa-2,4,6,15(20),16,18,21,26-octaene-26-carboxylate","","- C33 H35 N3 O5 -","- C33 H35 N3 O5 -","- C66 H70 N6 O10 -","2","1","CV5393","Hieu, Truong Hong; Anh, Le Tuan; Soldatenkov, Anatoly T.; Vasil'ev, Vasily G.; Khrustalev, Victor N.","Ethyl 23-benzyl-8,11,14-trioxa-23,28,29-triazapentacyclo[19.7.1.0^2,7^.0^15,20^.0^22,27^]nonacosa-2,4,6,15(20),16,18,21,26-octaene-26-carboxylate","Acta Crystallographica Section E","2013","69","4","o565","o566","10.1107/S1600536813007241","","","0.71073","MoKα","","0.052","0.0403","","","0.0887","0.0937","","","","","","1","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237608","9.6543","0.0006","9.7591","0.0011","18.579","0.003","90","","90","","90","","1750.5","0.4","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis(4-sulfamoylanilinium) sulfate","","- C12 H18 N4 O8 S3 -","- C12 H18 N4 O8 S3 -","- C48 H72 N16 O32 S12 -","4","0.5","FB2278","Ravikumar, B.; Pandiarajan, S.; Athimoolam, S.","Bis(4-sulfamoylanilinium) sulfate","Acta Crystallographica Section E","2013","69","4","o596","","10.1107/S1600536813007216","","","0.71073","MoKα","","0.0401","0.0386","","","0.1028","0.1038","","","","","","1.048","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237609","9.6422","0.0002","12.0871","0.0003","18.4517","0.0004","90","","99.228","0.001","90","","2122.64","0.08","446","2","446","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(5-Hydroxy-2,2,8,8-tetramethyl-2<i>H</i>,8<i>H</i>-pyrano[2,3-<i>f</i>]chromen-6-yl)-3-(4-methoxyphenyl)prop-2-en-1-one","","- C26 H26 O5 -","- C26 H26 O5 -","- C104 H104 O20 -","4","1","FF2099","Pawar, Sunayna; Gopaul, Kaalin; Moodley, Thrineshan; Omondi, Bernard; Koorbanally, Neil","1-(5-Hydroxy-2,2,8,8-tetramethyl-2<i>H</i>,8<i>H</i>-pyrano[2,3-<i>f</i>]chromen-6-yl)-3-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","4","o484","","10.1107/S1600536813005734","","","0.71073","MoKα","","0.0404","0.0369","","","0.0989","0.1035","","","","","","1.014","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237610","7.7021","0.0005","13.8713","0.0012","14.2554","0.001","90","","98.096","0.002","90","","1507.84","0.19","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>-[(<i>E</i>)-3-(4-Nitrophenyl)allylidene]naphthalen-1-amine","","- C19 H14 N2 O2 -","- C19 H14 N2 O2 -","- C76 H56 N8 O8 -","4","1","FF2100","Nam, Kee Dal; Cha, Joo Hwan; Cho, Yong Seo; Lee, Jae Kyun; Pae, Ae Nim","(<i>E</i>)-<i>N</i>-[(<i>E</i>)-3-(4-Nitrophenyl)allylidene]naphthalen-1-amine","Acta Crystallographica Section E","2013","69","4","o548","","10.1107/S1600536813006417","","","0.71075","MoKα","","","0.0442","","","","0.1247","","","","","","0.999","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237611","4.5798","0.0007","9.5411","0.0016","29.136","0.005","90","","90","","90","","1273.1","0.4","93","","93","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1,3-Bis(pentafluorophenyl)urea","","- C13 H2 F10 N2 O -","- C13 H2 F10 N2 O -","- C52 H8 F40 N8 O4 -","4","1","FF2101","Okuno, Tsunehisa","A new polymorph of 1,3-bis(pentafluorophenyl)urea","Acta Crystallographica Section E","2013","69","4","o608","","10.1107/S1600536813007836","","","0.71075","MoKα","","","0.0312","","","","0.0802","","","","","","1.093","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237612","6.5766","0.0001","11.1792","0.0002","12.4355","0.0003","93.175","0.001","103.89","0.001","98.688","0.001","873.34","0.03","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-4-chlorobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(ethanol-κ<i>O</i>)copper(II)](<i>Cu</i>—<i>Cu</i>)","","- C32 H28 Cl4 Cu2 O10 -","- C32 H28 Cl4 Cu2 O10 -","- C32 H28 Cl4 Cu2 O10 -","1","0.5","FJ2617","Mollica Nardo, Viviana; Nicoló, Francesco; Saccà, Alessandro; Bruno, Giuseppe; Ielo, Ileana","Tetrakis(μ-4-chlorobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(ethanol-κ<i>O</i>)copper(II)](<i>Cu</i>—<i>Cu</i>)","Acta Crystallographica Section E","2013","69","4","m221","","10.1107/S1600536813006909","","","0.71073","MoKα","","0.0485","0.0372","","","0.0946","0.1018","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237613","4.9246","0.0009","10.016","0.0019","25.907","0.005","90","","92.845","0.004","90","","1276.3","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(4-Nitrobenzyl)-4<i>H</i>-chromen-4-one","","- C16 H11 N O4 -","- C16 H11 N O4 -","- C64 H44 N4 O16 -","4","1","FJ2618","Gopaul, Kaalin; Koorbanally, Neil Anthony; Shaikh, Mahidansha M.; Ramjugernath, Deresh; Su, Hong","3-(4-Nitrobenzyl)-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2013","69","4","o513","","10.1107/S1600536813006119","","","0.71073","MoKα","","0.0585","0.0504","","","0.1483","0.1538","","","","","","1.085","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237614","7.16505","0.00018","15.3511","0.0004","33.3834","0.0008","90","","90","","90","","3671.89","0.16","123.01","0.1","123.01","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3,5-Dimethoxy-4'-methylbiphenyl","","- C15 H16 O2 -","- C15 H16 O2 -","- C180 H192 O24 -","12","3","FJ2619","Lahtinen, Manu; Nättinen, Kalle; Nummelin, Sami","3,5-Dimethoxy-4'-methylbiphenyl","Acta Crystallographica Section E","2013","69","4","o510","o511","10.1107/S1600536813006053","","","1.5418","CuKα","","0.045","0.0387","","","0.0911","0.0941","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237615","7.9772","0.0004","12.8562","0.0007","16.1719","0.0008","90","","90","","90","","1658.53","0.15","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1<i>S</i>,3<i>R</i>,8<i>R</i>,9<i>R</i>,10<i>S</i>)-2,2-Dibromo-3,7,7,10-tetramethyl-9β,10β-epoxy-3,7,7,10-tetramethyltricyclo[6.4.0.0^1,3^]dodecane","","- C16 H24 Br2 O -","- C16 H24 Br2 O -","- C64 H96 Br8 O4 -","4","1","FJ2620","Oukhrib, Abdelouahd; Benharref, Ahmed; Saadi, Mohamed; Berraho, Moha; El Ammari, Lahcen","(1<i>S</i>,3<i>R</i>,8<i>R</i>,9<i>R</i>,10<i>S</i>)-2,2-Dibromo-3,7,7,10-tetramethyl-9β,10β-epoxy-3,7,7,10-tetramethyltricyclo[6.4.0.0^1,3^]dodecane","Acta Crystallographica Section E","2013","69","4","o521","o522","10.1107/S1600536813006077","","","0.71073","MoKα","","0.06","0.0325","","","0.0682","0.0738","","","","","","1.02","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237616","5.0676","0.0004","7.0426","0.0007","15.8394","0.0015","97.509","0.004","98.819","0.003","105.79","0.004","528.62","0.09","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","(2<i>E</i>)-2-(3-Ethoxy-2-hydroxybenzylidene)hydrazinecarboxamide","","- C10 H13 N3 O3 -","- C10 H13 N3 O3 -","- C20 H26 N6 O6 -","2","1","FJ2621","Aravindakshan, A. Ambili; Sithambaresan, M.; Kurup, M. R. Prathapachandra","(2<i>E</i>)-2-(3-Ethoxy-2-hydroxybenzylidene)hydrazinecarboxamide","Acta Crystallographica Section E","2013","69","4","o586","o587","10.1107/S1600536813007617","","","0.71073","MoKα","","0.0451","0.0373","","","0.1011","0.1085","","","","","","1.053","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237617","10.1192","0.0015","13.7078","0.0019","10.9891","0.0015","90","","102.537","0.003","90","","1488","0.4","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-2-Hydroxycinnamaldehyde","","- C9 H8 O2 -","- C9 H8 O2 -","- C72 H64 O16 -","8","2","FY2086","Kang, Ki-Tae; Kim, Sung-Gon","(<i>E</i>)-2-Hydroxycinnamaldehyde","Acta Crystallographica Section E","2013","69","4","o534","","10.1107/S1600536813006648","","","0.71073","MoKα","","0.1092","0.0517","","","0.126","0.182","","","","","","0.967","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237618","8.1957","0.0014","6.1287","0.001","32.995","0.005","90","","93.014","0.003","90","","1655","0.5","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-(4-methylbenzoyl)-2,3-dihydro-1<i>H</i>-indene-2-carboxylate","","- C20 H20 O3 -","- C20 H20 O3 -","- C80 H80 O12 -","4","1","GG2108","Xiang, Jiachen; Hu, Tingting; Wang, Jungang","Ethyl 2-(4-methylbenzoyl)-2,3-dihydro-1<i>H</i>-indene-2-carboxylate","Acta Crystallographica Section E","2013","69","4","o504","","10.1107/S1600536813005801","","","0.71073","MoKα","","0.0673","0.0486","","","0.1631","0.1867","","","","","","1.09","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237619","4.0714","0.0001","23.7463","0.0007","12.7698","0.0004","90","","102.113","0.001","90","","1207.11","0.06","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","5-chloroquinolin-8-yl furan-2-carboxylate","5-Chloroquinolin-8-yl furan-2-carboxylate","","- C14 H8 Cl N O3 -","- C14 H8 Cl N O3 -","- C56 H32 Cl4 N4 O12 -","4","1","GG2111","Moreno-Fuquen, Rodolfo; Hernandez, Geraldine; Ellena, Javier; De Simone, Carlos A.; Tenorio, Juan C.","5-Chloroquinolin-8-yl furan-2-carboxylate","Acta Crystallographica Section E","2013","69","4","o501","","10.1107/S1600536813005667","","","0.71073","MoKα","","0.0593","0.0429","","","0.1085","0.1192","","","","","","1.032","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237620","5.381","0.003","15.225","0.007","13.749","0.007","90","","94.92","0.03","90","","1122.2","1","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","5-iodo-3-phenylbenzo[c]isoxazole","5-Iodo-3-phenyl-2,1-benzoxazole","","- C13 H8 I N O -","- C13 H8 I N O -","- C52 H32 I4 N4 O4 -","4","2","GK2554","Teslenko, Yuriy; Matiychuk, Vasyl S.; Kinzhybalo, Vasyl; Lis, Tadeusz; Obushak, Mykola D.","5-Iodo-3-phenyl-2,1-benzoxazole","Acta Crystallographica Section E","2013","69","4","o508","","10.1107/S1600536813005862","","","0.71073","MoKα","","0.0578","0.0413","","","0.085","0.0898","","","","","","1","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237621","6.0297","0.0001","8.1542","0.0002","13.4163","0.0003","90","","90.491","0.002","90","","659.62","0.02","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Bromo-2-chloropyrimidin-4-amine","","- C4 H3 Br Cl N3 -","- C4 H3 Br Cl N3 -","- C16 H12 Br4 Cl4 N12 -","4","1","GK2560","Kumar, Mohan; Mallikarjunaswamy, C.; Sridhar, M. A.; Bhadregowda, D. G.; Kapoor, Kamini; Gupta, Vivek K.; Kant, Rajni","5-Bromo-2-chloropyrimidin-4-amine","Acta Crystallographica Section E","2013","69","4","o583","","10.1107/S1600536813007228","","","0.71073","MoKα","","0.0282","0.0235","","","0.0556","0.0579","","","","","","1.102","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237622","3.8992","0.0007","12.662","0.002","10.9678","0.0017","90","","97.983","0.004","90","","536.25","0.15","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>N</i>,<i>N</i>'-Bis(pyridin-3-yl)oxamide","","- C12 H10 N4 O2 -","- C12 H10 N4 O2 -","- C24 H20 N8 O4 -","2","0.5","GK2563","Liu, Shih-Miao; He, Hsiu-Yi; Chen, Jhy-Der","<i>N</i>,<i>N</i>'-Bis(pyridin-3-yl)oxamide","Acta Crystallographica Section E","2013","69","4","o560","","10.1107/S1600536813007277","","","0.71073","MoKα","","0.0636","0.0433","","","0.1116","0.1263","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237623","10.0846","0.0007","7.9104","0.0006","10.933","0.0008","90","","110.164","0.002","90","","818.71","0.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Bromochroman-4-one","","- C9 H7 Br O2 -","- C9 H7 Br O2 -","- C36 H28 Br4 O8 -","4","1","GO2082","Shaikh, Mahidansha M.; Koorbanally, Neil A.; Du Toit, Karen; Ramjugernath, Deresh; Bodenstein, Johannes","3-Bromochroman-4-one","Acta Crystallographica Section E","2013","69","4","o473","","10.1107/S1600536813005394","","","0.71073","MoKα","","0.0343","0.0251","","","0.0582","0.0609","","","","","","1.047","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237624","6.8285","0.0002","20.1939","0.0006","22.4344","0.0006","90","","90","","90","","3093.57","0.15","93","2","93","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","viridiol","1β,3β-Dihydroxy-2β-methoxyfuro[4',3',2':4,5,6]-18-norandrosta-8,11,13-triene-7,17-dione","","- C20 H18 O6 -","- C20 H18 O6 -","- C160 H144 O48 -","8","2","HB7028","Andersson, Pierre F.; Broberg, Anders; Lundberg, Daniel","The furanosteroid viridiol","Acta Crystallographica Section E","2013","69","4","o467","o468","10.1107/S1600536813005606","","","0.71073","MoKα","","0.087","0.0491","","","0.081","0.0886","","","","","","0.912","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237625","11.157","0.002","12.141","0.002","15.517","0.003","82.79","0.03","84.19","0.03","70.59","0.03","1962.8","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[2-(2,2':4',2''-Terpyridin-6'-yl-κ^2^<i>N</i>^1^,<i>N</i>^1'^)benzoato-κ<i>O</i>]manganese(II) trihydrate","","- C44 H34 Mn N6 O7 -","- C44 H34 Mn N6 O7 -","- C88 H68 Mn2 N12 O14 -","2","1","HB7038","Liu, Xinzheng","[2-(2,2':4',2''-Terpyridin-6'-yl-κ^2^<i>N</i>^1^,<i>N</i>^1'^)benzoato-κ<i>O</i>]manganese(II) trihydrate","Acta Crystallographica Section E","2013","69","4","m204","","10.1107/S1600536813006004","","","0.71073","MoKα","","0.1484","0.093","","","0.2284","0.2711","","","","","","0.997","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237626","6.5311","0.0008","35.129","0.003","14.0903","0.0014","90","","101.74","0.011","90","","3165.1","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Amino-4-(4-chlorophenyl)-4<i>H</i>-chromeno[8,7-<i>b</i>]pyridine-3-carbonitrile","","- C19 H12 Cl N3 O -","- C19 H12 Cl N3 O -","- C152 H96 Cl8 N24 O8 -","8","2","HB7046","Amr, Abd El-Galil E.; El-Agrody, Ahmed M.; Sabry, Nermien M.; Ng, Seik Weng; Tiekink, Edward R. T.","2-Amino-4-(4-chlorophenyl)-4<i>H</i>-chromeno[8,7-<i>b</i>]pyridine-3-carbonitrile","Acta Crystallographica Section E","2013","69","4","o462","o463","10.1107/S1600536813005217","","","0.71073","MoKα","","0.147","0.0613","","","0.123","0.1635","","","","","","1.014","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237627","8.9672","0.0007","10.4365","0.0008","10.9058","0.0008","103.063","0.007","106.859","0.007","111.399","0.008","844.01","0.15","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","3-Amino-1-(4-fluorophenyl)-8-methoxy-1<i>H</i>-benzo[<i>f</i>]chromene-2-carbonitrile","","- C21 H15 F N2 O2 -","- C21 H15 F N2 O2 -","- C42 H30 F2 N4 O4 -","2","1","HB7047","El-Agrody, Ahmed M.; Al-Omar, Mohamed A.; Amr, Abd El-Galil E.; Ng, Seik Weng; Tiekink, Edward R. T.","3-Amino-1-(4-fluorophenyl)-8-methoxy-1<i>H</i>-benzo[<i>f</i>]chromene-2-carbonitrile","Acta Crystallographica Section E","2013","69","4","o476","o477","10.1107/S160053681300545X","","","0.71073","MoKα","","0.0708","0.0488","","","0.1213","0.1381","","","","","","1.051","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237628","6.0823","0.0007","16.6918","0.0018","17.77","0.0016","90","","93.646","0.009","90","","1800.4","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-4-(4-bromophenyl)-6-methoxy-4<i>H</i>-benzo[<i>h</i>]chromene-3-carbonitrile","","- C21 H15 Br N2 O2 -","- C21 H15 Br N2 O2 -","- C84 H60 Br4 N8 O8 -","4","1","HB7048","Al-dies, Al-anood M.; El-Agrody, Ahmed M.; Al-Omar, Mohamed A.; Amr, Abd El-Galil E.; Ng, Seik Weng; Tiekink, Edward R. T.","2-Amino-4-(4-bromophenyl)-6-methoxy-4<i>H</i>-benzo[<i>h</i>]chromene-3-carbonitrile","Acta Crystallographica Section E","2013","69","4","o480","o481","10.1107/S1600536813005461","","","0.71073","MoKα","","0.1113","0.0526","","","0.1182","0.1497","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237629","8.7798","0.0009","9.6329","0.0006","10.913","0.0011","77.074","0.007","68.414","0.01","87.083","0.007","835.99","0.15","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","3-Amino-1-(4-fluorophenyl)-7-methoxy-1<i>H</i>-benzo[<i>f</i>]chromene-2-carbonitrile","","- C21 H15 F N2 O2 -","- C21 H15 F N2 O2 -","- C42 H30 F2 N4 O4 -","2","1","HB7049","Amr, Abd El-Galil E.; El-Agrody, Ahmed M.; Al-Omar, Mohamed A.; Ng, Seik Weng; Tiekink, Edward R. T.","3-Amino-1-(4-fluorophenyl)-7-methoxy-1<i>H</i>-benzo[<i>f</i>]chromene-2-carbonitrile","Acta Crystallographica Section E","2013","69","4","o478","o479","10.1107/S1600536813005473","","","0.71073","MoKα","","0.0797","0.0516","","","0.1216","0.145","","","","","","1.021","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237630","12.6494","0.0004","13.2145","0.0006","8.5445","0.0004","90","","100.637","0.002","90","","1403.72","0.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[(2-Azaniumylethyl)carbamoyl]phenolate‒phenol (1/1)","","- C15 H18 N2 O3 -","- C15 H18 N2 O3 -","- C60 H72 N8 O12 -","4","1","HB7050","Yebedri, Sihem; Louhibi, Samira; Bouacida, Sofiane; Ourari, Ali; Roisnel, Thierry","2-[(2-Azaniumylethyl)carbamoyl]phenolate‒phenol (1/1)","Acta Crystallographica Section E","2013","69","4","o497","","10.1107/S1600536813005849","","","0.71073","MoKα","","0.051","0.0397","","","0.0952","0.1024","","","","","","1.028","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237631","9.1491","0.0009","12.7961","0.0014","7.5828","0.0011","90","","106.317","0.013","90","","851.98","0.18","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Fluorobenzylidene)propanedinitrile","","- C10 H5 F N2 -","- C10 H5 F N2 -","- C40 H20 F4 N8 -","4","1","HB7051","El-Agrody, Ahmed M.; Al-Omar, Mohamed A.; Amr, Abd El-Galil E.; Ng, Seik Weng; Tiekink, Edward R. T.","2-(4-Fluorobenzylidene)propanedinitrile: monoclinic polymorph","Acta Crystallographica Section E","2013","69","4","o515","","10.1107/S1600536813006235","","","0.71073","MoKα","","0.0991","0.0602","","","0.157","0.1902","","","","","","1.088","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237632","7.3695","0.0005","8.2367","0.0005","14.2398","0.0007","90","","90","","90","","864.36","0.09","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","<i>o</i>-Phenylenediaminium chloride nitrate","","- C6 H10 Cl N3 O3 -","- C6 H10 Cl N3 O3 -","- C24 H40 Cl4 N12 O12 -","4","0.5","HB7052","Soudani, Sarra; Kefi, Riadh; Jelsch, Christian; Wenger, Emmanuel; Ben Nasr, Cherif","<i>o</i>-Phenylenediaminium chloride nitrate","Acta Crystallographica Section E","2013","69","4","o600","","10.1107/S1600536813007447","","","0.56085","AgKα","","0.0235","0.0235","","","0.0531","0.0531","","","","","","0.801","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237633","13.7309","0.0008","6.9177","0.0004","14.8539","0.0009","90","","90.943","0.002","90","","1410.73","0.14","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","4,5,9,9,13,19,20-Heptamethyl-23-oxo-24- oxahexacyclo[15.5.2.0^1,18^.0^4,17^.0^5,14^.0^8,13^]tetracos- 15-en-10-yl acetate","4,4,6a,6b,11,12,14b-Heptamethyl-16-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,9,10,11,12,12a,14a,14b-octadecahydro-12b,8a-(epoxymethano)picen-3-yl acetate","","- C32 H48 O4 -","- C32 H48 O4 -","- C64 H96 O8 -","2","1","HB7057","Nisar, Mohammad; Ali, Sajid; Tahir, M. Nawaz; Ahmad, Bashir; Hameed, Shahid","4,4,6a,6b,11,12,14b-Heptamethyl-16-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,9,10,11,12,12a,14a,14b-octadecahydro-12b,8a-(epoxymethano)picen-3-yl acetate","Acta Crystallographica Section E","2013","69","4","o573","","10.1107/S1600536813007253","","","0.71073","MoKα","","0.0565","0.0406","","","0.0919","0.1008","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","201979","2020-10-21","18:00:00",""
"2237634","11.136","0.0009","16.4129","0.0016","11.6066","0.0007","90","","98.17","0.007","90","","2099.9","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-[3-(4-Chlorophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]-4-phenyl-1,3-thiazole","","- C24 H17 Cl F N3 S -","- C24 H17 Cl F N3 S -","- C96 H68 Cl4 F4 N12 S4 -","4","1","HB7058","Abdel-Wahab, Bakr F.; Ng, Seik Weng; Tiekink, Edward R. T.","2-[3-(4-Chlorophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]-4-phenyl-1,3-thiazole","Acta Crystallographica Section E","2013","69","4","o576","","10.1107/S1600536813007496","","","0.71073","MoKα","","0.1061","0.0531","","","0.1095","0.1395","","","","","","1.027","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237635","7.1835","0.0008","18.62","0.002","12.2949","0.0011","90","","101.676","0.011","90","","1610.5","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Methyl-<i>N</i>'-[(3<i>Z</i>)-2-oxo-2,3-dihydro-1<i>H</i>-indol-3-ylidene]-1-phenyl-1<i>H</i>-1,2,3-triazole-4-carbohydrazide","","- C18 H14 N6 O2 -","- C18 H14 N6 O2 -","- C72 H56 N24 O8 -","4","1","HB7059","Mohamed, Hanan A.; Abdel-Wahab, Bakr F.; Ng, Seik Weng; Tiekink, Edward R. T.","5-Methyl-<i>N</i>'-[(3<i>Z</i>)-2-oxo-2,3-dihydro-1<i>H</i>-indol-3-ylidene]-1-phenyl-1<i>H</i>-1,2,3-triazole-4-carbohydrazide","Acta Crystallographica Section E","2013","69","4","o577","","10.1107/S1600536813007502","","","0.71073","MoKα","","0.1101","0.0583","","","0.1151","0.1474","","","","","","1.031","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237636","8.8438","0.0008","11.0887","0.0012","11.8001","0.0013","66.054","0.01","83.684","0.008","75.946","0.009","1025.8","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>'-[3-Cyano-4-(4-fluorophenyl)-6-methoxy-4<i>H</i>-benzo[<i>h</i>]chromen-2-yl]-<i>N</i>,<i>N</i>-dimethylmethanimidamide","","- C24 H20 F N3 O2 -","- C24 H20 F N3 O2 -","- C48 H40 F2 N6 O4 -","2","1","HG5296","Al-dies, Al-anood M.; Al-Omar, Mohamed A.; Amr, Abd El-Galil E.; El-Agrody, Ahmed M.; Ng, Seik Weng; Tiekink, Edward R. T.","<i>N</i>'-[3-Cyano-4-(4-fluorophenyl)-6-methoxy-4<i>H</i>-benzo[<i>h</i>]chromen-2-yl]-<i>N</i>,<i>N</i>-dimethylmethanimidamide","Acta Crystallographica Section E","2013","69","4","o482","o483","10.1107/S1600536813005503","","","0.71073","MoKα","","0.1047","0.0579","","","0.1422","0.1791","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237637","7.1278","0.0004","8.4434","0.0004","10.3637","0.0006","95.341","0.004","106.14","0.005","96.745","0.004","589.8","0.06","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","2-(2,6-Dichlorophenyl)-<i>N</i>-(1,3-thiazol-2-yl)acetamide","","- C11 H8 Cl2 N2 O S -","- C11 H8 Cl2 N2 O S -","- C22 H16 Cl4 N4 O2 S2 -","2","1","HG5297","Nayak, Prakash S.; Narayana, B.; Yathirajan, H. S.; Jasinski, Jerry P.; Butcher, Ray J.","2-(2,6-Dichlorophenyl)-<i>N</i>-(1,3-thiazol-2-yl)acetamide","Acta Crystallographica Section E","2013","69","4","o523","","10.1107/S1600536813006260","","","0.71073","MoKα","","0.0613","0.0405","","","0.0853","0.0958","","","","","","1.048","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237638","11.4082","0.0018","12.523","0.002","14.007","0.003","73.306","0.008","71.646","0.008","64.945","0.007","1692.8","0.5","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","7-Iodo-3,3-diphenyloctahydrobenzofuran","","- C20 H21 I O -","- C20 H21 I O -","- C80 H84 I4 O4 -","4","2","HG5298","Sohail, Muhammad; Yao-Feng, Wang; Qi, Wang; Chen, Fu-Xue","7-Iodo-3,3-diphenyloctahydrobenzofuran","Acta Crystallographica Section E","2013","69","4","o585","","10.1107/S1600536813007563","","","0.71073","MoKα","","0.0567","0.0389","","","0.0816","0.0906","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237639","7.8777","0.0001","9.6481","0.0001","24.6757","0.0003","90","","93.19","0.001","90","","1872.57","0.04","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3,3-Bis(4-bromophenylsulfanyl)-1-methylpiperidin-2-one","","- C18 H17 Br2 N O S2 -","- C18 H17 Br2 N O S2 -","- C72 H68 Br8 N4 O4 S8 -","4","1","HG5299","Zukerman-Schpector, Julio; Olivato, Paulo R.; Cerqueira Jr, Carlos R.; Contieri, Bruna; Ng, Seik Weng; Tiekink, Edward R. T.","3,3-Bis(4-bromophenylsulfanyl)-1-methylpiperidin-2-one","Acta Crystallographica Section E","2013","69","4","o556","","10.1107/S1600536813006995","","","1.5418","CuKα","","0.0311","0.0294","","","0.0754","0.0767","","","","","","1.104","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237640","9.124","0.004","9.757","0.004","10.738","0.004","104.592","0.003","110.326","0.005","101.194","0.004","824.7","0.6","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","(<i>E</i>)-[2-(1,3-Dithiolan-2-ylidene)hydrazinylidene](3-fluorophenyl)methyl 3-fluorobenzoate","","- C17 H12 F2 N2 O2 S2 -","- C17 H12 F2 N2 O2 S2 -","- C34 H24 F4 N4 O4 S4 -","2","1","HG5300","Yin, Ling","(<i>E</i>)-[2-(1,3-Dithiolan-2-ylidene)hydrazinylidene](3-fluorophenyl)methyl 3-fluorobenzoate","Acta Crystallographica Section E","2013","69","4","o571","","10.1107/S1600536813007319","","","0.71073","MoKα","","0.0387","0.0308","","","0.074","0.0757","","","","","","0.959","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237641","6.5449","0.0005","26.103","0.0017","14.3818","0.0008","90","","100.604","0.007","90","","2415","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(4-Fluorophenyl)-3-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]-<i>N</i>-phenyl-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","","- C26 H23 F N6 S -","- C26 H23 F N6 S -","- C104 H92 F4 N24 S4 -","4","1","HG5303","Abdel-Wahab, Bakr F.; Ng, Seik Weng; Tiekink, Edward R. T.","5-(4-Fluorophenyl)-3-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]-<i>N</i>-phenyl-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","Acta Crystallographica Section E","2013","69","4","o619","","10.1107/S1600536813008155","","","0.71073","MoKα","","0.0981","0.0555","","","0.1318","0.162","","","","","","1.029","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237642","13.484","0.002","8.8741","0.0015","29.959","0.005","90","","90","","90","","3584.8","1","293","","293","","","","","","","","","5","P b c n","-P 2n 2ab","60","","(2-Amino-7-methyl-4-oxidopteridine-6-carboxylato-κ^3^<i>O</i>^4^,<i>N</i>^5^,<i>O</i>^6^)(ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) dihydrate","","- C13 H21 N9 Ni O5 -","- C13 H21 N9 Ni O5 -","- C104 H168 N72 Ni8 O40 -","8","1","HY2617","Baisya, Siddhartha S.; Roy, Parag S.","(2-Amino-7-methyl-4-oxidopteridine-6-carboxylato-κ^3^<i>O</i>^4^,<i>N</i>^5^,<i>O</i>^6^)(ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) dihydrate","Acta Crystallographica Section E","2013","69","4","m193","m194","10.1107/S1600536813005898","","","0.71073","MoKα","","0.0434","0.0361","","0.0908","0.0876","0.0908","","","","","","0.9447","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237643","7.7161","0.0017","17.55","0.004","20.947","0.004","90","","96.8","0.004","90","","2816.6","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[[diaquabis{μ-4-[6-(4-carboxyphenyl)-4,4'-bipyridin-2-yl]benzoato-κ^2^<i>O</i>:<i>N</i>^1'^}copper(II)] dimethylformamide tetrasolvate]","","- C60 H62 Cu N8 O14 -","- C60 H62 Cu N8 O14 -","- C120 H124 Cu2 N16 O28 -","2","0.5","HY2619","Sun, Yabin; Song, E.; Wang, Daguang","Poly[[diaquabis{μ-4-[6-(4-carboxyphenyl)-4,4'-bipyridin-2-yl]benzoato-κ^2^<i>O</i>:<i>N</i>^1'^}copper(II)] dimethylformamide tetrasolvate]","Acta Crystallographica Section E","2013","69","4","m202","m203","10.1107/S1600536813006430","","","0.71073","MoKα","","0.1008","0.0612","","","0.1607","0.1854","","","","","","1.044","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237644","15.1157","0.0008","5.8696","0.0003","28.5419","0.0009","90","","109.682","0.003","90","","2384.4","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aquabis(4-chlorobenzoato)-κ^2^<i>O</i>,<i>O</i>';κ<i>O</i>-bis(pyridine-κ<i>N</i>)cobalt(II)","","- C24 H20 Cl2 Co N2 O5 -","- C24 H20 Cl2 Co N2 O5 -","- C96 H80 Cl8 Co4 N8 O20 -","4","1","HY2620","Chen, Ya-Li; Zhang, Chun-E; Fei, Peng; Deng, Chao; Su, Bi-Tao","Aquabis(4-chlorobenzoato)-κ^2^<i>O</i>,<i>O</i>';κ<i>O</i>-bis(pyridine-κ<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2013","69","4","m210","","10.1107/S1600536813006752","","","0.71073","MoKα","","0.0479","0.0387","","","0.0782","0.082","","","","","","1.098","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237645","9.8722","0.0003","10.7413","0.0003","13.3081","0.0003","109.319","0.001","105.045","0.001","90.374","0.001","1279.46","0.06","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Diels-Alder Adduct","Diethyl 1,8-bis(4-methylphenyl)-11-oxatricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene-9,10-dicarboxylate","","- C30 H30 O5 -","- C30 H30 O5 -","- C60 H60 O10 -","2","1","IM2419","Balakrishnan, B.; Nandakumar, Meganathan; Seshadri, Pandamangalam R.; Mohanakrishnan, Arasambattu K.","Diethyl 1,8-bis(4-methylphenyl)-11-oxatricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene-9,10-dicarboxylate","Acta Crystallographica Section E","2013","69","4","o500","","10.1107/S1600536813005291","","","0.71073","MoKα","","0.0472","0.0383","","","0.1021","0.1119","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237646","7.5966","0.0015","10.877","0.002","13.515","0.003","91.339","0.005","93.456","0.004","100.129","0.005","1096.7","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Dimethyl 1-(4-methylphenyl)-8-(thiophen-2-yl)-11-oxatricyclo[6.2.1.0^2,7^]undeca-2,4,6,9-tetraene-9,10-dicarboxylate","","- C25 H20 O5 S -","- C24.991 H19.991 O5 S0.997 -","- C49.982 H39.982 O10 S1.994 -","2","1","IM2420","Balakrishnan, B.; Nandakumar, Meganathan; Seshadri, Pandamangalam R.; Mohanakrishnan, Arasambattu K.","Dimethyl 1-(4-methylphenyl)-8-(thiophen-2-yl)-11-oxatricyclo[6.2.1.0^2,7^]undeca-2,4,6,9-tetraene-9,10-dicarboxylate","Acta Crystallographica Section E","2013","69","4","o498","o499","10.1107/S1600536813005308","","","0.71073","MoKα","","0.0572","0.0413","","","0.1161","0.129","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237647","7.2182","0.0012","9.0635","0.0014","9.9589","0.0015","79.202","0.002","71.683","0.002","85.494","0.003","607.43","0.17","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Poly[diaqua[μ~6~-4,4'-(1,4-phenylene)bis(2,6-dimethylpyridine-3,5-dicarboxylato)]dilead(II)]","","- C24 H20 N2 O10 Pb2 -","- C24 H20 N2 O10 Pb2 -","- C24 H20 N2 O10 Pb2 -","1","0.5","IM2422","Zhu, Yi; Zhang, Ming-Xing; Yang, Shan-Shan; Xiao, Feng; Zhang, Xiao-Ping; Gao, Yuan-Yuan; Li, Bing-Jie; Huang, Kun-Lin","Poly[diaqua[μ~6~-4,4'-(1,4-phenylene)bis(2,6-dimethylpyridine-3,5-dicarboxylato)]dilead(II)]","Acta Crystallographica Section E","2013","69","4","m232","m233","10.1107/S1600536813007733","","","0.71073","MoKα","","0.026","0.0221","","","0.0534","0.0552","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237648","8.6933","0.0011","11.1746","0.0018","14.8051","0.0019","87.042","0.004","74.37","0.005","75.097","0.004","1338.2","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","5,11-Ditosyl-5<i>H</i>,11<i>H</i>-dibenzo[<i>b</i>,<i>f</i>][1,5]diazocine-6,12-dione acetic acid hemisolvate","","- C29 H24 N2 O7 S2 -","- C29 H24 N2 O7 S2 -","- C58 H48 N4 O14 S4 -","2","1","IM2423","Abbassi, Najat; Bassou, Oulemda; Rakib, El Mostapha; Saadi, Mohamed; El Ammari, Lahcen","5,11-Ditosyl-5<i>H</i>,11<i>H</i>-dibenzo[<i>b</i>,<i>f</i>][1,5]diazocine-6,12-dione acetic acid hemisolvate","Acta Crystallographica Section E","2013","69","4","o614","o615","10.1107/S1600536813007903","","","0.71073","MoKα","","0.0566","0.0417","","","0.1055","0.1136","","","","","","1.021","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2237649","7.583","0.003","15.831","0.006","21.906","0.008","90","","98.516","0.003","90","","2600.7","1.7","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[bis(4-pyridinealdoxime-κ<i>N</i>^1^)zinc]-μ-benzene-1,4-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^4^] 4-pyridinealdoxime monosolvate]","","- C26 H22 N6 O7 Zn -","- C26 H22 N6 O7 Zn -","- C104 H88 N24 O28 Zn4 -","4","1","IS5248","Kumagai, Hitoshi; Kawata, Satoshi; Sakamoto, Yoshiyuki","<i>catena</i>-Poly[[[bis(4-pyridinealdoxime-κ<i>N</i>^1^)zinc]-μ-benzene-1,4-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^4^] 4-pyridinealdoxime monosolvate]","Acta Crystallographica Section E","2013","69","4","m216","","10.1107/S1600536813006107","","","0.7107","MoKα","","","0.0296","","","","0.0782","","","","","","1.06","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237650","8.9769","0.0017","5.6601","0.0012","12.753","0.002","90","","90.662","0.005","90","","647.9","0.2","100","1","100","1","","","","","","","","6","P 1 21 1","P 2yb","4","","2-Amino-5-bromopyridinium 5-chloro-2-hydroxybenzoate","","- C12 H10 Br Cl N2 O3 -","- C12 H10 Br Cl N2 O3 -","- C24 H20 Br2 Cl2 N4 O6 -","2","1","IS5251","Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Arshad, Suhana; Razak, Ibrahim Abdul","2-Amino-5-bromopyridinium 5-chloro-2-hydroxybenzoate","Acta Crystallographica Section E","2013","69","4","o537","o538","10.1107/S160053681300665X","","","0.71073","MoKα","","0.083","0.0457","","","0.0786","0.0907","","","","","","0.909","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237651","8.0784","0.0003","10.8234","0.0004","16.4366","0.0006","91.608","0.002","101.039","0.002","105.782","0.002","1352.49","0.09","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","5-Amino-6-methylquinolin-1-ium 3-carboxypropanoate","","- C14 H16 N2 O4 -","- C14 H16 N2 O4 -","- C56 H64 N8 O16 -","4","2","IS5252","Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Arshad, Suhana; Razak, Ibrahim Abdul","5-Amino-6-methylquinolin-1-ium 3-carboxypropanoate","Acta Crystallographica Section E","2013","69","4","o539","o540","10.1107/S1600536813006673","","","0.71073","MoKα","","0.0972","0.066","","","0.1706","0.1998","","","","","","1.038","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237652","5.2926","0.0002","22.1675","0.0006","10.0529","0.0003","90","","101.77","0.003","90","","1154.64","0.07","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>Z</i>)-4-[2-(2,4-Dimethylphenyl)hydrazinylidene]-3-methylpyrazol-5(1<i>H</i>)-one","","- C12 H14 N4 O -","- C12 H14 N4 O -","- C48 H56 N16 O4 -","4","1","IS5254","Sarojini, B. K.; Mohan, B. J.; Narayana, B.; Yathirajan, H. S.; Jasinski, Jerry P.; Butcher, Ray J.","(<i>Z</i>)-4-[2-(2,4-Dimethylphenyl)hydrazinylidene]-3-methylpyrazol-5(1<i>H</i>)-one","Acta Crystallographica Section E","2013","69","4","o532","","10.1107/S1600536813006661","","","1.54178","CuKα","","0.0489","0.0433","","","0.1174","0.124","","","","","","1.049","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237653","10.027","0.0011","11.2196","0.0013","21.445","0.002","90","","102.912","0.001","90","","2351.5","0.4","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-(6-Benzyl-7-oxo-1,2,3,4,5,5a,5a^1^,6,7,7a,8,12b-dodecahydrobenzo\ [<i>f</i>]cycloocta[<i>cd</i>]isoindol-8-yl)benzonitrile","4-[3-Benzyl-2-oxo-3-azatetracyclo[8.7.1.0^4,18^.0^11,16^]octadeca-11(16),12,14-trien-17-yl]benzonitrile","","- C31 H30 N2 O -","- C31 H30 N2 O -","- C124 H120 N8 O4 -","4","1","IS5255","Zhang, Yu-Long; Hu, Yi-Min","4-(6-Benzyl-7-oxo-1,2,3,4,5,5a,5a^1^,6,7,7a,8,12b-dodecahydrobenzo[<i>f</i>]cycloocta[<i>cd</i>]isoindol-8-yl)benzonitrile","Acta Crystallographica Section E","2013","69","4","o550","","10.1107/S1600536813006880","","","0.71073","MoKα","","0.0616","0.0463","","","0.1166","0.1278","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237654","9.6167","0.0002","6.4772","0.0001","11.7326","0.0004","90","","96.162","0.002","90","","726.59","0.03","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","7-nitrotropolone","2-Hydroxy-7-nitrocyclohepta-2,4,6-trien-1-one","","- C7 H5 N O4 -","- C7 H5 N O4 -","- C28 H20 N4 O16 -","4","1","KJ2222","Lyczko, Krzysztof; Lyczko, Monika","2-Hydroxy-7-nitrocyclohepta-2,4,6-trien-1-one","Acta Crystallographica Section E","2013","69","4","o536","","10.1107/S1600536813006594","","","1.54178","CuKα","","0.0393","0.0384","","","0.1046","0.1055","","","","","","1.069","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237655","5.2708","0.0001","14.8465","0.0004","19.8427","0.0005","90","","100.383","0.001","90","","1527.32","0.06","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Chlorophenyl)-2-oxoethyl naphthalene-1-carboxylate","","- C19 H13 Cl O3 -","- C19 H13 Cl O3 -","- C76 H52 Cl4 O12 -","4","1","KQ2003","Garudachari, B.; Isloor, Arun M.; Gerber, Thomas; Hosten, Eric; Betz, Richard","2-(4-Chlorophenyl)-2-oxoethyl naphthalene-1-carboxylate","Acta Crystallographica Section E","2013","69","4","o551","","10.1107/S1600536813006958","","","0.71073","MoKα","","0.0471","0.0354","","","0.0936","0.103","","","","","","1.021","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237656","10.4595","0.0002","11.902","0.0003","12.6423","0.0003","69.439","0.001","70.466","0.001","67.058","0.001","1320.95","0.05","293","2","293","2","","","","","","","","5","P 1","P 1","1","","Bis{(<i>R</i>)-1-(3-aminosulfonyl-4-methoxyphenyl)-<i>N</i>-[2-(2-ethoxyphenoxy)ethyl]propan-2-aminium} adipate tetrahydrate","","- C46 H74 N4 O18 S2 -","- C46 H74 N4 O18 S2 -","- C46 H74 N4 O18 S2 -","1","1","LD2093","Ham, Zoran; Meden, Anton; Kasunič, Marta","Bis{(<i>R</i>)-1-(3-aminosulfonyl-4-methoxyphenyl)-<i>N</i>-[2-(2-ethoxyphenoxy)ethyl]propan-2-aminium} adipate tetrahydrate","Acta Crystallographica Section E","2013","69","4","o516","o517","10.1107/S1600536813005254","","","0.71073","MoKα","","0.0667","0.0472","","","0.1268","0.1431","","","","","","0.996","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237657","8.0737","0.0004","9.9428","0.0005","15.0887","0.0008","87.77","0.001","87.779","0.003","80.678","0.004","1193.7","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-Hydroxy-6-methyl-3-[3-(thiophen-2-yl)acryloyl]-2<i>H</i>-pyran-2-one","","- C13 H10 O4 S -","- C13 H10 O4 S -","- C52 H40 O16 S4 -","4","2","LD2095","Thabti, Salima; Djedouani, Amel; Bendaas, Abderrahmen; Boufas, Sihem; Loui, Rémi; Mandon, Dominique","4-Hydroxy-6-methyl-3-[3-(thiophen-2-yl)acryloyl]-2<i>H</i>-pyran-2-one","Acta Crystallographica Section E","2013","69","4","o524","o525","10.1107/S1600536813003826","","","0.71073","MoKα","","0.0739","0.0539","","","0.1455","0.1568","","","","","","1.06","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237658","7.9174","0.0003","8.8032","0.0003","9.3585","0.0003","78.374","0.002","86.599","0.002","73.528","0.002","612.67","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl (2<i>Z</i>)-2-bromomethyl-3-(2,4-dichlorophenyl)prop-2-enoate","","- C11 H9 Br Cl2 O2 -","- C11 H9 Br Cl2 O2 -","- C22 H18 Br2 Cl4 O4 -","2","1","LD2096","Swaminathan, K.; Sethusankar, K.; Devaraj, Anthonisamy; Bakthadoss, Manickam","Methyl (2<i>Z</i>)-2-bromomethyl-3-(2,4-dichlorophenyl)prop-2-enoate","Acta Crystallographica Section E","2013","69","4","o572","","10.1107/S1600536813007368","","","0.71073","MoKα","","0.0837","0.0374","","","0.0865","0.1015","","","","","","1.002","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237659","11.0298","0.0002","12.2135","0.0004","14.8542","0.0004","92.244","0.002","95.702","0.0019","93.379","0.002","1985.64","0.09","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","4-Amino-<i>N</i>-<i>tert</i>-butyl-5-oxo-3-(propan-2-yl)-1<i>H</i>-1,2,4-triazole-1-carboxamide","","- C10 H19 N5 O2 -","- C10 H19 N5 O2 -","- C60 H114 N30 O12 -","6","3","LD2097","Kaur, Manpreet; Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Siddaraju, B. P.","Amicarbazone","Acta Crystallographica Section E","2013","69","4","o603","","10.1107/S1600536813007782","","","1.54184","CuKα","","0.0454","0.0438","","","0.1133","0.1146","","","","","","1.051","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237660","10.0845","0.0002","14.6026","0.0003","25.8591","0.0006","90","","93.414","0.002","90","","3801.25","0.14","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Cinnarizinium bis(<i>p</i>-toluenesulfonate) dihydrate","1-Benzhydryl-4-cinnamylpiperazine-1,4-diium bis(<i>p</i>-toluenesulfonate) dihydrate","","- C40 H48 N2 O8 S2 -","- C40 H48 N2 O8 S2 -","- C160 H192 N8 O32 S8 -","4","1","LH5578","Kavitha, C. N.; Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Dayananda, A. S.","Cinnarizinium bis(<i>p</i>-toluenesulfonate) dihydrate","Acta Crystallographica Section E","2013","69","4","o485","o486","10.1107/S1600536813003991","","","1.54184","CuKα","","0.0572","0.0535","","","0.1371","0.1402","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237661","7.9716","0.0009","20.665","0.003","20.194","0.004","90","","92.745","0.012","90","","3322.8","0.9","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,3-Bis(2,3,5,6-tetrafluoro-4-iodophenoxy)-2,2-bis[(2,3,5,6-tetrafluoro-4-iodophenoxy)methyl]propane","","- C29 H8 F16 I4 O4 -","- C29 H8 F16 I4 O4 -","- C116 H32 F64 I16 O16 -","4","1","LH5584","Cavallo, Gabriella; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo; Ursini, Maurizio","1,3-Bis(2,3,5,6-tetrafluoro-4-iodophenoxy)-2,2-bis[(2,3,5,6-tetrafluoro-4-iodophenoxy)methyl]propane","Acta Crystallographica Section E","2013","69","4","o579","o580","10.1107/S1600536813007605","","","0.71073","MoKα","","0.05","0.0376","","","0.0877","0.0928","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237662","9.6132","0.0009","9.8928","0.001","25.724","0.002","83.215","0.002","84.102","0.002","72.564","0.002","2311.8","0.4","100","1","100","0.1","","","","","","","","5","P -1","-P 1","2","","2-Amino-6-methyl-5-{5-[(naphthalen-2-yloxy)methyl]-1,3,4-oxadiazol-2-ylsulfanyl}-4-(3-nitrophenyl)pyridine-3-carbonitrile","","- C26 H18 N6 O4 S -","- C26 H18 N6 O4 S -","- C104 H72 N24 O16 S4 -","4","2","LH5588","Fun, Hoong-Kun; Chidan Kumar, C. S.; Patrao, Prescilla; Khader, A. M. A.; Kalluraya, Balakrishna","2-Amino-6-methyl-5-{5-[(naphthalen-2-yloxy)methyl]-1,3,4-oxadiazol-2-ylsulfanyl}-4-(3-nitrophenyl)pyridine-3-carbonitrile","Acta Crystallographica Section E","2013","69","4","o491","o492","10.1107/S1600536813005837","","","0.71073","MoKα","","0.0645","0.0563","","","0.1574","0.1638","","","","","","1.203","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237663","12.0925","0.0018","8.446","0.0012","15.109","0.002","90","","92.34","0.003","90","","1541.8","0.4","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-3-(3,5-Dimethoxyphenyl)-1-(2-methoxyphenyl)prop-2-en-1-one","","- C18 H18 O4 -","- C18 H18 O4 -","- C72 H72 O16 -","4","1","LH5589","Lim, Yoongho; Koh, Dongsoo","(<i>E</i>)-3-(3,5-Dimethoxyphenyl)-1-(2-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","4","o514","","10.1107/S1600536813006302","","","0.71073","MoKα","","0.1222","0.0425","","","0.0899","0.1316","","","","","","0.814","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237664","9.3526","0.0003","11.4793","0.0003","13.6089","0.0004","90","","93.612","0.002","90","","1458.17","0.07","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,4,6-trinitrophenyl 4-chlorobenzoate","2,4,6-Trinitrophenyl 4-chlorobenzoate","","- C13 H6 Cl N3 O8 -","- C13 H6 Cl N3 O8 -","- C52 H24 Cl4 N12 O32 -","4","1","LH5591","Moreno-Fuquen, Rodolfo; Mosquera, Fabricio; Ellena, Javier; Tenorio, Juan C.; De Simone, Carlos A.","2,4,6-Trinitrophenyl 4-chlorobenzoate","Acta Crystallographica Section E","2013","69","4","o570","","10.1107/S1600536813007332","","","0.71073","MoKα","","0.0672","0.0484","","","0.1318","0.151","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237665","11.1308","0.0008","14.7928","0.0009","23.1448","0.0017","90","","90.916","0.008","90","","3810.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tris(2,2'-bipyridine)copper(II) pentacyanidonitrosoferrate(II) methanol disolvate monohydrate","","- C37 H34 Cu Fe N12 O4 -","- C37 H34 Cu Fe N12 O4 -","- C148 H136 Cu4 Fe4 N48 O16 -","4","1","LH5592","Rusanova, Julia A.; Nesterova, Oksana V.; Zubatyuk, Roman I.; Kozachuk, Olesia V.","Tris(2,2'-bipyridine)copper(II) pentacyanidonitrosoferrate(II) methanol disolvate monohydrate","Acta Crystallographica Section E","2013","69","4","m212","m213","10.1107/S1600536813006867","","","0.71073","MoKα","","0.1008","0.0508","","","0.1038","0.1099","","","","","","1.005","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237666","6.171","0.0003","12.8881","0.0007","13.349","0.0008","89.933","0.005","76.959","0.005","82.114","0.004","1024.03","0.1","294.1","0.4","294.1","0.4","","","","","","","","5","P -1","-P 1","2","","(4-Chlorobenzoyl)(4-chlorophenyl)amino 3-(2-nitrophenyl)propanoate","","- C22 H16 Cl2 N2 O5 -","- C22 H16 Cl2 N2 O5 -","- C44 H32 Cl4 N4 O10 -","2","1","LH5593","Ding, Yi-lan; Shao, Chang-jiang","(4-Chlorobenzoyl)(4-chlorophenyl)amino 3-(2-nitrophenyl)propanoate","Acta Crystallographica Section E","2013","69","4","o561","","10.1107/S1600536813007174","","","0.7107","MoKα","","0.0651","0.0439","","","","0.1126","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237667","10.1271","0.0004","19.1711","0.0008","14.3154","0.0006","90","","91.956","0.002","90","","2777.7","0.2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","822 [Ir(Tp^Me2^)(=C(Me)-Ph-O-)Cl].CHCl~3~","Chlorido[1-(2-oxidophenyl)ethylidene][tris(3,5-dimethylpyrazol-1-yl)hydroborato]iridium(III) chloroform monosolvate","","- C24 H30 B Cl4 Ir N6 O -","- C24 H30 B Cl4 Ir N6 O -","- C96 H120 B4 Cl16 Ir4 N24 O4 -","4","1","LH5594","Santos, Laura L.; Paneque, Margarita; Mereiter, Kurt","Chlorido[1-(2-oxidophenyl)ethylidene][tris(3,5-dimethylpyrazol-1-yl)hydroborato]iridium(III) chloroform monosolvate","Acta Crystallographica Section E","2013","69","4","m224","m225","10.1107/S1600536813007344","","","0.71073","MoKα","","0.0342","0.0276","","","0.0678","0.0709","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237668","15.041","0.0005","10.546","0.0003","20.417","0.0008","90","","94.953","0.001","90","","3226.5","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Trimethylammonium 5-(2,4-dinitrophenyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate 0.125-hydrate","","- C13 H15.25 N5 O7.125 -","- C13 H15 N5 O7.125 -","- C104 H120 N40 O57 -","8","2","LH5595","Mangaiyarkarasi, Govindan; Kalaivani, Doraisamyraja","Trimethylammonium 5-(2,4-dinitrophenyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate 0.125-hydrate","Acta Crystallographica Section E","2013","69","4","o592","o593","10.1107/S1600536813007915","","","0.71073","MoKα","","0.0733","0.0448","","","0.1095","0.1302","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237669","11.9488","0.0003","9.2952","0.0003","12.4067","0.0003","90","","117.116","0.002","90","","1226.51","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-6-methylpyridinium 4-hydroxybenzoate","","- C13 H14 N2 O3 -","- C13 H14 N2 O3 -","- C52 H56 N8 O12 -","4","1","LX2273","Kannan, V.; Sugumar, P.; Brahadeeswaran, S.; Ponnuswamy, M. N.","2-Amino-6-methylpyridinium 4-hydroxybenzoate","Acta Crystallographica Section E","2013","69","4","o610","","10.1107/S1600536813007939","","","0.71073","MoKα","","0.0529","0.0412","","","0.112","0.1218","","","","","","1.041","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237670","20.7448","0.0004","6.393","0.0001","15.7434","0.0003","90","","124.309","0.001","90","","1724.64","0.06","124","2","124","2","","","","","","","","4","C 1 2 1","C 2y","5","","(3<i>R</i>,4<i>S</i>)-1-(4-Methoxyphenyl)-2-oxo-4-(3-vinylphenyl)azetidin-3-yl acetate","","- C20 H19 N O4 -","- C20 H19 N O4 -","- C80 H76 N4 O16 -","4","1","MW2104","Hao, Xiao-Dong; Xie, Cheng; Hao, Yun-Peng; Chang, Jun; Sun, Xun","(3<i>R</i>,4<i>S</i>)-1-(4-Methoxyphenyl)-2-oxo-4-(3-vinylphenyl)azetidin-3-yl acetate","Acta Crystallographica Section E","2013","69","4","o601","","10.1107/S1600536813007897","","","1.54178","CuKα","","0.026","0.0255","","","0.0688","0.0693","","","","","","1.055","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237671","11.124","0.002","22.792","0.005","12.066","0.002","90","","95.51","0.03","90","","3045.1","1","223.15","","223.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[diaquabis(μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')bis(ethane-1,2-diol-κ<i>O</i>)bis(μ-sulfato-κ^2^<i>O</i>:<i>O</i>')dicobalt(II)]","","- C24 H32 Co2 N4 O14 S2 -","- C24 H32 Co2 N4 O14 S2 -","- C96 H128 Co8 N16 O56 S8 -","4","0.5","MW2105","Zhong, Kai-Long","Poly[diaquabis(μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')bis(ethane-1,2-diol-κ<i>O</i>)bis(μ-sulfato-κ^2^<i>O</i>:<i>O</i>')dicobalt(II)]","Acta Crystallographica Section E","2013","69","4","m207","m208","10.1107/S1600536813006685","","","0.71073","MoKα","","0.0349","0.0288","","","0.075","0.078","","","","","","1.054","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237672","14.0663","0.0012","13.1359","0.0011","14.9278","0.0013","90","","90","","90","","2758.3","0.4","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Dichloridobis(1,3-diisopropyl-4,5-dimethyl-1<i>H</i>-imidazol-3-ium-2-thiolate-κ<i>S</i>)copper(II)","","- C22 H40 Cl2 Cu N4 S2 -","- C22 H40 Cl2 Cu N4 S2 -","- C88 H160 Cl8 Cu4 N16 S8 -","4","0.5","NC2307","Flörke, Ulrich; Ahmida, Aziza; Schröder, Jörg; Egold, Hans; Henkel, Gerald","Dichloridobis(1,3-diisopropyl-4,5-dimethyl-1<i>H</i>-imidazol-3-ium-2-thiolate-κ<i>S</i>)copper(II)","Acta Crystallographica Section E","2013","69","4","m211","","10.1107/S1600536813006879","","","0.71073","MoKα","","0.0633","0.043","","","0.096","0.1039","","","","","","1.065","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237673","6.3839","0.0003","12.0353","0.0005","12.8006","0.0005","108.039","0.002","96.091","0.002","100.593","0.002","905.12","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","1,3-Bis(6-methylpyridin-2-yl)-1<i>H</i>-imidazol-3-ium hexafluorophosphate","","- C17 H19 F6 N4 P -","- C17 H19 F6 N4 P -","- C34 H38 F12 N8 P2 -","2","1","NG5317","Bae, Hoyeon; Yoon, Minyoung; Sun, Ho-Jung; Lee, Dong-Heon; Park, Gyungse","1,3-Bis(6-methylpyridin-2-yl)-1<i>H</i>-imidazol-3-ium hexafluorophosphate","Acta Crystallographica Section E","2013","69","4","o549","","10.1107/S1600536813006971","","","0.71073","MoKα","","0.0545","0.0389","","","0.1179","0.1327","","","","","","0.974","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237674","12.1816","0.0005","15.2481","0.0006","7.4207","0.0004","90","","99.299","0.002","90","","1360.25","0.11","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4-Dichlorobenzyl 2-methoxybenzoate","","- C15 H12 Cl2 O3 -","- C15 H12 Cl2 O3 -","- C60 H48 Cl8 O12 -","4","1","NG5318","Isloor, Arun M.; Garudachari, B.; Gerber, Thomas; Hosten, Eric; Betz, Richard","2,4-Dichlorobenzyl 2-methoxybenzoate","Acta Crystallographica Section E","2013","69","4","o509","","10.1107/S1600536813006156","","","0.71073","MoKα","","0.0362","0.0286","","","0.0749","0.0799","","","","","","1.032","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237675","8.8721","0.00019","8.37534","0.00017","20.7445","0.0004","90","","90.436","0.0019","90","","1541.41","0.05","110","2","110","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>N</i>-(2-Methoxybenzyl)-9-(oxolan-2-yl)-9<i>H</i>-purin-6-amine","","- C17 H19 N5 O2 -","- C17 H19 N5 O2 -","- C68 H76 N20 O8 -","4","1","NG5319","Trávníček, Zdeněk; Popa, Igor; Dvořák, Zdeněk; Štarha, Pavel","<i>N</i>-(2-Methoxybenzyl)-9-(oxolan-2-yl)-9<i>H</i>-purin-6-amine","Acta Crystallographica Section E","2013","69","4","o588","","10.1107/S1600536813007721","","","0.71073","MoKα","","0.0405","0.0351","","","0.0849","0.0873","","","","","","1.043","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237676","14.2372","0.0014","8.0302","0.0008","11.3277","0.0009","90","","103.075","0.008","90","","1261.5","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,2-Bis(pyridin-2-yl)-1,3-diazinane","","- C14 H16 N4 -","- C14 H16 N4 -","- C56 H64 N16 -","4","1","NK2200","Haddad, Salim F.; Warad, Ismail; Jodeh, Shehdeh; Ben Hadda, Taibi","2,2-Bis(pyridin-2-yl)-1,3-diazinane","Acta Crystallographica Section E","2013","69","4","o569","","10.1107/S1600536813007459","","","0.71073","MoKα","","0.0621","0.0411","","","0.0926","0.108","","","","","","1.046","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237677","8.1691","0.0003","32.0736","0.0009","8.9869","0.0003","90","","112.258","0.005","90","","2179.23","0.15","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","sulfamethazine 3,5-dinitrosalicylate","2-(4-Aminobenzenesulfonamido)-4,6-dimethylpyrimidin-1-ium 2-carboxy-4,6-dinitrophenolate","","- C19 H18 N6 O9 S -","- C19 H18 N6 O9 S -","- C76 H72 N24 O36 S4 -","4","1","NK2201","Smith, Graham; Wermuth, Urs D.","2-(4-Aminobenzenesulfonamido)-4,6-dimethylpyrimidin-1-ium 2-carboxy-4,6-dinitrophenolate","Acta Crystallographica Section E","2013","69","4","o472","","10.1107/S1600536813005631","","","0.71073","MoKα","","0.0836","0.0703","","","0.1509","0.158","","","","","","1.1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237678","7.9814","0.0005","8.1158","0.0005","13.944","0.0009","97.232","0.001","102.721","0.001","107.915","0.001","819.89","0.09","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","2-Benzylsulfanyl-<i>N</i>-(1,3-dimethylimidazolidin-2-ylidene)aniline","","- C18 H21 N3 S -","- C18 H21 N3 S -","- C36 H42 N6 S2 -","2","1","NK2203","Flörke, Ulrich; Neuba, Adam; Henkel, Gerald","2-Benzylsulfanyl-<i>N</i>-(1,3-dimethylimidazolidin-2-ylidene)aniline","Acta Crystallographica Section E","2013","69","4","o554","","10.1107/S1600536813007101","","","0.71073","MoKα","","0.0376","0.0349","","","0.0927","0.095","","","","","","1.043","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237679","5.524","0.0005","7.4735","0.0005","23.1229","0.0018","90","","90","","90","","954.6","0.13","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Carboxy(phenyl)methanaminium bromide","<i>D</i>-Phenylglycinium bromide","","- C8 H10 Br N O2 -","- C8 H10 Br N O2 -","- C32 H40 Br4 N4 O8 -","4","1","PK2465","Parthasarathy, Mohanadoss; Arun Kumar, Kannan; Gopalakrishnan, Rengasamy","<small>D</small>-Phenylglycinium bromide","Acta Crystallographica Section E","2013","69","4","o470","","10.1107/S1600536813004807","","","0.71073","MoKα","","0.0255","0.0216","","","0.045","0.046","","","","","","1.032","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237680","8.76532","0.00016","11.4266","0.0002","14.1972","0.0003","99.08","0.001","99.036","0.001","104.277","0.001","1331.94","0.05","193","2","193","2","","","","","","","","3","P -1","-P 1","2","1,8-Bis(1-naphthoyl)-2,7-diethoxynaphthalene","{2,7-Diethoxy-8-[(naphthalen-1-yl)carbonyl]naphthalen-1-yl}(naphthalen-1-yl)methanone","","- C36 H28 O4 -","- C36 H28 O4 -","- C72 H56 O8 -","2","1","PK2467","Tsumuki, Takehiro; Takeuchi, Ryo; Kawano, Hiroyuki; Yonezawa, Noriyuki; Okamoto, Akiko","{2,7-Diethoxy-8-[(naphthalen-1-yl)carbonyl]naphthalen-1-yl}(naphthalen-1-yl)methanone","Acta Crystallographica Section E","2013","69","4","o495","o496","10.1107/S1600536813005710","","","1.54187","CuKα","","0.0422","0.037","","","0.1012","0.1059","","","","","","1.072","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237681","9.787","0.002","10.993","0.003","12.781","0.003","90","","95.722","0.004","90","","1368.2","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-1-(4-Fluorophenyl)‒3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-one monohydrate","","- C16 H15 F O4 -","- C16 H15 F O4 -","- C64 H60 F4 O16 -","4","1","PK2468","Payton-Stewart, Florastina; Ravi Kiran Pingali, Subramanya; Donahue, James P.","The chalcone derivative (<i>E</i>)-1-(4-fluorophenyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-one monohydrate","Acta Crystallographica Section E","2013","69","4","o558","o559","10.1107/S160053681300696X","","","0.71073","MoKα","","0.0453","0.0409","","","0.1068","0.1102","","","","","","1.023","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237682","13.5078","0.0002","7.9272","0.0001","20.9276","0.0003","90","","124.027","0.001","90","","1857.21","0.05","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(2,6-Dimethoxypyridin-3-yl)-9-methyl-9<i>H</i>-carbazole-3-sulfonamide","","- C20 H19 N3 O4 S -","- C20 H19 N3 O4 S -","- C80 H76 N12 O16 S4 -","4","1","PK2469","Shan, Guangzhi; Li, Zhuorong; Hu, Laixing; Jiang, Jiandong; Liu, Zongying","<i>N</i>-(2,6-Dimethoxypyridin-3-yl)-9-methyl-9<i>H</i>-carbazole-3-sulfonamide","Acta Crystallographica Section E","2013","69","4","o584","","10.1107/S1600536813007460","","","1.54184","CuKα","","0.035","0.0339","","","0.0876","0.0884","","","","","","1.06","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237683","11.9379","0.0003","10.3704","0.0003","16.7018","0.0005","90","","90","","90","","2067.7","0.1","290","2","290","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(3-azaniumylpyridin-1-ium) hexachloridostannate(IV) dichloride","","- C10 H16 Cl8 N4 Sn -","- C10 H16 Cl8 N4 Sn -","- C40 H64 Cl32 N16 Sn4 -","4","0.5","PK2471","van Megen, Martin; Prömper, Stephan; Reiss, Guido J.","Bis(3-azaniumylpyridin-1-ium) hexachloridostannate(IV) dichloride","Acta Crystallographica Section E","2013","69","4","m217","","10.1107/S1600536813006806","","","0.71073","MoKα","","0.031","0.0204","","","0.0414","0.0439","","","","","","1.056","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237684","11.749","0.002","11.618","0.002","10.801","0.0019","90","","115.383","0.002","90","","1332","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cyclohexane-1,4-dicarboxylic acid‒pyridinium-4-olate (1/1)","","- C13 H17 N O5 -","- C13 H17 N O5 -","- C52 H68 N4 O20 -","4","1","PK2472","Cruz-Enríquez, Adriana; Peinado-Guevara, Hector J.; Reyes-Marquez, Viviana; Höpfl, Herbert; Campos-Gaxiola, José J.","Cyclohexane-1,4-dicarboxylic acid‒pyridinium-4-olate (1/1)","Acta Crystallographica Section E","2013","69","4","o591","","10.1107/S160053681300754X","","","0.71073","MoKα","","0.075","0.0718","","","0.1587","0.1611","","","","","","1.018","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237685","13.2691","0.0015","11.0965","0.0012","14.9545","0.0017","90","","114.181","0.003","90","","2008.7","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-(4-Bromoanilino)-6-(4-chlorophenyl)-5-methoxycarbonyl-4-methyl-3,6-dihydropyrimidin-1-ium chloride","","- C19 H18 Br Cl2 N3 O2 -","- C19 H18 Br Cl2 N3 O2 -","- C76 H72 Br4 Cl8 N12 O8 -","4","1","PV2621","Venugopala, K. N.; Nayak, Susanta K.; Odhav, Bharti","2-(4-Bromoanilino)-6-(4-chlorophenyl)-5-methoxycarbonyl-4-methyl-3,6-dihydropyrimidin-1-ium chloride","Acta Crystallographica Section E","2013","69","4","o518","o519","10.1107/S1600536813006296","","","0.71073","MoKα","","0.0911","0.0444","","","0.0864","0.0959","","","","","","0.95","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237686","8.1373","0.0003","13.9025","0.0005","13.7886","0.0005","90","","92.913","0.001","90","","1557.87","0.1","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-<i>N</i>'-(3,4-Dihydroxybenzylidene)-2,4-dimethylbenzohydrazide monohydrate","","- C16 H18 N2 O4 -","- C16 H18 N2 O4 -","- C64 H72 N8 O16 -","4","1","PV2622","Taha, Muhammad; Ismail, Nor Hadiani; Jaafar, Faridahanim Mohd; Aziz, Ahmad Nazif; Yousuf, Sammer","(<i>E</i>)-<i>N</i>'-(3,4-Dihydroxybenzylidene)-2,4-dimethylbenzohydrazide monohydrate","Acta Crystallographica Section E","2013","69","4","o490","","10.1107/S1600536813005692","","","0.71073","MoKα","","0.0445","0.0397","","","0.1057","0.1105","","","","","","1.053","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237687","11.083","0.002","10.0452","0.0017","12.846","0.002","90","","105.681","0.006","90","","1376.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(3-chloropyrazin-2-yloxy)benzene","","- C14 H8 Cl2 N4 O2 -","- C14 H8 Cl2 N4 O2 -","- C56 H32 Cl8 N16 O8 -","4","1","PV2624","Srinivasan, Thothadri; Kalpana, Venkatesan; Rajakumar, Perumal; Velmurugan, Devadasan","1,4-Bis(3-chloropyrazin-2-yloxy)benzene","Acta Crystallographica Section E","2013","69","4","o611","","10.1107/S1600536813007824","","","0.71073","MoKα","","0.0429","0.0322","","","0.0837","0.0919","","","","","","1.035","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237688","8.88","0.004","17.05","0.005","13.95","0.005","90","","103.527","0.014","90","","2053.5","1.3","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2<i>E</i>,5<i>E</i>)-2,5-Bis(4-hydroxy-3-methoxybenzylidene)cyclopentanone ethanol monosolvate","","- C23 H26 O6 -","- C23 H26 O6 -","- C92 H104 O24 -","4","1","QK2050","Da'i, Muhammad; Yanuar, Arry; Meiyanto, Edy; Jenie, Umar Anggara; Supardjan, Amir Margono","(2<i>E</i>,5<i>E</i>)-2,5-Bis(4-hydroxy-3-methoxybenzylidene)cyclopentanone ethanol monosolvate","Acta Crystallographica Section E","2013","69","4","o530","","10.1107/S1600536813005229","","","0.71075","MoKα","","0.1752","0.0698","","","0.1233","0.1569","","","","","","1.004","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237689","8.3628","0.0017","9.0904","0.0018","9.5093","0.0019","71.3","0.03","76.43","0.03","78.64","0.03","659.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>-(7-Methyl-1,8-naphthyridin-2-yl)acetamide‒acetic acid (1/1)","","- C13 H15 N3 O3 -","- C13 H15 N3 O3 -","- C26 H30 N6 O6 -","2","1","QM2092","Gou, Gao-Zhang; Ma, Rui; Zhou, Qing-Di; Chi, Shao-Ming","<i>N</i>-(7-Methyl-1,8-naphthyridin-2-yl)acetamide‒acetic acid (1/1)","Acta Crystallographica Section E","2013","69","4","o489","","10.1107/S1600536813005242","","","0.71073","MoKα","","0.1563","0.0472","","","0.1121","0.1597","","","","","","0.907","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237690","6.6552","0.0007","24.872","0.003","14.8636","0.0015","90","","93.7529","0.0016","90","","2455.1","0.5","93","","93","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>Z</i>)-9-(1,2-Dichlorovinyl)-9<i>H</i>-carbazole","","- C14 H9 Cl2 N -","- C14 H9 Cl2 N -","- C112 H72 Cl16 N8 -","8","2","QM2093","Ukai, Miho; Tabata, Hideyuki; Okuno, Tsunehisa","(<i>Z</i>)-9-(1,2-Dichlorovinyl)-9<i>H</i>-carbazole","Acta Crystallographica Section E","2013","69","4","o555","","10.1107/S1600536813007137","","","0.71075","MoKα","","","0.0352","","","","0.0915","","","","","","1.041","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237691","9.064","0.002","11.417","0.003","12.311","0.003","90","","90","","90","","1274","0.5","200","2","200","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","<i>N</i>-Cyclohexyl-3-methylbenzamidine","","- C14 H20 N2 -","- C14 H20 N2 -","- C56 H80 N8 -","4","1","RK2395","Liu, Rui-Qin; Bai, Sheng-Di; Wang, Tao","<i>N</i>-Cyclohexyl-3-methylbenzamidine","Acta Crystallographica Section E","2013","69","4","o520","","10.1107/S1600536813006272","","","0.71073","MoKα","","0.0588","0.04","","","0.0871","0.0976","","","","","","1.018","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237692","9.977","0.005","14.922","0.007","11.709","0.006","90","","106.61","0.005","90","","1670.5","1.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Bis(1-benzoyl-7-methoxynaphthalen-2-yl) terephthalate","","- C44 H30 O8 -","- C44 H30 O8 -","- C88 H60 O16 -","2","0.5","RN2113","Sakamoto, Rei; Hijikata, Daichi; Isozaki, Katsuhiro; Yonezawa, Noriyuki; Okamoto, Akiko","Bis(1-benzoyl-7-methoxynaphthalen-2-yl) terephthalate","Acta Crystallographica Section E","2013","69","4","o557","","10.1107/S1600536813007186","","","0.7107","MoKα","","0.0589","0.0435","","","0.1113","0.1216","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237693","8.4974","0.0004","46.582","0.002","14.7342","0.0007","90","","103.618","0.004","90","","5668.2","0.5","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[1,2-Bis(diisopropylphosphanyl)ethane-κ^2^<i>P</i>,<i>P</i>'](carbonato-κ^2^<i>O</i>,<i>O</i>')nickel(II)","","- C15 H32 Ni O3 P2 -","- C15 H32 Ni O3 P2 -","- C180 H384 Ni12 O36 P24 -","12","3","RU2049","Morales-Becerril, Illan; Flores-Alamo, Marcos; Garcia, Juventino J.","[1,2-Bis(diisopropylphosphanyl)ethane-κ^2^<i>P</i>,<i>P</i>'](carbonato-κ^2^<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section E","2013","69","4","m200","m201","10.1107/S1600536813006521","","","0.71073","MoKα","","0.0921","0.0618","","","0.0869","0.0963","","","","","","1.087","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237694","5.4705","0.0001","5.4705","0.0001","13.0895","0.0004","90","","90","","120","","339.241","0.014","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","Ammonium diphosphitoindate(III)","","- H6 In N O6 P2 -","- H6 In N O6 P2 -","- H12 In2 N2 O12 P4 -","2","0.166667","RU2050","Hamchaoui, Farida; Rebbah, Houria; Le Fur, Eric","Ammonium diphosphitoindate(III)","Acta Crystallographica Section E","2013","69","4","i21","i22","10.1107/S160053681300771X","","","0.71073","MoKα","","0.0194","0.0172","","","0.0403","0.0408","","","","","","1.262","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2237695","9.3145","0.0004","25.3673","0.0012","9.5565","0.0005","90","","115.082","0.001","90","","2045.12","0.17","100","2","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-5-(4-ethoxyphenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide ethanol monosolvate","","- C20 H24 Cl N3 O2 S -","- C20 H24 Cl N3 O2 S -","- C80 H96 Cl4 N12 O8 S4 -","4","1","RZ5045","Quah, Ching Kheng; Fun, Hoong-Kun; Suwunwong, Thitipone; Boonnak, Nawong; Chantrapromma, Suchada","3-(4-Chlorophenyl)-5-(4-ethoxyphenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide ethanol monosolvate","Acta Crystallographica Section E","2013","69","4","o464","o465","10.1107/S1600536813005369","","","0.71073","MoKα","","0.0302","0.027","","","0.0674","0.0705","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237696","8.1435","0.0002","16.4887","0.0004","10.5506","0.0003","90","","125.882","0.002","90","","1147.84","0.06","100","0.1","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-[(2-oxo-2<i>H</i>-chromen-7-yl)oxy]acetate","","- C13 H12 O5 -","- C13 H12 O5 -","- C52 H48 O20 -","4","1","RZ5046","Fun, Hoong-Kun; Quah, Ching Kheng; Aich, Krishnendu; Das, Sangita; Goswami, Shyamaprosad","Ethyl 2-[(2-oxo-2<i>H</i>-chromen-7-yl)oxy]acetate","Acta Crystallographica Section E","2013","69","4","o502","","10.1107/S1600536813005539","","","0.71073","MoKα","","0.0805","0.0485","","","0.0988","0.1142","","","","","","1.038","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237697","14.7026","0.0003","6.2586","0.0001","14.7035","0.0003","90","","97.447","0.002","90","","1341.57","0.04","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-Hydroxymethyl-2-pivaloylamino-1,8-naphthyridine","","- C14 H17 N3 O2 -","- C14 H17 N3 O2 -","- C56 H68 N12 O8 -","4","1","RZ5047","Fun, Hoong-Kun; Quah, Ching Kheng; Aich, Krishnendu; Das, Sangita; Goswami, Shyamaprosad","7-Hydroxymethyl-2-pivaloylamino-1,8-naphthyridine","Acta Crystallographica Section E","2013","69","4","o503","","10.1107/S1600536813005527","","","0.71073","MoKα","","0.1156","0.0737","","","0.133","0.1476","","","","","","1.141","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237698","4.7548","0.0004","12.3971","0.0009","14.858","0.0011","90","","97.35","0.002","90","","868.62","0.12","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(2-Methyl-5-nitro-1<i>H</i>-imidazol-1-yl)acetone","","- C7 H9 N3 O3 -","- C7 H9 N3 O3 -","- C28 H36 N12 O12 -","4","1","RZ5048","Yousuf, Sammer; Khan, Khalid M.; Naz, Frazana; Perveen, Shahanaz; Miana, Ghulam A.","1-(2-Methyl-5-nitro-1<i>H</i>-imidazol-1-yl)acetone","Acta Crystallographica Section E","2013","69","4","o552","","10.1107/S1600536813006569","","","0.71073","MoKα","","0.0508","0.0414","","","0.1115","0.1215","","","","","","1.056","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237699","9.5969","0.0003","19.0805","0.0005","11.0678","0.0003","90","","97.387","0.001","90","","2009.84","0.1","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 4-(5-bromo-2-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","","- C21 H24 Br N O4 -","- C21 H24 Br N O4 -","- C84 H96 Br4 N4 O16 -","4","1","RZ5051","Kurbanova, Malahat M.; Huseynov, Elnur Z.; Gurbanov, Atash V.; Maharramov, Abel M.; Kia, Reza","Ethyl 4-(5-bromo-2-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","Acta Crystallographica Section E","2013","69","4","o541","","10.1107/S1600536813006739","","","0.71073","MoKα","","0.0724","0.0497","","","0.1245","0.1362","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237700","5.6565","0.0004","10.4019","0.0006","10.95","0.0005","89.693","0.004","87.202","0.005","76.412","0.005","625.49","0.07","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Phenazin-5-ium hydrogen sulfate monohydrate","","- C12 H12 N2 O5 S -","- C12 H12 N2 O5 S -","- C24 H24 N4 O10 S2 -","2","1","SJ5299","deGeorge, Joseph; Landee, Christopher P.; Turnbull, Mark M.","Phenazin-5-ium hydrogen sulfate monohydrate","Acta Crystallographica Section E","2013","69","4","o471","","10.1107/S160053681300562X","","","1.54184","CuKα","","0.0329","0.032","","","0.0874","0.0881","","","","","","1.088","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237701","9.2188","0.0005","7.2767","0.0004","9.562","0.0005","90","","93.625","0.006","90","","640.16","0.06","90","0.5","90","0.5","","","","","","","","4","P 1 21 1","P 2yb","4","","(<i>Z</i>)-1-(2-Hydroxyethyl)-4-(2-methoxybenzylidene)-2-methyl-1<i>H</i>-imidazol-5(4<i>H</i>)-one","","- C14 H16 N2 O3 -","- C14 H16 N2 O3 -","- C28 H32 N4 O6 -","2","1","SJ5304","Wu, Hongyi; Wang, Weihua; Walker, Jr, Edwin H.; Fronczek, Frank R.","(<i>Z</i>)-1-(2-Hydroxyethyl)-4-(2-methoxybenzylidene)-2-methyl-1<i>H</i>-imidazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2013","69","4","o604","o605","10.1107/S1600536813007770","","","0.71073","MoKα","","0.0334","0.0315","","","0.0852","0.0865","","","","","","1.057","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237702","7.1748","0.0003","11.7299","0.0006","15.0103","0.0007","103.224","0.004","98.569","0.004","92.181","0.004","1212.62","0.1","200","1","200","1","","","","","","","","5","P -1","-P 1","2","","Tetraaquabis(3,5-dinitrobenzoato-κ<i>O</i>^1^)magnesium tetrahydrate","","- C14 H22 Mg N4 O20 -","- C14 H22 Mg N4 O20 -","- C28 H44 Mg2 N8 O40 -","2","1","SJ5305","Smith, Graham","Tetraaquabis(3,5-dinitrobenzoato-κ<i>O</i>^1^)magnesium tetrahydrate","Acta Crystallographica Section E","2013","69","4","m215","","10.1107/S160053681300682X","","","0.71073","MoKα","","0.0475","0.0364","","","0.0874","0.0946","","","","","","0.944","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237703","6.4001","0.0004","10.2719","0.0007","10.9162","0.0008","110.928","0.006","104.327","0.006","93.937","0.005","639.6","0.08","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","Hexaaquacopper(II) bis(tetrafluoridoborate)‒pyrazine 1,4-dioxide (1/3)","","- C12 H24 B2 Cu F8 N6 O12 -","- C12 H24 B2 Cu F8 N6 O12 -","- C12 H24 B2 Cu F8 N6 O12 -","1","0.5","SJ5306","Wikaira, Jan L.; Landee, Christopher P.; Turnbull, Mark M.","Hexaaquacopper(II) bis(tetrafluoridoborate)‒pyrazine 1,4-dioxide (1/3)","Acta Crystallographica Section E","2013","69","4","m229","m230","10.1107/S1600536813007629","","","1.54184","CuKα","","0.0456","0.0453","","","0.1109","0.111","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237704","8.8081","0.0006","9.8474","0.0005","10.3292","0.0008","94.997","0.012","93.811","0.014","106.719","0.013","850.85","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)-3-(4-Methoxyphenyl)-3-[3-(4-methoxyphenyl)-1<i>H</i>-pyrazol-1-yl]prop-2-enal","","- C20 H18 N2 O3 -","- C20 H18 N2 O3 -","- C40 H36 N4 O6 -","2","1","SJ5307","Susindran, V.; Athimoolam, S.; Bahadur, S. Asath; Manikannan, R.; Muthusubramanian, S.","(<i>E</i>)-3-(4-Methoxyphenyl)-3-[3-(4-methoxyphenyl)-1<i>H</i>-pyrazol-1-yl]prop-2-enal","Acta Crystallographica Section E","2013","69","4","o594","o595","10.1107/S1600536813007678","","","0.71073","MoKα","","0.0443","0.0401","","","0.1038","0.1074","","","","","","1.041","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237705","27.85","0.03","9.281","0.01","9.981","0.011","90","","94.849","0.018","90","","2571","5","99","2","99","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(Decyloxy)phenyl 2-oxo-7-trifluoromethyl-2<i>H</i>-chromene-3-carboxylate","","- C27 H29 F3 O5 -","- C27 H29 F3 O5 -","- C108 H116 F12 O20 -","4","1","SJ5309","Palakshamurthy, B. S.; Devarajegowda, H. C.; Srinivasa, H. T.; Sreenivasa, S.; Vijithkumar","4-(Decyloxy)phenyl 2-oxo-7-trifluoromethyl-2<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section E","2013","69","4","o621","o622","10.1107/S1600536813008222","","","0.71073","MoKα","","0.1416","0.0837","","","0.1979","0.2209","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237706","8.9643","0.0011","30.539","0.006","8.9625","0.0012","90","","90","","90","","2453.6","0.7","296","2","296","2","","","","","","","","4","I b c a","-I 2b 2c","73","","Poly[μ-aqua-aqua-μ~4~-naphthalene-1,8-dicarboxylato-barium]","","- C12 H8 Ba O5 -","- C12 H8 Ba O5 -","- C96 H64 Ba8 O40 -","8","0.5","SU2556","Zhao, Dan; Li, Fei Fei; Liang, Peng; Ren, Jun-Ran; Qiu, Shen","Poly[μ-aqua-aqua-μ~4~-naphthalene-1,8-dicarboxylato-barium]: a layer structure","Acta Crystallographica Section E","2013","69","4","m219","m220","10.1107/S1600536813006259","","","0.71073","MoKα","","0.0238","0.0193","","","0.0419","0.0433","","","","","","1.054","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237707","20.623","0.004","14.626","0.003","15.471","0.003","90","","104.03","0.03","90","","4527.3","1.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{1-[(1<i>H</i>-benzimidazol-1-yl)methyl]-1<i>H</i>-imidazole-κ<i>N</i>^3^}bis(3,5-dicarboxybenzoato-κ^2^<i>O</i>^1^,<i>O</i>^1'^)nickel(II) octahydrate","","- C40 H46 N8 Ni O20 -","- C40 H46 N8 Ni O20 -","- C160 H184 N32 Ni4 O80 -","4","0.5","SU2557","Jia, Yong-Yan; Fan, Jing-Jing; Yin, Xiang-Ge; Zhao, Wen-Long","Bis{1-[(1<i>H</i>-benzimidazol-1-yl)methyl]-1<i>H</i>-imidazole-κ<i>N</i>^3^}bis(3,5-dicarboxybenzoato-κ^2^<i>O</i>^1^,<i>O</i>^1'^)nickel(II) octahydrate","Acta Crystallographica Section E","2013","69","4","m184","","10.1107/S1600536813003322","","","0.71073","MoKα","","0.0726","0.0638","","","0.1641","0.1717","","","","","","1.126","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237708","17.075","0.003","17.075","0.003","9.4536","0.0013","90","","90","","120","","2387","0.7","293","2","293","2","","","","","","","","5","P 61","P 61","169","","2-(2-Chlorophenyl)-<i>N</i>-cyclohexyl-2-oxoacetamide","","- C14 H16 Cl N O2 -","- C14 H16 Cl N O2 -","- C84 H96 Cl6 N6 O12 -","6","1","SU2558","Jin, Xiu-Dan; Wu, Jin-Long","2-(2-Chlorophenyl)-<i>N</i>-cyclohexyl-2-oxoacetamide","Acta Crystallographica Section E","2013","69","4","o505","","10.1107/S1600536813005904","","","0.71073","MoKα","","0.0706","0.0512","","","0.1379","0.1494","","","","","","1.01","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237709","9.2737","0.0005","11.6543","0.0008","18.8489","0.0014","90","","90","","90","","2037.2","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1'<i>S</i>,12'<i>R</i>,13'<i>S</i>,17'<i>S</i>)-15',15'-Dimethyl-1,2-dihydro-11',14',16',18'-tetraoxa-7'-azaspiro[indole-3,8'-pentacyclo[10.6.0.0^2,9^.0^3,7^.0^13,17^]octadecane]-2,10'-dione","","- C22 H24 N2 O6 -","- C22 H24 N2 O6 -","- C88 H96 N8 O24 -","4","1","SU2563","Sabari, V.; Ponnusamy, R.; Prasanna, R.; Raghunathan, R.; Aravindhan, S.","(1'<i>S</i>,12'<i>R</i>,13'<i>S</i>,17'<i>S</i>)-15',15'-Dimethyl-1,2-dihydro-11',14',16',18'-tetraoxa-7'-azaspiro[indole-3,8'-pentacyclo[10.6.0.0^2,9^.0^3,7^.0^13,17^]octadecane]-2,10'-dione","Acta Crystallographica Section E","2013","69","4","o466","","10.1107/S1600536813005436","","","0.71073","MoKα","","0.0518","0.0371","","","0.0828","0.0901","","","","","","1.035","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237710","7.5633","0.0015","6.7977","0.0014","21.605","0.004","90","","90.97","0.03","90","","1110.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraaqua(pyrimidine-4,6-dicarboxylato-κ^2^<i>N</i>^1^,<i>O</i>^6^)magnesium monohydrate","","- C6 H12 Mg N2 O9 -","- C6 H12 Mg N2 O9 -","- C24 H48 Mg4 N8 O36 -","4","1","SU2567","Starosta, Wojciech; Leciejewicz, Janusz; Kiegiel, Katarzyna","Tetraaqua(pyrimidine-4,6-dicarboxylato-κ^2^<i>N</i>^1^,<i>O</i>^6^)magnesium monohydrate","Acta Crystallographica Section E","2013","69","4","m189","","10.1107/S1600536813005850","","","0.71073","MoKα","","0.0743","0.0355","","","0.1044","0.1249","","","","","","1.006","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237711","13.214","0.005","12.049","0.005","9.825","0.004","90","","100.709","0.003","90","","1537","1.1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis{5-(pyridin-2-yl-κ<i>N</i>)-3-[4-(pyridin-4-yl)phenyl]-1<i>H</i>-1,2,4-triazol-1-ido-κ<i>N</i>^1^}zinc","","- C36 H28 N10 O2 Zn -","- C36 H28 N10 O2 Zn -","- C72 H56 N20 O4 Zn2 -","2","0.5","SU2568","Li, Bin","Diaquabis{5-(pyridin-2-yl-κ<i>N</i>)-3-[4-(pyridin-4-yl)phenyl]-1<i>H</i>-1,2,4-triazol-1-ido-κ<i>N</i>^1^}zinc","Acta Crystallographica Section E","2013","69","4","m214","","10.1107/S1600536813005916","","","0.71073","MoKα","","0.0968","0.0572","","","0.1313","0.1513","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237712","7.376","0.003","16.468","0.007","20.075","0.009","90","","96.123","0.006","90","","2424.6","1.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,8-Bis(4-fluorobenzoyl)naphthalen-2,7-diyl dimethanesulfonate","","- C26 H18 F2 O8 S2 -","- C26 H18 F2 O8 S2 -","- C104 H72 F8 O32 S8 -","4","0.5","SU2570","Hijikata, Daichi; Sakamoto, Rei; Isozaki, Katsuhiro; Yonezawa, Noriyuki; Okamoto, Akiko","1,8-Bis(4-fluorobenzoyl)naphthalen-2,7-diyl dimethanesulfonate","Acta Crystallographica Section E","2013","69","4","o544","","10.1107/S1600536813006788","","","0.7107","MoKα","","0.086","0.0526","","","0.1063","0.1197","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237713","26.073","0.004","5.5538","0.0008","9.7591","0.0014","90","","102.211","0.003","90","","1381.2","0.4","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,2-Bis(4-methoxyphenoxy)ethane","","- C16 H18 O4 -","- C16 H18 O4 -","- C64 H72 O16 -","4","0.5","SU2572","Ji, Jun; Zhang, XiuQin; Wang, Kai; Ju, ChaoFan; Chen, Qiang","1,2-Bis(4-methoxyphenoxy)ethane","Acta Crystallographica Section E","2013","69","4","o547","","10.1107/S1600536813007009","","","0.71073","MoKα","","0.0658","0.0463","","","0.1627","0.2244","","","","","","1.1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237714","6.9562","0.0004","17.505","0.0009","10.5304","0.0006","90","","100.124","0.005","90","","1262.3","0.12","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 2-(quinolin-8-yloxy)acetate monohydrate","","- C13 H15 N O4 -","- C13 H15 N O4 -","- C52 H60 N4 O16 -","4","1","SU2575","Kumar, Mohan; Mallikarjunaswamy, C.; Sridhar, M. A.; Bhadregowda, D. G.; Kapoor, Kamini; Gupta, Vivek K.; Kant, Rajni","Ethyl 2-(quinolin-8-yloxy)acetate monohydrate","Acta Crystallographica Section E","2013","69","4","o623","","10.1107/S1600536813008106","","","0.71073","MoKα","","0.1043","0.0531","","","0.1011","0.1226","","","","","","1.023","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237715","12.1746","0.0011","13.9614","0.0013","20.2985","0.0019","90","","90","","90","","3450.2","0.6","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","<i>N</i>-<i>tert</i>-Butyl-2-[4-(dimethylamino)phenyl]imidazo[1,2-<i>a</i>]pyrazin-3-amine","","- C18 H23 N5 -","- C18 H23 N5 -","- C144 H184 N40 -","8","1","SU2577","Fatima, Zeenat; Srinivasan, Thothadri; Koorathota, Suman; Thennarasu, Sathiah; Velmurugan, Devadasan","<i>N</i>-<i>tert</i>-Butyl-2-[4-(dimethylamino)phenyl]imidazo[1,2-<i>a</i>]pyrazin-3-amine","Acta Crystallographica Section E","2013","69","4","o612","o613","10.1107/S1600536813007861","","","0.71073","MoKα","","0.0716","0.0487","","","0.1313","0.1475","","","","","","1.028","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237716","17.7373","0.0018","7.8367","0.0007","19.4159","0.0018","90","","109.323","0.011","90","","2546.8","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-[5-(4-Fluorophenyl)-1-(4-phenyl-1,3-thiazol-2-yl)-4,5-dihydro-<i>1H</i>-pyrazol-3-yl]-5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazole","","- C28 H23 F N6 S -","- C28 H23 F N6 S -","- C112 H92 F4 N24 S4 -","4","1","SU2580","Abdel-Wahab, Bakr F.; Ng, Seik Weng; Tiekink, Edward R. T.","4-[5-(4-Fluorophenyl)-1-(4-phenyl-1,3-thiazol-2-yl)-4,5-dihydro-1<i>H</i>-pyrazol-3-yl]-5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazole","Acta Crystallographica Section E","2013","69","4","o618","","10.1107/S1600536813008179","","","0.71073","MoKα","","0.1361","0.0653","","","0.1771","0.2317","","","","","","1.058","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237717","9.9924","0.0006","13.2317","0.0008","13.2867","0.0008","116.9","0.003","92.325","0.002","98.518","0.003","1537.79","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(6'<i>R</i>*,7'<i>R</i>*)-7'-(1,3,-Diphenyl-1<i>H</i>-pyrazol-4-yl)-1,2,5',6',7',7a',3'',4''-octahydro-1'<i>H</i>,2''<i>H</i>-dispiro[acenaphthylene-1,5'-pyrrolo[1,2-<i>c</i>][1,3]thiazole-6',3''-[1]benzopyran]-2,4''-dione","","- C40 H29 N3 O3 S -","- C40 H29 N3 O3 S -","- C80 H58 N6 O6 S2 -","2","1","TK5201","Murugan, J.; Haribabu, J.; Reddy, B. S. R.; Rajarajan, G.; Murugavel, S.","(6'<i>R</i>*,7'<i>R</i>*)-7'-(1,3,-Diphenyl-1<i>H</i>-pyrazol-4-yl)-1,2,5',6',7',7a',3'',4''-octahydro-1'<i>H</i>,2''<i>H</i>-dispiro[acenaphthylene-1,5'-pyrrolo[1,2-<i>c</i>][1,3]thiazole-6',3''-[1]benzopyran]-2,4''-dione","Acta Crystallographica Section E","2013","69","4","o493","o494","10.1107/S1600536813005825","","","0.71073","MoKα","","0.0793","0.0494","","","0.1301","0.1536","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237718","7.5187","0.0005","12.5695","0.0009","11.7932","0.0008","90","","90.033","0.002","90","","1114.53","0.13","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(4-Hydroxyphenyl)-4-nitrobenzamide","","- C13 H10 N2 O4 -","- C13 H10 N2 O4 -","- C52 H40 N8 O16 -","4","1","TK5203","Waris, Ghulam; Siddiqi, Humaira Masood; Flörke, Ulrich; Saeed, Shaukat; Butt, M. Saeed","<i>N</i>-(4-Hydroxyphenyl)-4-nitrobenzamide","Acta Crystallographica Section E","2013","69","4","o526","","10.1107/S1600536813006132","","","0.71073","MoKα","","0.0572","0.0479","","","0.1166","0.122","","","","","","1.123","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237719","7.0249","0.0004","10.7949","0.0007","10.8826","0.0007","91.783","0.003","97.562","0.002","108.512","0.002","773.42","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(<i>Z</i>)-3-(3,4-Dimethoxybenzylidene)-2,3-dihydro-1,5-benzothiazepin-4(5<i>H</i>)-one","","- C18 H17 N O3 S -","- C18 H17 N O3 S -","- C36 H34 N2 O6 S2 -","2","1","TK5207","Bakthadoss, M.; Selvakumar, R.; Manikandan, N.; Murugavel, S.","(<i>Z</i>)-3-(3,4-Dimethoxybenzylidene)-2,3-dihydro-1,5-benzothiazepin-4(5<i>H</i>)-one","Acta Crystallographica Section E","2013","69","4","o562","o563","10.1107/S1600536813007423","","","0.71073","MoKα","","0.0495","0.0387","","","0.1118","0.1212","","","","","","1.057","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237720","7.879","0.005","9.667","0.005","9.979","0.005","89.052","0.005","78.161","0.004","83.647","0.005","739.3","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(<i>Z</i>)-3-(2,4-Dichlorobenzyl)-1,5-benzothiazepin-4(5<i>H</i>)-one","","- C16 H11 Cl2 N O S -","- C16 H11 Cl2 N O S -","- C32 H22 Cl4 N2 O2 S2 -","2","1","TK5208","Murugavel, S.; Manikandan, N.; Selvakumar, R.; Bakthadoss, M.","(<i>Z</i>)-3-(2,4-Dichlorobenzyl)-1,5-benzothiazepin-4(5<i>H</i>)-one","Acta Crystallographica Section E","2013","69","4","o564","","10.1107/S1600536813007435","","","0.71073","MoKα","","0.0571","0.042","","","0.1124","0.1231","","","","","","1.035","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237721","8.607","0.003","13.222","0.004","13.973","0.004","90","","90","","90","","1590.2","0.9","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,2-Dichloro-3,7,7,11-tetramethyl-10-azatetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","","- C16 H25 Cl2 N -","- C16 H25 Cl2 N -","- C64 H100 Cl8 N4 -","4","1","TK5210","Oukhrib, Abdelouahd; Benharref, Ahmed; Saadi, Mohamed; Berraho, Moha; El Ammari, Lahcen","2,2-Dichloro-3,7,7,11-tetramethyl-10-azatetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","Acta Crystallographica Section E","2013","69","4","o589","o590","10.1107/S1600536813007642","","","0.71073","MoKα","","0.0536","0.0485","","","0.1384","0.1437","","","","","","1.064","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237722","12.525","0.003","13.95","0.003","14.626","0.003","90","","97.72","0.03","90","","2532.3","1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[copper(I)-μ-2,6-bis[4-(pyridin-2-yl)thiazol-2-yl]pyridine] hexafluoridophosphate acetonitrile monosolvate]","","- C23 H16 Cu F6 N6 P S2 -","- C23 H16 Cu F6 N6 P S2 -","- C92 H64 Cu4 F24 N24 P4 S8 -","4","1","VM2190","Xiao, Linda; Bhadbhade, Mohan; Baker, Anthony T.","<i>catena</i>-Poly[[copper(I)-μ-2,6-bis[4-(pyridin-2-yl)thiazol-2-yl]pyridine] hexafluoridophosphate acetonitrile monosolvate] from single-crystal synchrotron data","Acta Crystallographica Section E","2013","69","4","m231","","10.1107/S1600536813006831","","","0.71073","Synchrotron","","0.0327","0.0305","","","0.0768","0.0781","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237723","7.203","0.0002","8.3341","0.0003","19.5436","0.0006","90","","90","","90","","1173.21","0.06","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2-Methoxyanilinium trichloridostannate(II)","","- C7 H10 Cl3 N O Sn -","- C7 H10 Cl3 N O Sn -","- C28 H40 Cl12 N4 O4 Sn4 -","4","1","VN2066","Karoui, Sahel; Kamoun, Slaheddine; Michaud, François","2-Methoxyanilinium trichloridostannate(II)","Acta Crystallographica Section E","2013","69","4","m187","m188","10.1107/S1600536813005096","","","0.71073","MoKα","","0.0287","0.0262","","","0.0636","0.0643","","","","","","1.143","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237724","7.8537","0.0016","12.875","0.003","15.252","0.003","90","","100.92","0.03","90","","1514.3","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[(2<i>R</i>,3<i>S</i>)-Butane-1,2,3,4-tetraol-κ^3^<i>O</i>^1^,<i>O</i>^2^,<i>O</i>^3^](ethanol-κ<i>O</i>)tris(nitrato-κ^2^<i>O</i>,<i>O</i>')samarium(III)","","- C6 H16 N3 O14 Sm -","- C6 H16 N3 O14 Sm -","- C24 H64 N12 O56 Sm4 -","4","1","WM2711","Xue, Jun-Hui; Hua, Xiao-Hui; Yang, Li-Min; Xu, Yi-Zhuang; Wu, Jin-Guang","[(2<i>R</i>,3<i>S</i>)-Butane-1,2,3,4-tetraol-κ^3^<i>O</i>^1^,<i>O</i>^2^,<i>O</i>^3^](ethanol-κ<i>O</i>)tris(nitrato-κ^2^<i>O</i>,<i>O</i>')samarium(III)","Acta Crystallographica Section E","2013","69","4","m182","m183","10.1107/S1600536813003255","","","0.71073","MoKα","","0.0313","0.0294","","","0.0563","0.0571","","","","","","1.22","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237725","7.6747","0.0001","13.0025","0.0002","5.464","0.0001","90","","90","","98.5165","0.0005","539.242","0.015","293","","293","","","","","","","","","3","P 1 1 21","P 2c","4","","Dineodymium(III) dititanium(IV) heptaoxide","","- Nd2 O7 Ti2 -","- Nd2 O7 Ti2 -","- Nd8 O28 Ti8 -","4","2","WM2720","Ishizawa, Nobuo; Ninomiya, Keisuke; Sakakura, Terutoshi; Wang, Jun","Redetermination of Nd~2~Ti~2~O~7~: a non-centrosymmetric structure with perovskite-type slabs","Acta Crystallographica Section E","2013","69","4","i19","","10.1107/S1600536813005497","","","0.71069","MoKα","","0.0268","0.0244","","","0.0268","0.0272","","","","","","1.37","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237726","21.108","0.004","9.9335","0.0019","6.3879","0.0013","90","","90","","90","","1339.4","0.5","223","2","223","2","","","","","","","","6","P n a 21","P 2c -2n","33","","<i>catena</i>-Poly[[[diaqua(tetramethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')nickel(II)]-μ-sulfato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]","","- C6 H22 N2 Ni O7 S -","- C6 H22 N2 Ni O7 S -","- C24 H88 N8 Ni4 O28 S4 -","4","1","WM2722","Schmidt, Guntram; Merzweiler, Kurt","<i>catena</i>-Poly[[[diaqua(tetramethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')nickel(II)]-μ-sulfato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2013","69","4","m197","","10.1107/S1600536813006557","","","0.71073","MoKα","","0.0304","0.0233","","","0.0468","0.0518","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237727","13.139","0.003","9.6674","0.0018","15.393","0.003","90","","90","","90","","1955.2","0.7","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Bromido(1,4,7,10,13-pentaazacyclohexadecane)cobalt(III) dibromide dihydrate","","- C11 H31 Br3 Co N5 O2 -","- C11 H31 Br3 Co N5 O2 -","- C44 H124 Br12 Co4 N20 O8 -","4","0.5","WM2723","Kurisaki, Tsutomu; Hamano, Makoto; Wakita, Hisanobu","Bromido(1,4,7,10,13-pentaazacyclohexadecane)cobalt(III) dibromide dihydrate","Acta Crystallographica Section E","2013","69","4","m179","m180","10.1107/S1600536813004947","","","0.71073","MoKα","","0.0431","0.0309","","","0.0708","0.076","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237728","23.4532","0.0005","10.4466","0.0002","18.3113","0.0003","90","","90.6186","0.0007","90","","4486.12","0.15","296.1","","296","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[1,2-bis(ethoxycarbonyl)ethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>']bis(η^5^-pentamethylcyclopentadienyl)tetra-μ~3~-sulfido-diiron(IV)diiron(III)(3 <i>Fe</i>—<i>Fe</i>)","","- C36 H50 Fe4 O8 S8 -","- C36 H50 Fe4 O8 S8 -","- C144 H200 Fe16 O32 S32 -","4","0.5","WM2725","Ito, Shohei; Hisamichi, Nozomu; Takase, Tsugiko; Inomata, Shinji","Bis[1,2-bis(ethoxycarbonyl)ethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>']bis(η^5^-pentamethylcyclopentadienyl)tetra-μ~3~-sulfido-diiron(IV)diiron(III)(3 <i>Fe</i>—<i>Fe</i>)","Acta Crystallographica Section E","2013","69","4","m181","","10.1107/S1600536813005564","","","0.71075","MoKα","","","0.03","","","","0.0803","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237729","8.0491","0.001","8.0491","0.001","8.8953","0.0018","90","","90","","120","","499.1","0.13","153","2","153","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","Poly[[(μ~4~-1,3,5-triamino-1,3,5-trideoxy-<i>cis</i>-inositol)sodium] bromide]","","- C6 H15 Br N3 Na O3 -","- C6 H15 Br N3 Na O3 -","- C12 H30 Br2 N6 Na2 O6 -","2","0.333333","WM2727","Reiss, Guido J.; Hegetschweiler, Kaspar","Poly[[(μ~4~-1,3,5-triamino-1,3,5-trideoxy-<i>cis</i>-inositol)sodium] bromide]","Acta Crystallographica Section E","2013","69","4","m185","m186","10.1107/S1600536813005618","","","0.71073","MoKα","","0.0361","0.0357","","","0.0778","0.0779","","","","","","1.051","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237730","5.4228","0.0004","7.1572","0.0006","7.4539","0.0007","90","","105.121","0.009","90","","279.28","0.04","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dipotassium hydrogen carbonate fluoride monohydrate","","- C H3 F K2 O4 -","- C H3 F K2 O4 -","- C2 H6 F2 K4 O8 -","2","0.5","WM2728","Kahlenberg, Volker; Schwaier, Timo","Dipotassium hydrogencarbonate fluoride monohydrate","Acta Crystallographica Section E","2013","69","4","i20","","10.1107/S1600536813006041","","","0.71073","MoKα","","0.034","0.0283","","","0.07","0.0748","","","","","","1.051","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237731","9.036","0.0002","14.0492","0.0005","10.2077","0.0003","90","","98.7259","0.0009","90","","1280.85","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(Dimethylamino)pyridinium tetrachloridoferrate(III)","","- C7 H11 Cl4 Fe N2 -","- C7 H11 Cl4 Fe N2 -","- C28 H44 Cl16 Fe4 N8 -","4","1","WM2729","Khadri, Amina; Bouchene, Rafika; Bouacida, Sofiane; Merazig, Hocine; Roisnel, Thierry","4-(Dimethylamino)pyridinium tetrachloridoferrate(III)","Acta Crystallographica Section E","2013","69","4","m190","","10.1107/S160053681300603X","","","0.71073","MoKα","","0.0515","0.0335","","","0.0727","0.0811","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237732","15.546","0.009","23.767","0.013","24.872","0.014","90","","102.209","0.006","90","","8982","9","93","1","93","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis[1,2-bis(methoxycarbonyl)ethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>']bis(η^5^-pentamethylcyclopentadienyl)tetra-μ~3~-sulfido-tetrairon(4 <i>Fe</i>‒<i>Fe</i>) hexafluoridophosphate","","- C32 H42 F6 Fe4 O8 P S8 -","- C32 H42 F6 Fe4 O8 P S8 -","- C256 H336 F48 Fe32 O64 P8 S64 -","8","2","WM2732","Inomata, Shinji; Ito, Shohei; Takase, Tsugiko","Bis[1,2-bis(methoxycarbonyl)ethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>']bis(η^5^-pentamethylcyclopentadienyl)tetra-μ~3~-sulfido-tetrairon(4 <i>Fe</i>‒<i>Fe</i>) hexafluoridophosphate","Acta Crystallographica Section E","2013","69","4","m227","m228","10.1107/S1600536813007514","","","0.71075","MoKα","","","0.0749","","","","0.1862","","","","","","1.142","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237733","11.042","0.005","14.552","0.006","11.524","0.005","90","","116.049","0.004","90","","1663.6","1.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Chlorido[1,1'-(5-methyl-1,3-phenylene)bis(3,5-dimethyl-1<i>H</i>-imidazol-2-ylidene)]platinum(II)","","- C17 H19 Cl N4 Pt -","- C17 H19 Cl N4 Pt -","- C68 H76 Cl4 N16 Pt4 -","4","1","XU5680","Peng, Kui-Juan; Wang, Zi-Xing; Wan, Wen","Chlorido[1,1'-(5-methyl-1,3-phenylene)bis(3,5-dimethyl-1<i>H</i>-imidazol-2-ylidene)]platinum(II)","Acta Crystallographica Section E","2013","69","4","m218","","10.1107/S1600536813006545","","","0.71073","MoKα","","0.0343","0.029","","","0.0775","0.0802","","","","","","1.066","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237734","10.3446","0.0002","13.5779","0.0003","14.6586","0.0003","71.226","0.003","71.364","0.003","69.221","0.002","1772.85","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(2-hydroxybenzoato-κ<i>O</i>^1^)bis(nicotinamide-κ<i>N</i>^1^)cadmium‒diaquabis(2-hydroxybenzoato-κ^2^<i>O</i>^1^,<i>O</i>^1'^)(nicotinamide-κ<i>N</i>)cadmium‒water (1/2/4)","","- C66 H74 Cd3 N8 O32 -","- C66 H74 Cd3 N8 O32 -","- C66 H74 Cd3 N8 O32 -","1","0.5","XU5682","Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","Diaquabis(2-hydroxybenzoato-κ<i>O</i>^1^)bis(nicotinamide-κ<i>N</i>^1^)cadmium‒diaquabis(2-hydroxybenzoato-κ^2^<i>O</i>^1^,<i>O</i>^1'^)(nicotinamide-κ<i>N</i>)cadmium‒water (1/2/4)","Acta Crystallographica Section E","2013","69","4","m191","m192","10.1107/S1600536813006168","","","0.71073","MoKα","","0.0211","0.0194","","","0.0488","0.0503","","","","","","1.065","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237735","6.7002","0.0002","17.0005","0.0004","13.6","0.0003","90","","99.993","0.003","90","","1525.63","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>trans</i>-Tetraaquabis(isonicotinamide-κ<i>N</i>^1^)zinc bis(3-hydroxybenzoate) tetrahydrate","","- C26 H38 N4 O16 Zn -","- C26 H38 N4 O16 Zn -","- C52 H76 N8 O32 Zn2 -","2","0.5","XU5683","Zaman, Ibrahim Göker; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","<i>trans</i>-Tetraaquabis(isonicotinamide-κ<i>N</i>^1^)zinc bis(3-hydroxybenzoate) tetrahydrate","Acta Crystallographica Section E","2013","69","4","m198","m199","10.1107/S1600536813006466","","","0.71073","MoKα","","0.0514","0.0472","","","0.1106","0.1137","","","","","","1.268","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237736","5.292","0.001","20.203","0.001","23.863","0.001","87.853","0.01","86.457","0.01","85.26","0.01","2536.4","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-{[4-(4-{[(2-Oxidonaphthalen-1-yl)methylidene]azaniumyl}phenoxy)phenyl]iminiumylmethyl}naphthalen-2-olate","","- C34 H24 N2 O3 -","- C34 H24 N2 O3 -","- C136 H96 N8 O12 -","4","2","XU5684","Haffar, Djahida; Daoud, Djamel; Douadi, Tahar; Bouzidi, Leila; Chafaa, Salah","1-{[4-(4-{[(2-Oxidonaphthalen-1-yl)methylidene]azaniumyl}phenoxy)phenyl]iminiumylmethyl}naphthalen-2-olate","Acta Crystallographica Section E","2013","69","4","o581","o582","10.1107/S1600536813007307","","","0.71073","MoKα","","0.1474","0.0722","","","0.1732","0.2181","","","","","","1.015","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237737","8.286","0.007","9.041","0.008","10.629","0.009","69.905","0.007","69.096","0.007","79.082","0.008","696.5","1","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","1-(2-Carboxyethyl)-3-(carboxylatomethyl)-2-ethylbenzimidazol-1-ium monohydrate","","- C14 H18 N2 O5 -","- C14 H18 N2 O5 -","- C28 H36 N4 O10 -","2","1","XU5687","Yao, Hong; Xie, Yong-Qiang; Yao, Xiao-Qiang; Yang, Yun-Xia; Zhang, You-Ming","1-(2-Carboxyethyl)-3-(carboxylatomethyl)-2-ethylbenzimidazol-1-ium monohydrate","Acta Crystallographica Section E","2013","69","4","o546","","10.1107/S1600536813006855","","","0.71073","MoKα","","0.0608","0.0419","","","0.0956","0.1016","","","","","","1.065","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237738","16.8163","0.0003","9.8407","0.0002","17.2913","0.0004","90","","90","","90","","2861.44","0.1","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3,9-Dimethyl-2,3-dihydrospiro[carbazole-1,2'-[1,3]dithiolan]-4(9<i>H</i>)-one","","- C16 H17 N O S2 -","- C16 H17 N O S2 -","- C128 H136 N8 O8 S16 -","8","1","XU5690","Gülle, Sibel; Çaylak Delibaş, Nagihan; Ergün, Yavuz; Hökelek, Tuncer","3,9-Dimethyl-2,3-dihydrospiro[carbazole-1,2'-[1,3]dithiolan]-4(9<i>H</i>)-one","Acta Crystallographica Section E","2013","69","4","o598","o599","10.1107/S1600536813007873","","","0.71073","MoKα","","0.0894","0.0752","","","0.1849","0.1948","","","","","","1.051","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237739","8.2521","0.0002","8.481","0.0002","9.6369","0.0002","87.117","0.005","89.527","0.005","70.962","0.004","636.73","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Piperazine-1,4-diium bis(2,4,5-tricarboxybenzoate) dihydrate","","- C24 H26 N2 O18 -","- C24 H26 N2 O18 -","- C24 H26 N2 O18 -","1","0.5","YK2086","Narayanam, Nagaraju; Gangu, Kranthi Kumar; Kurra, Balakrishna; Mukkamala, Saratchandra Babu","Piperazine-1,4-diium bis(2,4,5-tricarboxybenzoate) dihydrate","Acta Crystallographica Section E","2013","69","4","o574","o575","10.1107/S160053681300723X","","","0.71073","MoKα","","0.0328","0.0303","","","0.0831","0.0852","","","","","","1.057","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237740","13.993","0.003","9.189","0.0018","28.778","0.006","90","","90","","90","","3700.3","1.3","90","0.2","90","0.2","","","","","","","","5","P c a 21","P 2c -2ac","29","","3,4',5-Trichlorobiphenyl-4-yl 2,2,2-trichloroethyl sulfate","","- C14 H8 Cl6 O4 S -","- C14 H8 Cl6 O4 S -","- C112 H64 Cl48 O32 S8 -","8","2","YK2088","Lehmler, Hans-Joachim; He, Xianran; Duffel, Michael W.; Parkin, Sean","3,4',5-Trichlorobiphenyl-4-yl 2,2,2-trichloroethyl sulfate","Acta Crystallographica Section E","2013","69","4","o620","","10.1107/S1600536813007976","","","1.54178","CuKα","","0.068","0.0643","","","0.158","0.1605","","","","","","1.152","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237741","7.909","0.002","27.239","0.008","5.9652","0.0017","90","","90","","90","","1285.1","0.6","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","5-(3-Methoxyphenyl)-3-phenyl-1,2-oxazole","","- C16 H13 N O2 -","- C16 H13 N O2 -","- C64 H52 N4 O8 -","4","1","ZJ2101","Balakrishnan, B.; Praveen, C.; Seshadri, P. R.; Perumal, P. T.","5-(3-Methoxyphenyl)-3-phenyl-1,2-oxazole","Acta Crystallographica Section E","2013","69","4","o597","","10.1107/S160053681300740X","","","0.71073","MoKα","","0.053","0.0383","","","0.0933","0.1025","","","","","","1.028","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237742","38.312","0.003","6.7621","0.001","20.987","0.002","90","","113.41","0.005","90","","4989.5","1","90","0.5","90","0.5","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Benzotriazolium sulfate dihydrate","Bis(1,2,3-benzotriazolium) sulfate dihydrate","","- C12 H16 N6 O6 S -","- C12 H16 N6 O6 S -","- C144 H192 N72 O72 S12 -","12","1.5","ZL2540","Belter, Randolph K.; Fronczek, Frank R.","Bis(1,2,3-benzotriazolium) sulfate dihydrate","Acta Crystallographica Section E","2013","69","4","o606","o607","10.1107/S1600536813007472","","","0.71073","MoKα","","0.0402","0.0328","","","0.0922","0.098","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237743","11.5837","0.0006","4.4677","0.0003","15.5521","0.0008","90","","103.31","0.006","90","","783.24","0.08","300","2","300","2","","","","","","","","3","P 1 c 1","P -2yc","7","5,7,3'-Trihydroxy-6,4',5'-trimethoxyflavone","5,7-Dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-4<i>H</i>-chromen-4-one","","- C18 H16 O8 -","- C18 H16 O8 -","- C36 H32 O16 -","2","1","ZP2001","Adizov, Shahobiddin M.; Mukhamathanova, Rimma F.; Turgunov, Kambarali K.; Sham'yanov, Ildar D.; Tashkhodjaev, Bakhodir","5,7-Dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2013","69","4","o578","","10.1107/S1600536813007381","","","1.54184","CuKα","","0.0486","0.0421","","","0.1159","0.1259","","","","","","1.073","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237744","8.6978","0.0003","8.8318","0.0003","12.1517","0.0004","84.808","0.003","78.674","0.003","82.039","0.003","904.53","0.05","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","6-(3,5-Dimethoxybenzylamino)-9-(oxan-2-yl)-9<i>H</i>-purine","","- C19 H23 N5 O3 -","- C19 H23 N5 O3 -","- C38 H46 N10 O6 -","2","1","ZQ2196","Štarha, Pavel; Popa, Igor; Dvořák, Zdeněk; Trávníček, Zdeněk","6-(3,5-Dimethoxybenzylamino)-9-(oxan-2-yl)-9<i>H</i>-purine","Acta Crystallographica Section E","2013","69","4","o533","","10.1107/S1600536813006697","","","0.71073","MoKα","","0.0509","0.0442","","","0.1122","0.1161","","","","","","1.07","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237745","15.7463","0.0002","21.8914","0.0003","28.6122","0.0004","90","","90","","90","","9862.9","0.2","173","2","173","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","<i>cis</i>,<i>cis</i>,<i>cis</i>-(Acetato-κ^2^<i>O</i>,<i>O</i>')bis[1,2-bis(diphenylphosphanyl)ethane-κ^2^<i>P</i>,<i>P</i>']ruthenium(II) 0.75-trifluoromethanesulfonate 0.25-chloride","","- C219 H204 Cl F9 O17 P16 Ru4 S3 -","- C219 H204 Cl F9 O17 P16 Ru4 S3 -","- C438 H408 Cl2 F18 O34 P32 Ru8 S6 -","2","0.25","ZS2249","Figueira, João; Rodrigues, João; Valkonen, Arto","<i>cis</i>,<i>cis</i>,<i>cis</i>-(Acetato-κ^2^<i>O</i>,<i>O</i>')bis[1,2-bis(diphenylphosphanyl)ethane-κ^2^<i>P</i>,<i>P</i>']ruthenium(II) 0.75-trifluoromethanesulfonate 0.25-chloride","Acta Crystallographica Section E","2013","69","4","m226","","10.1107/S160053681300737X","","","0.71073","MoKα","","0.0774","0.0614","","","0.1406","0.1483","","","","","","1.125","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237746","4.7616","0.0004","17.7989","0.0015","14.2841","0.0012","90","","93.8021","0.001","90","","1207.93","0.18","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl (<i>E</i>)-2-cyano-3-(4-methylphenyl)acrylate","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C52 H52 N4 O8 -","4","1","AA2081","Chen, Qi-Yu; Ke, Wen-Dong; Kong, Lin","Ethyl (<i>E</i>)-2-cyano-3-(4-methylphenyl)acrylate: a second monoclinic polymorph","Acta Crystallographica Section E","2013","69","5","o748","","10.1107/S1600536813009550","","","0.71073","MoKα","","0.0677","0.0546","","","0.1711","0.192","","","","","","1.109","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237747","21.268","0.002","6.7031","0.0009","22.303","0.002","90","","92.776","0.006","90","","3175.8","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,4-Bis(furan-2-yl)-1,5-dimethyl-3-azabicyclo[3.3.1]nonan-9-one","","- C18 H21 N O3 -","- C18 H21 N O3 -","- C144 H168 N8 O24 -","8","1","AA2083","Venkateswaramoorthi, R.; Rizwana Begum, S.; Hema, R.; Krishnasamy, K.; Anitha, A.G.","2,4-Bis(furan-2-yl)-1,5-dimethyl-3-azabicyclo[3.3.1]nonan-9-one","Acta Crystallographica Section E","2013","69","5","o768","","10.1107/S1600536813010180","","","0.71073","MoKα","","0.0598","0.0441","","","0.1167","0.1302","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237748","6.1039","0.0003","15.3928","0.0007","15.9601","0.0008","90","","95.462","0.002","90","","1492.74","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Diacetatodi-<i>tert</i>-butyltin(IV)","","- C12 H24 O4 Sn -","- C12 H24 O4 Sn -","- C48 H96 O16 Sn4 -","4","1","AA2086","Reichelt, Martin; Reuter, Hans","Diacetatodi-<i>tert</i>-butyltin(IV)","Acta Crystallographica Section E","2013","69","5","m254","","10.1107/S1600536813009185","","","0.71073","MoKα","","0.0333","0.0226","","","0.0426","0.0455","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237749","10.125","0.003","11.949","0.004","34.653","0.006","90","","90.2","0.02","90","","4192","2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Zn~3~(Et)~2~(MalO)~4~]^.^2(C~7~H~8~)","Diethyl(μ~3~-2-methyl-4-oxo-4<i>H</i>-pyran-3-olato-κ^4^<i>O</i>^3^,<i>O</i>^4^:<i>O</i>^3^:<i>O</i>^3^)tris(μ~2~-2-methyl-4-oxo-4<i>H</i>-pyran-3-olato-κ^3^<i>O</i>^3^,<i>O</i>^4^:<i>O</i>^3^)trizinc toluene disolvate","","- C42 H46 O12 Zn3 -","- C42 H46 O12 Zn3 -","- C168 H184 O48 Zn12 -","4","1","AA2088","Petrus, Rafał; Petrus, Joanna; Paszek, Karolina; Sobota, Piotr","Diethyl(μ~3~-2-methyl-4-oxo-4<i>H</i>-pyran-3-olato-κ^4^<i>O</i>^3^,<i>O</i>^4^:<i>O</i>^3^:<i>O</i>^3^)tris(μ~2~-2-methyl-4-oxo-4<i>H</i>-pyran-3-olato-κ^3^<i>O</i>^3^,<i>O</i>^4^:<i>O</i>^3^)trizinc toluene disolvate","Acta Crystallographica Section E","2013","69","5","m281","m282","10.1107/S1600536813010064","","","0.71073","MoKα","","0.0399","0.0286","","","0.0633","0.0655","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237750","6.1266","0.0003","10.0247","0.0005","12.663","0.0007","84.749","0.003","79.235","0.002","86.443","0.003","760.03","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","3-(4-Bromophenylsulfinyl)-5-chloro-2,7-dimethyl-1-benzofuran","","- C16 H12 Br Cl O2 S -","- C16 H12 Br Cl O2 S -","- C32 H24 Br2 Cl2 O4 S2 -","2","1","AA2089","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","3-(4-Bromophenylsulfinyl)-5-chloro-2,7-dimethyl-1-benzofuran","Acta Crystallographica Section E","2013","69","5","o745","","10.1107/S160053681300994X","","","0.71073","MoKα","","0.0394","0.0305","","","0.0776","0.0818","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237751","13.4019","0.0012","14.2255","0.0012","21.022","0.002","85.9","0.02","84.61","0.02","65.75","0.02","3635.6","0.8","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","[5,11,17,23-Tetra-<i>tert</i>-butyl-25,27-(3,6-dioxaoctan-1,8-dioxy)-26,28-bis(pyridin-2-ylmethoxy)calix[4]arene]sodium iodide‒1,2,4,5-tetrafluoro-3,6-diiodobenzene‒methanol (2/3/4)","","- C146 H168 F12 I8 N4 Na2 O16 -","- C146 H168 F12 I8 N4 Na2 O16 -","- C146 H168 F12 I8 N4 Na2 O16 -","1","0.5","BG2501","Cavallo, Gabriella; Metrangolo, Pierangelo; Parisi, Melchiorre F.; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo","[5,11,17,23-Tetra-<i>tert</i>-butyl-25,27-(3,6-dioxaoctan-1,8-dioxy)-26,28-bis(pyridin-2-ylmethoxy)calix[4]arene]sodium iodide‒1,2,4,5-tetrafluoro-3,6-diiodobenzene‒methanol (2/3/4)","Acta Crystallographica Section E","2013","69","5","m236","m237","10.1107/S1600536813007757","","","0.71073","MoKα","","0.052","0.0446","","","0.0917","0.095","","","","","","1.126","","","","has coordinates,has Fobs","223448","2020-10-21","18:00:00",""
"2237752","7.5943","0.0003","7.9123","0.0003","10.7673","0.0004","88.769","0.001","81.681","0.001","83.92","0.001","636.57","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[[[diaquacobalt(II)]-bis{μ-2-[3-(4-carboxylatophenyl)pyridin-1-ium-1-yl]acetato}] dihydrate]","","- C28 H28 Co N2 O12 -","- C28 H28 Co N2 O12 -","- C28 H28 Co N2 O12 -","1","0.5","BG2502","Gao, Wei; Zhang, Xiu-Mei","<i>catena</i>-Poly[[[diaquacobalt(II)]-bis{μ-2-[3-(4-carboxylatophenyl)pyridin-1-ium-1-yl]acetato}] dihydrate]","Acta Crystallographica Section E","2013","69","5","m252","","10.1107/S1600536813008933","","","0.71073","MoKα","","0.0303","0.0301","","","0.0908","0.0911","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237753","11.1927","0.0002","11.4535","0.0003","12.1206","0.0003","87.637","0.002","86.048","0.001","70.564","0.002","1461.5","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 1''-benzyl-1'-methyl-2''-oxodispiro[indeno[1,2-<i>b</i>]quinoxaline-11,3'-pyrrolidine-2',3''-indoline]-4'-carboxylate","","- C36 H30 N4 O3 -","- C36 H30 N4 O3 -","- C72 H60 N8 O6 -","2","1","BG2503","Kannan, Piskala Subburaman; Lanka, Srinu; Thennarasu, Sathiah; Govindan, Elumalai; SubbiahPandi, Arunachalathevar","Ethyl 1''-benzyl-1'-methyl-2''-oxodispiro[indeno[1,2-<i>b</i>]quinoxaline-11,3'-pyrrolidine-2',3''-indoline]-4'-carboxylate","Acta Crystallographica Section E","2013","69","6","o822","","10.1107/S1600536813011525","","","0.71073","MoKα","","0.0569","0.0473","","","0.1243","0.1337","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237754","15.235","0.003","13.959","0.003","5.9153","0.0011","90","","93.259","0.003","90","","1255.9","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2<i>E</i>)-1-(5-Bromothiophen-2-yl)-3-(4-chlorophenyl)prop-2-en-1-one","","- C13 H8 Br Cl O S -","- C13 H8 Br Cl O S -","- C52 H32 Br4 Cl4 O4 S4 -","4","1","BG2505","Kavitha, H. D.; Roopashree, K. R.; Vepuri, Suresh B.; Devarajegowda, H. C.; Devaru, Venkatesh B.","(2<i>E</i>)-1-(5-Bromothiophen-2-yl)-3-(4-chlorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","6","o859","","10.1107/S1600536813012063","","","0.71073","MoKα","","0.0385","0.0298","","","0.0768","0.0805","","","","","","1.051","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237755","8.6707","0.0008","5.2628","0.0004","20.6693","0.0015","90","","93.014","0.007","90","","941.88","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>'-Hydroxypyridine-2-carboximidamide‒succinic acid (2/1)","","- C16 H20 N6 O6 -","- C16 H20 N6 O6 -","- C32 H40 N12 O12 -","2","0.5","BG2507","Liu, Jiyong","<i>N</i>'-Hydroxypyridine-2-carboximidamide‒succinic acid (2/1)","Acta Crystallographica Section E","2013","69","6","o992","","10.1107/S1600536813014359","","","0.71073","MoKα","","0.0607","0.0391","","","0.0929","0.1057","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237756","10.896","0.001","17.2838","0.0016","11.8888","0.001","90","","92.752","0.004","90","","2236.4","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-4-[2-(4-Ethoxyphenyl)ethenyl]-1-methylpyridinium naphthalene-2-sulfonate","","- C26 H25 N O4 S -","- C26 H25 N O4 S -","- C104 H100 N4 O16 S4 -","4","1","BH2474","Balachandar, R. K.; Kalainathan, S.; Aravindan, P. G.; Eappen, Shibu M.; Podder, Jiban","(<i>E</i>)-4-[2-(4-Ethoxyphenyl)ethenyl]-1-methylpyridinium naphthalene-2-sulfonate","Acta Crystallographica Section E","2013","69","5","o722","","10.1107/S1600536813009240","","","0.71073","MoKα","","0.081","0.0516","","","0.1411","0.1588","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237757","9.3898","0.0003","9.9752","0.0003","11.1324","0.0003","98.765","0.001","113.991","0.001","109.52","0.001","846.09","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-(4-Fluorophenyl)-6-methylamino-5-nitro-2-phenyl-4<i>H</i>-pyran-3-carbonitrile","","- C19 H14 F N3 O3 -","- C19 H14 F N3 O3 -","- C38 H28 F2 N6 O6 -","2","1","BH2475","Vishnupriya, R.; Suresh, J.; Sivakumar, S.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","4-(4-Fluorophenyl)-6-methylamino-5-nitro-2-phenyl-4<i>H</i>-pyran-3-carbonitrile","Acta Crystallographica Section E","2013","69","5","o687","o688","10.1107/S1600536813009008","","","0.71073","MoKα","","0.0505","0.0404","","","0.1102","0.1179","","","","","","1.057","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237758","15.515","0.0006","12.9137","0.0006","17.8323","0.0006","90","","90","","90","","3572.8","0.2","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-Nitrophenol‒1,3,5-triazine-2,4,6-triamine (2/1)","","- C15 H16 N8 O6 -","- C15 H16 N8 O6 -","- C120 H128 N64 O48 -","8","1","BH2476","Sangeetha, V.; Kanagathara, N.; Chakkaravarthi, G.; Marchewka, M.K.; Anbalagan, G.","3-Nitrophenol‒1,3,5-triazine-2,4,6-triamine (2/1)","Acta Crystallographica Section E","2013","69","6","o827","","10.1107/S1600536813011148","","","0.71073","MoKα","","0.0582","0.0417","","","0.1074","0.1189","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237759","17.563","0.0005","6.25208","0.00019","13.7963","0.0004","90","","93.209","0.003","90","","1512.53","0.08","143","0.1","143","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6-Amino-2-methyl-8-phenyl-1,2,3,4-tetrahydroisoquinoline-5,7-dicarbonitrile","","- C18 H16 N4 -","- C18 H16 N4 -","- C72 H64 N16 -","4","1","BH2477","Wang, Dao-Cai; Song, Hang; Yao, Shun","6-Amino-2-methyl-8-phenyl-1,2,3,4-tetrahydroisoquinoline-5,7-dicarbonitrile","Acta Crystallographica Section E","2013","69","6","o929","","10.1107/S1600536813013342","","","0.7107","MoKα","","0.0612","0.0449","","","0.1002","0.1115","","","","","","1.047","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237760","8.233","0.0016","12.534","0.003","12.192","0.002","90","","97.96","0.03","90","","1246","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methyl-2-phenyl-1-(pyrrolidin-1-yl)propan-1-one","","- C14 H19 N O -","- C14 H19 N O -","- C56 H76 N4 O4 -","4","1","BQ2384","Ren, Dong-mei","2-Methyl-2-phenyl-1-(pyrrolidin-1-yl)propan-1-one","Acta Crystallographica Section E","2013","69","5","o773","","10.1107/S1600536813009975","","","0.71073","MoKα","","0.1159","0.0625","","","0.1325","0.1521","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237761","6.0588","0.0002","14.3762","0.0006","15.1617","0.0006","65.323","0.003","89.759","0.002","80.259","0.002","1179.46","0.08","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1,3,5-Tris(4-bromophenyl)-1,3,5-triazinane dichloromethane monosolvate","","- C22 H20 Br3 Cl2 N3 -","- C22 H20 Br3 Cl2 N3 -","- C44 H40 Br6 Cl4 N6 -","2","1","BQ2386","Chebbah, Mahmoud; Bouchemma, Ahcene; Bouacida, Sofiane; Lefrada, Leila; Bouhenguel, Mustapha","1,3,5-Tris(4-bromophenyl)-1,3,5-triazinane dichloromethane monosolvate","Acta Crystallographica Section E","2013","69","6","o976","","10.1107/S1600536813013743","","","0.71073","MoKα","","0.114","0.0604","","","0.1227","0.145","","","","","","1.088","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237762","8.3551","0.0004","9.7067","0.0005","23.8555","0.0011","90","","90","","90","","1934.69","0.16","293","2","293","2","101.3","","","","","","","4","C 2 2 21","C 2c 2","20","","Pentacobalt(II) divanadium(III) tetrakis(diphosphate)","","- Co5 O28 P8 V2 -","- Co4.9984 O28 P8 V2.0016 -","- Co19.9936 O112 P32 V8.0064 -","4","0.5","BR2223","Bronova, Anna; Glaum, Robert; Litterscheid, Christian","Pentacobalt(II) divanadium(III) tetrakis(diphosphate), Co~5~V~2~(P~2~O~7~)~4~","Acta Crystallographica Section E","2013","69","5","i26","","10.1107/S1600536813008507","","","0.71073","MoKα","","0.0701","0.0462","","","","0.1099","","","","","","0.92","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237763","4.83","0.002","8.721","0.002","9.3269","0.0009","90","","98.08","0.03","90","","388.97","0.19","298","2","298","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Lithium dicobalt(II) triarsenate","","- As3 Co2 Li O10 -","- As3 Co2 Li O10 -","- As6 Co4 Li2 O20 -","2","0.5","BR2224","Ben Smida, Youssef; Guesmi, Abderrahmen; Driss, Ahmed","LiCo~2~As~3~O~10~: une nouvelle structure à tunnels interconnectés","Acta Crystallographica Section E","2013","69","6","i39","","10.1107/S1600536813013548","","","0.71073","MoKα","","0.0271","0.0229","","","0.0609","0.0633","","","","","","1.096","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237764","31.7536","0.0006","9.8492","0.0002","14.4865","0.0003","90","","113.222","0.001","90","","4163.57","0.15","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-2,2'-iminodibenzoato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']","","- C26 H17 Cu N3 O4 -","- C26 H17 Cu N3 O4 -","- C208 H136 Cu8 N24 O32 -","8","1","BT6890","Yuste-Vivas, Consuelo; Coutinho, Joana T.; Pereira, Laura C. J.; Silva, Manuela Ramos","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-2,2'-iminodibenzoato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2013","69","5","m255","m256","10.1107/S1600536813009203","","","0.71073","MoKα","","0.0616","0.0353","","","0.0786","0.089","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237765","5.6355","0.0004","8.1597","0.0005","36.794","0.002","90","","90","","90","","1691.93","0.18","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-[(<i>E</i>)-Anthracen-9-ylmethylidene]-2-(2,4-dinitrophenyl)hydrazine","","- C21 H14 N4 O4 -","- C21 H14 N4 O4 -","- C84 H56 N16 O16 -","4","1","BT6891","A. e Silva, Joana de; Yuste-Vivas, Consuelo; Sobral, Abilio J. F. N.; Silva, Manuela Ramos","1-[(<i>E</i>)-Anthracen-9-ylmethylidene]-2-(2,4-dinitrophenyl)hydrazine","Acta Crystallographica Section E","2013","69","5","o705","","10.1107/S1600536813009197","","","0.71073","MoKα","","0.2255","0.0738","","","0.1633","0.2422","","","","","","0.879","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237766","5.773","0.002","11.168","0.005","15.991","0.007","96.092","0.016","100.316","0.014","91.333","0.014","1007.6","0.7","300","2","300","2","","","","","","","","5","P -1","-P 1","2","","<i>tert</i>-Butyl 4-{5-[3-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-3-yl}piperazine-1-carboxylate","","- C18 H21 F3 N4 O4 -","- C18 H21 F3 N4 O4 -","- C36 H42 F6 N8 O8 -","2","1","BT6899","Sreenivasa, Swamy; ManojKumar, Karikere Ekanna; Kempaiah, Arakyathanahalli; Suchetan, Parameshwar Adimoole; Palakshamurthy, Bandrehalli Siddagangaiah","<i>tert</i>-Butyl 4-{5-[3-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-3-yl}piperazine-1-carboxylate","Acta Crystallographica Section E","2013","69","5","o761","","10.1107/S1600536813010131","","","0.71073","MoKα","","0.0944","0.0623","","","0.1887","0.2066","","","","","","1.099","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237767","9.0502","0.0002","6.4201","0.0001","33.928","0.0007","90","","94.469","0.001","90","","1965.33","0.07","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","4-(4-Bromostyryl)-1-methylpyridinium tosylate","4-[2-(4-Bromophenyl)ethenyl]-1-methylpyridin-1-ium 4-methylbenzene-1-sulfonate","","- C21 H20 Br N O3 S -","- C21 H20 Br N O3 S -","- C84 H80 Br4 N4 O12 S4 -","4","1","BT6900","Kumar, M. Krishna; Sudhahar, S.; Sornamurthy, B. M.; Chakkaravarthi, G.; Kumar, R. Mohan","4-(4-Bromostyryl)-1-methylpyridinium tosylate","Acta Crystallographica Section E","2013","69","5","o694","","10.1107/S1600536813009227","","","0.71073","MoKα","","0.1165","0.049","","","0.1074","0.1301","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237768","10.3971","0.0003","12.2589","0.0003","11.0994","0.0003","90","","93.953","0.001","90","","1411.33","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Chloro-1-(2,4,4-trimethyl-2,3,4,5-tetrahydro-1<i>H</i>-1,5-benzodiazepin-1-yl)ethanone","","- C14 H19 Cl N2 O -","- C14 H19 Cl N2 O -","- C56 H76 Cl4 N8 O4 -","4","1","BT6901","Thiruselvam, V.; Rajakumari, D. Deepa; Akila, A.; Ponnuswamy, S.; Ponnuswamy, M. N.","2-Chloro-1-(2,4,4-trimethyl-2,3,4,5-tetrahydro-1<i>H</i>-1,5-benzodiazepin-1-yl)ethanone","Acta Crystallographica Section E","2013","69","6","o874","","10.1107/S1600536813012324","","","0.71073","MoKα","","0.0528","0.0395","","","0.1108","0.1197","","","","","","1.067","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237769","10.725","0.005","10.405","0.005","14.93","0.005","90","","100.262","0.005","90","","1639.4","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","8,11,24-Trioxa-21-thia-19-azapentacyclo[16.6.0.0^2,7^.0^12,17^.0^19,23^]tetracosa-2(7),3,5,12,14,16-hexaene","","- C19 H19 N O3 S -","- C19 H19 N O3 S -","- C76 H76 N4 O12 S4 -","4","1","BT6902","Devi, Seenivasan Karthiga; Srinivasan, Thothadri; Purushothaman, Santhanagopalan; Raghunathan, Raghavachary; Velmurugan, Devadasan","8,11,24-Trioxa-21-thia-19-azapentacyclo[16.6.0.0^2,7^.0^12,17^.0^19,23^]tetracosa-2(7),3,5,12,14,16-hexaene","Acta Crystallographica Section E","2013","69","6","o898","","10.1107/S1600536813012798","","","0.71073","MoKα","","0.0812","0.0483","","","0.1302","0.1487","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237770","6.008","0.0012","6.3519","0.0013","7.4834","0.0015","90","","112.2","0.03","90","","264.41","0.11","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Pyrimidine-4-carboxylic acid","","- C5 H4 N2 O2 -","- C5 H4 N2 O2 -","- C10 H8 N4 O4 -","2","0.5","BT6903","Kiegiel, Katarzyna; Starosta, Wojciech; Leciejewicz, Janusz","Pyrimidine-4-carboxylic acid","Acta Crystallographica Section E","2013","69","6","o885","","10.1107/S1600536813012610","","","0.71073","MoKα","","0.0831","0.0476","","","0.107","0.1244","","","","","","0.995","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237771","10.4814","0.001","8.0528","0.0008","32.571","0.003","90","","90","","90","","2749.1","0.5","296","2","296","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","<i>N</i>-[4-(Dimethylamino)benzylidene]-4-methylaniline","","- C16 H18 N2 -","- C16 H18 N2 -","- C128 H144 N16 -","8","1","BT6904","Balachandar, R. K.; Kalainathan, S.; Eappen, Shibu M.; Podder, Jiban","<i>N</i>-[4-(Dimethylamino)benzylidene]-4-methylaniline","Acta Crystallographica Section E","2013","69","6","o905","","10.1107/S160053681301249X","","","0.71073","MoKα","","0.0981","0.061","","","0.1578","0.1865","","","","","","1.077","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237772","10.6804","0.0004","7.5196","0.0003","29.1355","0.001","90","","90","","90","","2339.94","0.15","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-(4-Bromophenyl)-<i>N</i>-(pyrazin-2-yl)acetamide","","- C12 H10 Br N3 O -","- C12 H10 Br N3 O -","- C96 H80 Br8 N24 O8 -","8","1","BT6905","Nayak, Prakash S.; Narayana, B.; Jasinski, Jerry P.; Yathirajan, H. S.; Sarojini, B. K.","2-(4-Bromophenyl)-<i>N</i>-(pyrazin-2-yl)acetamide","Acta Crystallographica Section E","2013","69","6","o891","","10.1107/S1600536813012531","","","1.54184","CuKα","","0.0397","0.0347","","","0.0905","0.0946","","","","","","1.028","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237773","7.2465","0.0001","7.6533","0.0001","12.0141","0.0002","101.094","0.002","99.129","0.001","102.39","0.002","624.568","0.018","293","2","293","2","","","","","","","","4","P -1","-P 1","2","({[(Carboxymethyl)sulfanyl](2-hydroxyphenyl)methyl}sulfanyl)acetic acid","4-(2-Hydroxyphenyl)-3,5-dithiaheptanedioic acid","","- C11 H12 O5 S2 -","- C11 H12 O5 S2 -","- C22 H24 O10 S4 -","2","1","BT6906","Ravichandran, K.; Manikannan, R.; Muthusubramanian, S.; Ramesh, P.; Ponnuswamy, M. N.","4-(2-Hydroxyphenyl)-3,5-dithiaheptanedioic acid","Acta Crystallographica Section E","2013","69","6","o893","","10.1107/S1600536813012737","","","0.71073","MoKα","","0.0323","0.0259","","","0.0685","0.0731","","","","","","1.058","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237774","10.3312","0.001","7.1692","0.0008","10.8502","0.0006","90","","115.958","0.005","90","","722.56","0.12","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","","(1<i>R</i>,2<i>S</i>,4<i>S</i>,4a<i>S</i>,8<i>S</i>,8a<i>S</i>)-4-Hydroxy-8,8a-dimethyl-10-oxo-2,3,4,7,8,8a-hexahydro-1<i>H</i>- 4a,1-(epoxymethano)naphthalen-2-yl acetate","","- C15 H20 O5 -","- C15 H20 O5 -","- C30 H40 O10 -","2","1","BT6907","Selaïmia-Ferdjani, Ouassila; Bidjou-Haiour, Chahra; Planchat, Aurelien; Pipelier, Muriel","(1<i>R</i>,2<i>S</i>,4<i>S</i>,4a<i>S</i>,8<i>S</i>,8a<i>S</i>)-4-Hydroxy-8,8a-dimethyl-10-oxo-2,3,4,7,8,8a-hexahydro-1<i>H</i>-4a,1-(epoxymethano)naphthalen-2-yl acetate","Acta Crystallographica Section E","2013","69","6","o938","o939","10.1107/S1600536813013524","","","0.71069","MoKα","","0.0705","0.0502","","","0.1229","0.1383","","","","","","1.84","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237775","16.8124","0.0012","10.9545","0.0008","10.9331","0.0007","90","","90","","90","","2013.6","0.2","130","2","130","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","<i>N</i>,<i>N</i>'-Bis(4-hydroxyphenyl)pyridine-2,6-dicarboxamide dimethylformamide monosolvate","","- C22 H22 N4 O5 -","- C22 H22 N4 O5 -","- C88 H88 N16 O20 -","4","1","BT6908","Waris, Ghulam; Siddiqi, Humaira Masood; Flörke, Ulrich; Hussain, Rizwan; Butt, M. Saeed","<i>N</i>,<i>N</i>'-Bis(4-hydroxyphenyl)pyridine-2,6-dicarboxamide dimethylformamide monosolvate","Acta Crystallographica Section E","2013","69","6","o991","","10.1107/S1600536813013810","","","0.71073","MoKα","","0.0373","0.0361","","","0.0979","0.0994","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237776","14.6494","0.0002","20.0535","0.0003","8.7694","0.0001","90","","90","","90","","2576.2","0.06","150","2","150","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","{<i>N</i>,<i>N</i>-Bis[bis(2,2,2-trifluoroethoxy)phosphanyl]methylamine-κ^2^<i>P</i>,<i>P</i>'}bis(η^5^-cyclopentadienyl)titanium(II)","","- C19 H21 F12 N O4 P2 Ti -","- C19 H21 F12 N O4 P2 Ti -","- C76 H84 F48 N4 O16 P8 Ti4 -","4","0.5","BT6910","Haehnel, Martin; Hansen, Sven; Spannenberg, Anke; Beweries, Torsten","{<i>N</i>,<i>N</i>-Bis[bis(2,2,2-trifluoroethoxy)phosphanyl]methylamine-κ^2^<i>P</i>,<i>P</i>'}bis(η^5^-cyclopentadienyl)titanium(II)","Acta Crystallographica Section E","2013","69","6","m346","","10.1107/S1600536813014244","","","0.71073","MoKα","","0.0373","0.0306","","","0.0745","0.079","","","","","","1.059","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237777","11.977","0.002","7.2497","0.0012","13.85","0.002","90","","94.244","0.003","90","","1199.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2,3-Dicyanophenyl)pyridin-1-ium-4-olate monohydrate","","- C13 H9 N3 O2 -","- C13 H9 N3 O2 -","- C52 H36 N12 O8 -","4","1","BV2216","Han, Zhe; Zhu, Ying; Tian, Xuelei; Feng, Suping","1-(2,3-Dicyanophenyl)pyridin-1-ium-4-olate monohydrate","Acta Crystallographica Section E","2013","69","5","o767","","10.1107/S1600536813008891","","","0.71073","MoKα","","0.0761","0.0435","","","0.104","0.1238","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237778","8.6685","0.0004","10.1323","0.0005","16.722","0.0008","76.607","0.002","79.481","0.002","77.91","0.002","1383.15","0.12","90","0.5","90","0.5","","","","","","","","6","P -1","-P 1","2","","Iodido{4-phenyl-1-[1-(1,3-thiazol-2-yl-κ<i>N</i>)ethylidene]thiosemicarbazidato-κ^2^<i>N'</i>,<i>S</i>}{4-phenyl-1-[1-(1,3-thiazol-2-yl)ethylidene]thiosemicarbazide-κ<i>S</i>}cadmium(II)","","- C24 H23 Cd I N8 S4 -","- C24 H23 Cd I N8 S4 -","- C48 H46 Cd2 I2 N16 S8 -","2","1","BV2219","Venkatraman, Ramaiyer; Samuel, Dasary S.; Arslan, Zikri; Hossain, Md. Alamgir; Fronczek, Frank R.","Iodido{4-phenyl-1-[1-(1,3-thiazol-2-yl-κ<i>N</i>)ethylidene]thiosemicarbazidato-κ^2^<i>N</i>',<i>S</i>}{4-phenyl-1-[1-(1,3-thiazol-2-yl)ethylidene]thiosemicarbazide-κ<i>S</i>}cadmium(II)","Acta Crystallographica Section E","2013","69","5","m246","m247","10.1107/S160053681300915X","","","0.71073","MoKα","","0.0385","0.0269","","","0.0561","0.0597","","","","","","1.015","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237779","6.4389","0.0008","8.4336","0.0011","15.4958","0.0012","89.312","0.002","87.395","0.003","81.224","0.002","830.75","0.16","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","2-Tosyl-2,3,3a,4,9,9a-hexahydro-1<i>H</i>-benzo[<i>f</i>]isoindol-1-one","","- C19 H19 N O3 S -","- C19 H19 N O3 S -","- C38 H38 N2 O6 S2 -","2","1","BV2220","Wu, Min; Hu, Yi-Min","2-Tosyl-2,3,3a,4,9,9a-hexahydro-1<i>H</i>-benzo[<i>f</i>]isoindol-1-one","Acta Crystallographica Section E","2013","69","6","o926","","10.1107/S1600536813011045","","","0.71073","MoKα","","0.1258","0.0554","","","0.1132","0.1397","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237780","11.0527","0.0003","11.5834","0.0003","12.2015","0.0003","97.37","0.001","92.037","0.001","96.81","0.001","1536.25","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 1''-benzyl-2''-oxo-2',3',5',6',7',7a'-hexahydro-1'<i>H</i>-dispiro[indeno[1,2-<i>b</i>]quinoxaline-11,2'-pyrrolizine-3',3''-indoline]-1'-carboxylate monohydrate","","- C38 H34 N4 O4 -","- C38 H34 N4 O4 -","- C76 H68 N8 O8 -","2","1","BX2437","Kannan, Piskala Subburaman; Lanka, Srinu; Thennarasu, Sathiah; Vimala, Gopal; SubbiahPandi, Arunachalathevar","Ethyl 1''-benzyl-2''-oxo-2',3',5',6',7',7a'-hexahydro-1'<i>H</i>-dispiro[indeno[1,2-<i>b</i>]quinoxaline-11,2'-pyrrolizine-3',3''-indoline]-1'-carboxylate monohydrate","Acta Crystallographica Section E","2013","69","6","o854","o855","10.1107/S1600536813011537","","","0.71073","MoKα","","0.0463","0.0404","","","0.1081","0.1143","","","","","","1.016","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237781","8.4709","0.0007","17.1658","0.0013","7.9481","0.0006","90","","107.228","0.004","90","","1103.88","0.15","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 2-(5-chloro-1-methyl-2-oxo-2,3-dihydro-1<i>H</i>-indol-3-ylidene)acetate","","- C12 H10 Cl N O3 -","- C12 H10 Cl N O3 -","- C48 H40 Cl4 N4 O12 -","4","1","BX2438","Kannan, Piskala Subburaman; Yuvaraj, PanneerSelvam; Manivannan, Karthikeyan; Reddy, Boreddy S. R.; SubbiahPandi, A.","Methyl 2-(5-chloro-1-methyl-2-oxo-2,3-dihydro-1<i>H</i>-indol-3-ylidene)acetate","Acta Crystallographica Section E","2013","69","6","o856","","10.1107/S1600536813011768","","","0.71073","MoKα","","0.0441","0.0376","","","0.1296","0.1384","","","","","","1.127","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237782","6.895","0.005","10.443","0.003","13.373","0.003","105.4","0.02","103.96","0.04","104.84","0.04","846.5","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3,3'-({4-[(4,5-Dicyano-1<i>H</i>-imidazol-2-yl)diazenyl]phenyl}imino)dipropionic acid","","- C17 H15 N7 O4 -","- C17 H15 N7 O4 -","- C34 H30 N14 O8 -","2","1","BX2439","Centore, Roberto; Piccialli, Vincenzo; Tuzi, Angela","3,3'-({4-[(4,5-Dicyano-1<i>H</i>-imidazol-2-yl)diazenyl]phenyl}imino)dipropionic acid","Acta Crystallographica Section E","2013","69","5","o802","o803","10.1107/S1600536813011185","","","0.71073","Mokα","","0.3262","0.0754","","","0.1475","0.2163","","","","","","0.905","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237783","9.172","0.003","12.224","0.004","15.563","0.005","86.933","0.006","86.99","0.007","70.382","0.006","1640.2","0.9","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","1-[4-(Dimethylamino)benzylidene]-4-<i>o</i>-tolylthiosemicarbazide","","- C17 H20 N4 S -","- C17 H20 N4 S -","- C68 H80 N16 S4 -","4","2","BX2440","Huang, Rui-Yun; Xu, Qin-Juan; Lin, Li-Rong","1-[4-(Dimethylamino)benzylidene]-4-<i>o</i>-tolylthiosemicarbazide","Acta Crystallographica Section E","2013","69","6","o906","o907","10.1107/S1600536813012890","","","0.71073","MoKα","","0.1027","0.0577","","","0.1366","0.1548","","","","","","0.952","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237784","13.485","0.0004","15.7677","0.0004","16.7252","0.0004","90","","90","","90","","3556.24","0.16","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","<i>catena</i>-Poly[[bis(pyridine-κ<i>N</i>)zinc]-μ-5-carboxybenzene-1,3-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^]","","- C19 H14 N2 O6 Zn -","- C19 H14 N2 O6 Zn -","- C152 H112 N16 O48 Zn8 -","8","1","CQ2004","Yotnoi, Bunlawee; Rujiwatra, Apinpus","<i>catena</i>-Poly[[bis(pyridine-κ<i>N</i>)zinc]-μ-5-carboxybenzene-1,3-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^]","Acta Crystallographica Section E","2013","69","6","m345","","10.1107/S1600536813014347","","","0.71073","MoKα","","0.0418","0.0283","","","0.0693","0.0747","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237785","7.281","0.001","17.467","0.002","9.131","0.0012","90","","106.447","0.007","90","","1113.7","0.3","113","2","113","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(<i>Z</i>)-3β-(2-Chloroanilino)-17(20)-pregnene","","- C27 H38 Cl N -","- C27 H38 Cl N -","- C54 H76 Cl2 N2 -","2","1","CV5384","Hu, Jun-yi; Wang, Jiang; Xu, Ying-qian; Gao, Yun; Xiao, Guo-yong","(<i>Z</i>)-3β-(2-Chloroanilino)-17(20)-pregnene","Acta Crystallographica Section E","2013","69","5","o635","","10.1107/S1600536813007290","","","0.71073","MoKα","","0.0375","0.0292","","","0.064","0.0657","","","","","","0.972","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237786","7.207","0.004","14.176","0.007","11.686","0.005","90","","101.87","0.007","90","","1168.4","1","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(4-nitrophenyl) selenide","","- C12 H8 N2 O4 Se -","- C12 H8 N2 O4 Se -","- C48 H32 N8 O16 Se4 -","4","0.5","CV5389","Zuo, Zong-Le","Bis(4-nitrophenyl) selenide","Acta Crystallographica Section E","2013","69","5","o636","","10.1107/S1600536813007526","","","0.71073","MoKα","","0.038","0.0304","","","0.0719","0.0735","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237787","16.6359","0.0009","8.8629","0.0005","9.6221","0.0004","90","","102.775","0.002","90","","1383.59","0.12","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,3-Bis(2-methylprop-2-enoyl)-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","","- C15 H14 N2 O3 -","- C15 H14 N2 O3 -","- C60 H56 N8 O12 -","4","0.5","CV5390","Haridharan, N.; Ramkumar, V.","1,3-Bis(2-methylprop-2-enoyl)-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","6","o818","","10.1107/S1600536813011380","","","0.71073","MoKα","","0.0615","0.0566","","","0.1966","0.2084","","","","","","1.161","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237788","8.7761","0.0018","5.088","0.001","10.636","0.002","90","","101.381","0.004","90","","465.59","0.16","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","3,4-Diaminopyridinium hydrogen malonate","3,4-Diaminopyridinium 2-carboxyethanoate","","- C8 H11 N3 O4 -","- C8 H11 N3 O4 -","- C16 H22 N6 O8 -","2","1","CV5392","Thapa, Surendra; Draguta, Sergiu; Sandhu, Bhupinder; Antipin, Mikhail Yu.; Timofeeva, Tatiana V.","3,4-Diaminopyridinium hydrogen malonate","Acta Crystallographica Section E","2013","69","5","o670","","10.1107/S1600536813008763","","","0.71073","MoKα","","0.0486","0.0395","","","0.0966","0.1022","","","","","","1.183","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237789","9.6996","0.0019","16.29","0.003","14.168","0.003","90","","98.71","0.03","90","","2212.8","0.8","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-6-(4-Chlorophenyl)-4-[(2-cyano-3-phenylallyl)sulfanyl]-2,2-difluoro-3-phenyl-1,3,2-oxazaborinin-3-ium-2-uide","","- C25 H18 B Cl F2 N2 O S -","- C25 H18 B Cl F2 N2 O S -","- C100 H72 B4 Cl4 F8 N8 O4 S4 -","4","1","CV5394","Li, Ming; Wang, Shu-Wen; Wen, Li-Rong","(<i>E</i>)-6-(4-Chlorophenyl)-4-[(2-cyano-3-phenylallyl)sulfanyl]-2,2-difluoro-3-phenyl-1,3,2-oxazaborinin-3-ium-2-uide","Acta Crystallographica Section E","2013","69","5","o648","","10.1107/S1600536813007800","","","0.71073","MoKα","","0.0687","0.0582","","","0.1148","0.1202","","","","","","1.18","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237790","5.7161","0.0001","17.4091","0.0004","8.2505","0.0002","90","","103.513","0.001","90","","798.3","0.03","308","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>rac</i>-5-(1-Methylethyl)-2-sulfanylideneimidazolidin-4-one","","- C6 H10 N2 O S -","- C6 H10 N2 O S -","- C24 H40 N8 O4 S4 -","4","1","CV5395","de Castro, Rosane; Macedo, Jr, Fernando C.; Brito, Tiago O.; Fátima, Angelo de; Sabino, José R.","<i>rac</i>-5-(1-Methylethyl)-2-sulfanylideneimidazolidin-4-one","Acta Crystallographica Section E","2013","69","5","o643","","10.1107/S1600536813008337","","","0.71073","MoKα","","0.0446","0.0365","","","","0.1138","","","","","","1.023","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237791","6.2726","0.0002","6.3462","0.0002","9.1745","0.0003","92.436","0.003","92.193","0.003","94.341","0.003","363.52","0.02","293","2","293","2","","","","","","","","5","P -1","-P 1","2","ethane-1,2 diammonium chloride thiocyanate","Ethylendiammonium chloride thiocyanate","","- C3 H10 Cl N3 S -","- C3 H10 Cl N3 S -","- C6 H20 Cl2 N6 S2 -","2","1","CV5396","Karoui, Sahel; Kamoun, Slaheddine; Michaud, François","Ethylenediammonium chloride thiocyanate","Acta Crystallographica Section E","2013","69","5","o669","","10.1107/S1600536813008830","","","0.7107","MoKα","","0.0276","0.0245","","","0.0706","0.072","","","","","","1.076","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237792","9.0112","0.0006","11.6772","0.0008","9.0849","0.0006","90","","108.045","0.005","90","","908.94","0.11","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1<i>S</i>,3<i>R</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-2,2-Dibromo-10,10-dichloro-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","","- C17 H24 Br2 Cl2 -","- C17 H24 Br2 Cl2 -","- C34 H48 Br4 Cl4 -","2","1","CV5397","Ourhriss, Najia; Benharref, Ahmed; Saadi, Mohamed; Berraho, Moha; El Ammari, Lahcen","(1<i>S</i>,3<i>R</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-2,2-Dibromo-10,10-dichloro-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","Acta Crystallographica Section E","2013","69","5","o724","","10.1107/S1600536813009070","","","0.71073","MoKα","","0.0587","0.0382","","","0.084","0.0916","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237793","11.58","0.0011","13.695","0.0012","14.286","0.0013","118.401","0.002","90.977","0.001","108.404","0.001","1852.6","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","1,5-Bis[1-(4-bromophenyl)ethylidene]thiocarbonohydrazide","","- C17 H16 Br2 N4 S -","- C17 H16 Br2 N4 S -","- C68 H64 Br8 N16 S4 -","4","2","CV5398","Gao, Zhiqing","1,5-Bis[1-(4-bromophenyl)ethylidene]thiocarbonohydrazide","Acta Crystallographica Section E","2013","69","5","o723","","10.1107/S1600536813009720","","","0.71073","MoKα","","0.1723","0.0725","","","0.1666","0.2141","","","","","","0.955","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237794","14.174","0.003","5.9321","0.0012","18.796","0.004","90","","99.06","0.03","90","","1560.7","0.6","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-(2-Cyanobenzyl)-4,5,6,7-tetrahydrothieno[3,2-<i>c</i>]pyridin-2-yl acetate","","- C17 H16 N2 O2 S -","- C17 H16 N2 O2 S -","- C68 H64 N8 O8 S4 -","4","1","CV5399","Xie, Xiao-Shuai; Mu, Shuai; Liu, Ying; Liu, Deng-Ke","5-(2-Cyanobenzyl)-4,5,6,7-tetrahydrothieno[3,2-<i>c</i>]pyridin-2-yl acetate","Acta Crystallographica Section E","2013","69","5","o713","","10.1107/S1600536813009513","","","1.54187","CuKα","","0.0388","0.0375","","","0.0972","0.0984","","","","","","1.075","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237795","8.96","0.005","9.944","0.006","11.128","0.006","104.174","0.008","111.041","0.007","99.41","0.002","861.9","0.9","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","(3-Chlorophenyl)[(<i>E</i>)-2-(1,3-dithiolan-2-ylidene)hydrazinylidene]methyl 3-chlorobenzoate","","- C17 H12 Cl2 N2 O2 S2 -","- C17 H12 Cl2 N2 O2 S2 -","- C34 H24 Cl4 N4 O4 S4 -","2","1","CV5400","Yin, Ling","(3-Chlorophenyl)[(<i>E</i>)-2-(1,3-dithiolan-2-ylidene)hydrazinylidene]methyl 3-chlorobenzoate","Acta Crystallographica Section E","2013","69","5","o714","","10.1107/S1600536813009239","","","0.71073","MoKα","","0.0363","0.0302","","","0.0724","0.0735","","","","","","0.952","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237796","4.6408","0.0008","18.263","0.003","9.4482","0.0016","90","","94.294","0.003","90","","798.5","0.2","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","3-(4-Methoxyphenyl)-1,3-selenazolo[2,3-<i>b</i>][1,3]benzothiazol-4-ium hydrogen sulfate","","- C16 H13 N O5 S2 Se -","- C16 H13 N O5 S2 Se -","- C32 H26 N2 O10 S4 Se2 -","2","1","CV5401","Mammadova, Gunay Z.; Matsulevich, Zhanna V.; Borisova, Galina N.; Borisov, Alexander V.; Khrustalev, Victor N.","3-(4-Methoxyphenyl)-1,3-selenazolo[2,3-<i>b</i>][1,3]benzothiazol-4-ium hydrogen sulfate","Acta Crystallographica Section E","2013","69","5","o703","o704","10.1107/S1600536813009288","","","0.71073","MoKα","","0.0516","0.0395","","","0.0803","0.0845","","","","","","0.965","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237797","5.3188","0.0004","11.1525","0.0014","12.0279","0.0008","90","","101.256","0.007","90","","699.75","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[[tetraaquacadmium]-μ-5,5'-(1,4-phenylene)di(tetrazol-2-ido)-κ^2^<i>N</i>^2^:<i>N</i>^2'^]","","- C8 H12 Cd N8 O4 -","- C8 H12 Cd N8 O4 -","- C16 H24 Cd2 N16 O8 -","2","0.5","CV5403","Dang, Qinqin; Caiyun, Han","<i>catena</i>-Poly[[tetraaquacadmium]-μ-5,5'-(1,4-phenylene)di(tetrazol-2-ido)-κ^2^<i>N</i>^2^:<i>N</i>^2'^]","Acta Crystallographica Section E","2013","69","5","m283","","10.1107/S1600536813010441","","","0.71073","MoKα","","0.0629","0.0399","","","0.0763","0.0846","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237798","10.7396","0.001","16.3471","0.0014","20.112","0.002","90","","105.485","0.004","90","","3402.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6'-(1,3-Diphenyl-1<i>H</i>-pyrazol-4-yl)-7'-(1<i>H</i>-indol-3-ylcarbonyl)-2-oxo-1-(prop-2-en-1-yl)-5',6',7',7a'-tetrahydro-1'<i>H</i>-spiro[indoline-3,5'-pyrrolo[1,2-<i>c</i>][1,3]thiazole]-7'-carbonitrile","","- C41 H32 N6 O2 S -","- C41 H32 N6 O2 S -","- C164 H128 N24 O8 S4 -","4","1","CV5404","Kannan, Piskala Subburaman; Kathirvelan, Devaraj; Reddy, Boreddy Siva Rami; Govindan, Elumalai; SubbiahPandi, Arunachalathevar","6'-(1,3-Diphenyl-1<i>H</i>-pyrazol-4-yl)-7'-(1<i>H</i>-indol-3-ylcarbonyl)-2-oxo-1-(prop-2-en-1-yl)-5',6',7',7a'-tetrahydro-1'<i>H</i>-spiro[indoline-3,5'-pyrrolo[1,2-<i>c</i>][1,3]thiazole]-7'-carbonitrile","Acta Crystallographica Section E","2013","69","6","o857","o858","10.1107/S1600536813011513","","","0.71073","MoKα","","0.1125","0.0488","","","0.1055","0.1463","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237799","10.2657","0.0011","13.0675","0.0013","18.3415","0.0015","90","","90","","90","","2460.5","0.4","298","2","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","1,2-Bis{2-[(4-methoxybenzylidene)amino]phenyl}disulfane","","- C28 H24 N2 O2 S2 -","- C28 H24 N2 O2 S2 -","- C112 H96 N8 O8 S8 -","4","0.5","CV5405","Xin, Wei","1,2-Bis{2-[(4-methoxybenzylidene)amino]phenyl}disulfane","Acta Crystallographica Section E","2013","69","6","o896","","10.1107/S1600536813011598","","","0.71073","MoKα","","0.0842","0.0508","","","0.1206","0.1393","","","","","","0.953","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237800","5.4696","0.0004","13.7164","0.001","16.3117","0.0011","90","","90","","90","","1223.76","0.15","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-1,5-Diphenylpent-2-en-4-yn-1-one","","- C17 H12 O -","- C17 H12 O -","- C68 H48 O4 -","4","1","CV5408","Bunev, Alexander S.; Statsyuk, Vladimir E.; Utekhina, Nina V.; Khrustalev, Victor N.","(<i>E</i>)-1,5-Diphenylpent-2-en-4-yn-1-one","Acta Crystallographica Section E","2013","69","6","o911","","10.1107/S1600536813013044","","","0.71073","MoKα","","0.0731","0.0573","","","0.1015","0.1069","","","","","","1.072","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237801","9.559","0.004","9.656","0.003","16.392","0.006","78.584","0.006","82.056","0.006","68.39","0.006","1375.3","0.9","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 4-anilino-2,6-bis(4-chlorophenyl)-1-phenyl-1,2,5,6-tetrahydropyridine-3-carboxylate","","- C32 H28 Cl2 N2 O2 -","- C32 H28 Cl2 N2 O2 -","- C64 H56 Cl4 N4 O4 -","2","1","CV5409","Yu, Jianfeng; Tang, Shiming; Zeng, Jingbin; Yan, Zifeng","Ethyl 4-anilino-2,6-bis(4-chlorophenyl)-1-phenyl-1,2,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E","2013","69","6","o947","o948","10.1107/S1600536813013573","","","0.71073","MoKα","","0.1113","0.0703","","","0.2004","0.3104","","","","","","1.084","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237802","5.86715","0.00015","12.728","0.0003","10.2756","0.0003","90","","106.02","0.003","90","","737.55","0.04","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Acetoxy-γ-valerolactone","2-Methyl-5-oxotetrahydrofuran-2-yl acetate","","- C7 H10 O4 -","- C7 H10 O4 -","- C28 H40 O16 -","4","1","CV5410","Tristram, Cameron; Gainsford, Graeme J.; Hinkley, Simon","Acetoxy-γ-valerolactone","Acta Crystallographica Section E","2013","69","6","o952","","10.1107/S1600536813013561","","","1.54184","CuKα","","0.0346","0.0316","","","0.0809","0.0835","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237803","9.583","0.0002","10.9142","0.0002","16.8172","0.0003","79.21","0.002","84.542","0.003","74.193","0.002","1660.68","0.06","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","2-(4-Methylpyridin-2-yl)-4',4',6',6'-tetrakis(pyrrolidin-1-yl)-1<i>H</i>,2<i>H</i>-spiro[naphtho[1,2-<i>e</i>][1,3,2]oxazaphosphinine-3,2'-[1,3,5,2,4,6]triazatriphosphinine]","","- C33 H46 N9 O P3 -","- C33 H46 N9 O P3 -","- C66 H92 N18 O2 P6 -","2","1","CV5414","Işıklan, Muhammet; Sonkaya, Ömer; Hökelek, Tuncer","2-(4-Methylpyridin-2-yl)-4',4',6',6'-tetrakis(pyrrolidin-1-yl)-1<i>H</i>,2<i>H</i>-spiro[naphtho[1,2-<i>e</i>][1,3,2]oxazaphosphinine-3,2'-[1,3,5,2,4,6]triazatriphosphinine]","Acta Crystallographica Section E","2013","69","6","o994","o995","10.1107/S1600536813014220","","","0.71073","MoKα","","0.0505","0.0395","","","0.102","0.1088","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237804","15.6996","0.0017","8.8767","0.0009","29.591","0.003","90","","90","","90","","4123.8","0.7","296","2","296","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1-[2-(Trityloxy)phenyl]ethanone","","- C27 H22 O2 -","- C27 H22 O2 -","- C216 H176 O16 -","8","1","DS2228","Zhao, Pengying","1-[2-(Trityloxy)phenyl]ethanone","Acta Crystallographica Section E","2013","69","6","o918","","10.1107/S1600536813012956","","","0.71073","MoKα","","0.0772","0.0451","","","0.1101","0.1283","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237805","11.1257","0.0002","7.4232","0.0001","19.4212","0.0003","90","","97.319","0.001","90","","1590.9","0.04","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(2-Fluorophenyl)-3-methylsulfanyl-5-phenyl-1-benzofuran","","- C21 H15 F O S -","- C21 H15 F O S -","- C84 H60 F4 O4 S4 -","4","1","DS2230","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","2-(2-Fluorophenyl)-3-methylsulfanyl-5-phenyl-1-benzofuran","Acta Crystallographica Section E","2013","69","5","o721","","10.1107/S1600536813009768","","","0.71073","MoKα","","0.0488","0.037","","","0.094","0.1009","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237806","12.1493","0.0009","14.2208","0.0011","14.71","0.0011","101.811","0.001","98.278","0.001","109.759","0.001","2277.7","0.3","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","Aquacarbonyl(ferrocenyldithiophosphonato-κ^2^<i>S</i>,<i>S</i>')bis(triphenylphosphane-κ<i>P</i>)ruthenium(II) dichloromethane monosolvate","","- C48 H43 Cl2 Fe O3 P3 Ru S2 -","- C48 H43 Cl2 Fe O3 P3 Ru S2 -","- C96 H86 Cl4 Fe2 O6 P6 Ru2 S4 -","2","1","DS2231","Zhu, Hang; Ma, Qing; Shi, Hua-Tian; Chen, Qun; Zhang, Qian-Feng","Aquacarbonyl(ferrocenyldithiophosphonato-κ^2^<i>S</i>,<i>S</i>')bis(triphenylphosphane-κ<i>P</i>)ruthenium(II) dichloromethane monosolvate","Acta Crystallographica Section E","2013","69","6","m343","","10.1107/S1600536813014311","","","0.71073","MoKα","","0.0711","0.0543","","","0.1403","0.1543","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237807","12.325","0.0018","8.8409","0.0013","16.721","0.002","90","","98.558","0.002","90","","1801.7","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium trichlorido(<i>N</i>,<i>N</i>'-dimethylformamide-κ<i>O</i>)zinc","","- C11 H27 Cl3 N2 O Zn -","- C11 H27 Cl3 N2 O Zn -","- C44 H108 Cl12 N8 O4 Zn4 -","4","1","DS2232","Chao, Guo-Ping; Shi, Hua-Tian; Chen, Qun; Zhang, Qian-Feng","Tetraethylammonium trichlorido(<i>N</i>,<i>N</i>'-dimethylformamide-κ<i>O</i>)zinc","Acta Crystallographica Section E","2013","69","6","m344","","10.1107/S1600536813014323","","","0.71073","MoKα","","0.0405","0.0305","","","0.0732","0.0781","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237808","20.5028","0.0006","9.5882","0.0004","18.7797","0.0006","90","","96.629","0.003","90","","3667.1","0.2","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[[diaquabis[1,2-bis(pyridin-4-yl)diazene]copper(II)]-μ-1,2-bis(pyridin-4-yl)diazene] bis(perchlorate)]","","- C30 H28 Cl2 Cu N12 O10 -","- C30 H28 Cl2 Cu N12 O10 -","- C120 H112 Cl8 Cu4 N48 O40 -","4","0.5","FB2274","Ballestero-Martínez, Ernesto; Campos-Fernández, Cristian Saul; Soto-Tellini, Victor Hugo; Gonzalez-Montiel, Simplicio; Martínez-Otero, Diego","<i>catena</i>-Poly[[[diaquabis[1,2-bis(pyridin-4-yl)diazene]copper(II)]-μ-1,2-bis(pyridin-4-yl)diazene] bis(perchlorate)]","Acta Crystallographica Section E","2013","69","6","m317","m318","10.1107/S1600536813012269","","","0.71073","MoKα","","0.0571","0.0427","","","0.1021","0.1063","","","","","","2.67","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237809","5.7379","0.0002","7.7338","0.0003","17.167","0.0007","97.887","0.002","92.864","0.002","107.34","0.002","716.97","0.05","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","Benzylammonium heptanoate","","- C14 H23 N O2 -","- C14 H23 N O2 -","- C28 H46 N2 O4 -","2","1","FB2281","Wood, Mary H.; Clarke, Stuart M.","Benzylammonium heptanoate","Acta Crystallographica Section E","2013","69","5","o755","o756","10.1107/S1600536813009574","","","0.71073","MoKα","","0.0828","0.0542","","","0.1253","0.1412","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237810","9.2503","0.0001","29.3854","0.0004","16.2616","0.0002","90","","96.901","0.001","90","","4388.27","0.09","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9-[3-(Carbazol-9-yl)-5-methylphenyl]carbazole","","- C31 H22 N2 -","- C31 H22 N2 -","- C248 H176 N16 -","8","2","FB2283","Kim, Jae Eun; Kim, Jun Hee; Sim, Wonbo; Lee, Jai Young","9-[3-(Carbazol-9-yl)-5-methylphenyl]carbazole","Acta Crystallographica Section E","2013","69","6","o828","","10.1107/S1600536813011641","","","0.71073","MoKα","","0.087","0.0509","","","0.1041","0.1173","","","","","","1.028","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237811","8.6733","0.0008","11.8116","0.0009","17.6227","0.0015","90","","95.661","0.003","90","","1796.6","0.3","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-<i>N</i>-(3,3-Diphenylallylidene)-2-(trifluoromethyl)aniline","","- C22 H16 F3 N -","- C22 H16 F3 N -","- C88 H64 F12 N4 -","4","1","FF2102","Yu, Byung-Yong; Lee, Ji Eun; Cho, Yong Seo; Cha, Joo Hwan; Lee, Jae Kyun","(<i>E</i>)-<i>N</i>-(3,3-Diphenylallylidene)-2-(trifluoromethyl)aniline","Acta Crystallographica Section E","2013","69","5","o757","","10.1107/S1600536813010283","","","0.71075","MoKα","","","0.0507","","","","0.1579","","","","","","1.015","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237812","12.955","0.003","7.346","0.0016","14.422","0.003","90","","103.263","0.01","90","","1335.9","0.5","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 2-aminobiphenyl-4,4'-dicarboxylate","","- C16 H15 N O4 -","- C16 H15 N O4 -","- C64 H60 N4 O16 -","4","1","FF2103","Lehane, Ryan L.; Golen, James A.; Rheingold, Arnold L.; Manke, David R.","Dimethyl 2-aminobiphenyl-4,4'-dicarboxylate","Acta Crystallographica Section E","2013","69","5","o797","","10.1107/S1600536813010775","","","0.71073","MoKα","","0.0692","0.0451","","","0.111","0.1239","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237813","14.5204","0.0009","7.2358","0.0005","10.3955","0.0006","90","","90","","90","","1092.22","0.12","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Tetraammine-2κ^4^<i>C</i>-μ-cyanido-1:2κ^2^<i>C</i>:<i>N</i>-tricyanido-1κ^3^<i>C</i>-copper(II)palladium(II)","","- C4 H12 Cu N8 Pd -","- C4 H12 Cu N8 Pd -","- C16 H48 Cu4 N32 Pd4 -","4","0.5","FF2104","Suchá, Veronika; Kuchár, Juraj; Harms, Klaus","Tetraammine-2κ^4^<i>C</i>-μ-cyanido-1:2κ^2^<i>C</i>:<i>N</i>-tricyanido-1κ^3^<i>C</i>-copper(II)palladium(II)","Acta Crystallographica Section E","2013","69","5","i32","","10.1107/S1600536813011033","","","0.71073","MoKα","","0.0278","0.0247","","","0.0604","0.0611","","","","","","1.004","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237814","5.9367","0.0007","18.8521","0.0016","19.3709","0.0016","90","","99.681","0.003","90","","2137.1","0.4","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-9-(4-Fluorostyryl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-2<i>H</i>-xanthene-1,8-dione","","- C25 H27 F O3 -","- C25 H27 F O3 -","- C100 H108 F4 O12 -","4","1","FF2106","Lee, Jae Kyun; Min, Sun-Joon; Cho, Yong Seo; Cha, Joo Hwan; Won, Sung Ok","(<i>E</i>)-9-(4-Fluorostyryl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-2<i>H</i>-xanthene-1,8-dione","Acta Crystallographica Section E","2013","69","6","o985","","10.1107/S1600536813014049","","","0.71075","MoKα","","","0.0534","","","","0.169","","","","","","1.088","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237815","15.1475","0.0006","7.6501","0.0003","15.8339","0.0006","90","","102.105","0.003","90","","1794.03","0.12","292","2","292","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{2-[(1,3-Benzothiazol-2-yl)methoxy]-5-bromophenyl}(phenyl)methanone","","- C21 H14 Br N O2 S -","- C21 H14 Br N O2 S -","- C84 H56 Br4 N4 O8 S4 -","4","1","FF2107","Venugopala, K. N.; Nayak, Susanta K.; Odhav, B.","{2-[(1,3-Benzothiazol-2-yl)methoxy]-5-bromophenyl}(phenyl)methanone","Acta Crystallographica Section E","2013","69","6","o984","","10.1107/S1600536813014086","","","0.7107","MoKα","","0.1196","0.0539","","","0.0997","0.12","","","","","","0.982","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237816","8.5444","0.0003","10.9406","0.0004","37.8017","0.0015","90","","90","","90","","3533.7","0.2","90","2","90","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Metacridamide B","(3<i>S</i>,6<i>E</i>,8<i>S</i>,9<i>R</i>,10<i>E</i>,12<i>S</i>,13<i>S</i>,14<i>E</i>,16<i>S</i>,17<i>R</i>)-3-Benzyl-9,13-dihydroxy-6,8,10,12,14,16- hexamethyl-17-[(2<i>S</i>,4<i>S</i>)-4-methylhexan-2-yl]-1-oxa-4-azacycloheptadeca-6,10,14-triene-2,5-dione methanol-<i>d</i>~4~ monosolvate","","- C36 H57 N O6 -","- C36 H57 N O6 -","- C144 H228 N4 O24 -","4","1","FJ2623","Englich, Ulrich; Krasnoff, Stuart B.","Metacridamide B methanol-<i>d</i>~4~ monosolvate","Acta Crystallographica Section E","2013","69","5","o742","","10.1107/S1600536813009641","","","1.54178","CuKα","","0.0433","0.0426","","","0.1137","0.1147","","","","","","1.111","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237817","9.9621","0.0005","10.8702","0.0006","12.2298","0.0007","70.421","0.002","74.56","0.002","77.296","0.002","1190.24","0.11","123","2","123","2","","","","","","","","5","P -1","-P 1","2","Olanzapine propan-2-ol disolvate","2-Methyl-4-(4-methylpiperazin-1-yl)-10<i>H</i>-thieno[2,3-<i>b</i>][1,5]benzodiazepine propan-2-ol disolvate","","- C23 H36 N4 O2 S -","- C23 H36 N4 O2 S -","- C46 H72 N8 O4 S2 -","2","1","FJ2624","Bhardwaj, Rajni M.; Florence, Alastair J.","2-Methyl-4-(4-methylpiperazin-1-yl)-10<i>H</i>-thieno[2,3-<i>b</i>][1,5]benzodiazepine (olanzapine) propan-2-ol disolvate","Acta Crystallographica Section E","2013","69","5","o752","o753","10.1107/S1600536813009811","","","0.71073","MoKα","","0.0482","0.0376","","","0.0983","0.1058","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237818","17.743","0.0009","8.7581","0.0003","8.1135","0.0003","90","","101.795","0.005","90","","1234.18","0.09","123","0.1","123","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3,4-Dimethoxy-4'-methylbiphenyl","","- C15 H16 O2 -","- C15 H16 O2 -","- C60 H64 O8 -","4","1","FJ2625","Lahtinen, Manu; Nummelin, Sami","3,4-Dimethoxy-4'-methylbiphenyl","Acta Crystallographica Section E","2013","69","5","o681","","10.1107/S1600536813008957","","","1.5418","CuKα","","0.0629","0.0519","","","0.1302","0.143","","","","","","1.073","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237819","42.9266","0.0017","5.9741","0.0003","5.068","0.0002","90","","90","","90","","1299.68","0.1","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","(2<i>E</i>)-1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one","","- C15 H10 Cl N O3 -","- C15 H10 Cl N O3 -","- C60 H40 Cl4 N4 O12 -","4","1","FJ2627","Yamuna, T. S.; Yathirajan, H. S.; Jasinski, Jerry P.; Keeley, Amanda C.; Narayana, B.; Sarojini, B. K.","(2<i>E</i>)-1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","5","o790","o791","10.1107/S1600536813010854","","","1.5418","CuKα","","0.0495","0.0484","","","0.099","0.0996","","","","","","1.141","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237820","12.6455","0.0016","12.7423","0.0016","8.9306","0.0009","90","","90","","90","","1439","0.3","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","<i>N</i>'-[(<i>E</i>)-2-Hydroxy-5-methoxybenzylidene]pyridine-4-carbohydrazide monohydrate","","- C14 H15 N3 O4 -","- C14 H15 N3 O4 -","- C56 H60 N12 O16 -","4","1","FJ2628","Prasanna, M. K.; Sithambaresan, M.; Pradeepkumar, K.; Kurup, M. R. Prathapachandra","<i>N</i>'-[(<i>E</i>)-2-Hydroxy-5-methoxybenzylidene]pyridine-4-carbohydrazide monohydrate","Acta Crystallographica Section E","2013","69","6","o881","","10.1107/S160053681301235X","","","0.71073","MoKα","","0.0764","0.0454","","","0.1077","0.1238","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237821","4.2399","0.0002","10.4463","0.0004","14.5144","0.0006","107.611","0.002","90.628","0.003","99.784","0.003","602.49","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","3-Benzyl-6-bromo-1<i>H</i>-imidazo[4,5-<i>b</i>]pyridin-2(3<i>H</i>)-one","","- C13 H10 Br N3 O -","- C13 H10 Br N3 O -","- C26 H20 Br2 N6 O2 -","2","1","FJ2630","Kandri Rodi, Youssef; Haoudi, Amal; Capet, Frédéric; Mazzah, Ahmed; Essassi, El Mokhtar; El Ammari, Lahcen","3-Benzyl-6-bromo-1<i>H</i>-imidazo[4,5-<i>b</i>]pyridin-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","6","o962","","10.1107/S1600536813013780","","","0.71073","MoKα","","0.048","0.0326","","","0.0793","0.0852","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237822","24.287","0.003","8.6534","0.0012","18.355","0.002","90","","94.851","0.009","90","","3843.8","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido{2,6-diisopropyl-<i>N</i>-[(<i>S</i>)-pyrrolidin-2-ylmethyl]aniline-κ^2^<i>N</i>,<i>N</i>'}palladium(II)","","- C17 H28 Cl2 N2 Pd -","- C17 H28 Cl2 N2 Pd -","- C136 H224 Cl16 N16 Pd8 -","8","1","FK2069","Nayab, Saira; Lee, Hong-In; Jeong, Jong Hwa","Dichlorido{2,6-diisopropyl-<i>N</i>-[(<i>S</i>)-pyrrolidin-2-ylmethyl]aniline-κ^2^<i>N</i>,<i>N</i>'}palladium(II)","Acta Crystallographica Section E","2013","69","5","m238","m239","10.1107/S1600536813008271","","","0.71073","MoKα","","0.0453","0.038","","","0.1031","0.1053","","","","","","1.077","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237823","19.4734","0.0004","7.7679","0.0002","19.8042","0.0004","90","","97.552","0.001","90","","2969.75","0.11","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl)-2-hydroxyimino-<i>N</i>'-[1-(pyridin-2-yl)ethylidene]acetohydrazide","","- C14 H16 N6 O2 -","- C14 H16 N6 O2 -","- C112 H128 N48 O16 -","8","2","FK2070","Plutenko, Maxym O.; Lampeka, Rostislav D.; Haukka, Matti; Nordlander, Ebbe","A second monoclinic polymorph of 2-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)-2-hydroxyimino-<i>N</i>'-[1-(pyridin-2-yl)ethylidene]acetohydrazide","Acta Crystallographica Section E","2013","69","5","o765","o766","10.1107/S1600536813009628","","","0.71073","MoKα","","0.0491","0.0378","","","0.0983","0.1061","","","","","","1.025","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237824","6.689","0.003","9.009","0.004","13.257","0.006","87.193","0.005","87.719","0.005","82.674","0.005","791","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(3-Chlorophenyl)-5-(2,4-dihydroxybenzoyl)pyridin-2(1<i>H</i>)-one","","- C18 H12 Cl N O4 -","- C18 H12 Cl N O4 -","- C36 H24 Cl2 N2 O8 -","2","1","FY2085","Ren, Fang; Li, Guifeng; Zhang, Quanying; Yao, Jinhua; Zhang, Xuli","1-(3-Chlorophenyl)-5-(2,4-dihydroxybenzoyl)pyridin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2013","69","5","o732","","10.1107/S1600536813009689","","","0.71073","MoKα","","0.0969","0.078","","","0.2153","0.2334","","","","","","0.999","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237825","5.8062","0.0004","9.9267","0.0007","18.4548","0.0013","103.281","0.002","92.49","0.002","104.741","0.002","995.26","0.12","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","Diethyl 4-hydroxy-4-methyl-2-(4-methylphenyl)-6-oxocyclohexane-1,3-dicarboxylate","","- C20 H26 O6 -","- C20 H26 O6 -","- C40 H52 O12 -","2","1","FY2087","Ismiev, Arif I.; Gadirova, Narmina A.; Hajiyeva, Kushvar E.; Askerov, Rizvan K.; Potekhin, Konstantin A.","(1<i>R</i>*,2<i>R</i>*,3<i>S</i>*,4<i>R</i>*)-Diethyl 4-hydroxy-4-methyl-2-(4-methylphenyl)-6-oxocyclohexane-1,3-dicarboxylate","Acta Crystallographica Section E","2013","69","5","o734","","10.1107/S1600536813009872","","","0.71073","MoKα","","0.0917","0.0533","","","0.121","0.1405","","","","","","1.006","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237826","18.8906","0.0008","6.8391","0.0003","15.3542","0.0008","90","","126.815","0.003","90","","1588.08","0.14","150","2","150","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Alternariol 9-<i>O</i>-methyl ether dimethyl sulfoxide monosolvate","3,7-Dihydroxy-9-methoxy-1-methyl-6<i>H</i>-benzo[<i>c</i>]chromen-6-one dimethylsulfoxide monosolvate","","- C17 H18 O6 S -","- C17 H18 O6 S -","- C68 H72 O24 S4 -","4","0.5","FY2088","Dasari, Sreekanth; Miller, Kristin I.; Kalaitzis, John A.; Bhadbhade, Mohan; Neilan, Brett A.","Alternariol 9-<i>O</i>-methyl ether dimethyl sulfoxide monosolvate","Acta Crystallographica Section E","2013","69","6","o872","o873","10.1107/S1600536813012294","","","0.71073","MoKα","","0.0356","0.0319","","","0.0898","0.0933","","","","","","1.095","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237827","10.3457","0.0007","5.4662","0.0005","13.2446","0.0012","90","","102.849","0.002","90","","730.25","0.11","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(4a<i>R</i>,9<i>R</i>,9a<i>R</i>)-7-Bromo-9-nitromethyl-2,3,4,4a,9,9a-hexahydro-1<i>H</i>-xanthen-1-one","","- C14 H14 Br N O4 -","- C14 H14 Br N O4 -","- C28 H28 Br2 N2 O8 -","2","1","FY2090","Wu, Chao; Guo, Yan-Jun; Xia, Ai-Bao","(4a<i>R</i>,9<i>R</i>,9a<i>R</i>)-7-Bromo-9-nitromethyl-2,3,4,4a,9,9a-hexahydro-1<i>H</i>-xanthen-1-one","Acta Crystallographica Section E","2013","69","5","o794","","10.1107/S1600536813008659","","","0.71073","MoKα","","0.096","0.0517","","","0.1147","0.1367","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237828","8.4361","0.0003","8.8812","0.0003","11.2582","0.0004","87.692","0.002","71.022","0.002","89.21","0.002","797","0.05","190","2","190","2","","","","","","","","4","P -1","-P 1","2","","3-Acetyl-2-methyl-4-(pyridin-3-yl)-1,4-dihydroindeno[1,2-<i>b</i>]pyridin-5-one","","- C20 H16 N2 O2 -","- C20 H16 N2 O2 -","- C40 H32 N4 O4 -","2","1","FY2091","Bisenieks, Imants; Mishnev, Anatoly; Bruvere, Imanta; Vigante, Brigita; Andzans, Zigmars","3-Acetyl-2-methyl-4-(pyridin-3-yl)-1,4-dihydroindeno[1,2-<i>b</i>]pyridin-5-one","Acta Crystallographica Section E","2013","69","5","o717","","10.1107/S1600536813009719","","","0.71073","MoKα","","0.0678","0.0469","","","0.1128","0.1244","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237829","6.4604","0.0003","10.9964","0.0004","12.9074","0.0005","93.205","0.003","96.446","0.003","100.507","0.003","893.14","0.06","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","4-(Adamantan-1-yl)-2-(4-fluorophenyl)quinoline","","- C25 H24 F N -","- C25 H24 F N -","- C50 H48 F2 N2 -","2","1","FY2093","Kozubková, Zuzana; Babjaková, Eva; Bartoš, Peter; Vícha, Robert","4-(Adamantan-1-yl)-2-(4-fluorophenyl)quinoline","Acta Crystallographica Section E","2013","69","6","o882","","10.1107/S1600536813012336","","","0.71073","MoKα","","0.0451","0.0337","","","0.0961","0.099","","","","","","1.078","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237830","4.6074","0.0007","21.68","0.003","12.7907","0.0018","90","","93.342","0.002","90","","1275.5","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-[(3,4-Dichlorobenzylidene)amino]-4-methylphenol","","- C14 H11 Cl2 N O -","- C14 H11 Cl2 N O -","- C56 H44 Cl8 N4 O4 -","4","1","FY2096","Kose, Muhammet; Gonul, Ilyas; McKee, Vickie","2-[(3,4-Dichlorobenzylidene)amino]-4-methylphenol","Acta Crystallographica Section E","2013","69","6","o961","","10.1107/S1600536813013585","","","0.71073","MoKα","","0.0458","0.0349","","","0.0879","0.0935","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237831","13.6892","0.0005","6.0339","0.0002","17.1786","0.0007","90","","92.741","0.002","90","","1417.32","0.09","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(2-Fluorophenylsulfinyl)-2,4,6-trimethyl-1-benzofuran","","- C17 H15 F O2 S -","- C17 H15 F O2 S -","- C68 H60 F4 O8 S4 -","4","1","FY2099","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","3-(2-Fluorophenylsulfinyl)-2,4,6-trimethyl-1-benzofuran","Acta Crystallographica Section E","2013","69","6","o998","","10.1107/S160053681301461X","","","0.71073","MoKα","","0.053","0.0426","","","0.1073","0.1139","","","","","","1.066","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237832","7.547","0.005","20.216","0.005","13.415","0.005","90","","96.07","0.005","90","","2035.3","1.6","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 3-(pyridin-4-ylmethylidene)dithiocarbazate","","- C8 H9 N3 S2 -","- C8 H9 N3 S2 -","- C64 H72 N24 S16 -","8","2","GG2112","Wang, Hui; Hossain, Abul-Monsur-Showkot; Wang, Shi-Chao; Tian, Yu-Peng","Methyl 3-(pyridin-4-ylmethylidene)dithiocarbazate","Acta Crystallographica Section E","2013","69","5","o712","","10.1107/S1600536813009409","","","0.71069","MoKα","","0.0716","0.0435","","","0.1038","0.1237","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237833","6.3535","0.0003","10.7304","0.0006","8.5629","0.0004","90","","99.49","0.002","90","","575.79","0.05","290","2","290","2","","","","","","","","7","P 1 21 1","P 2yb","4","","<i>fac</i>-diaquatrichlorido[(dimethylphosphoryl)methanaminium-κ<i>O</i>]manganese(II)","","- C3 H15 Cl3 Mn N O3 P -","- C3 H15 Cl3 Mn N O3 P -","- C6 H30 Cl6 Mn2 N2 O6 P2 -","2","1","GG2113","Reiss, Guido J.","Pseudosymmetric <i>fac</i>-diaquatrichlorido[(dimethylphosphoryl)methanaminium-κ<i>O</i>]manganese(II)","Acta Crystallographica Section E","2013","69","5","m250","m251","10.1107/S1600536813008751","","","0.71073","MoKα","","0.0143","0.0142","","","0.0375","0.0377","","","","","","1.109","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237834","4.7573","0.0001","11.1432","0.0003","19.3311","0.0005","90","","90","","90","","1024.77","0.04","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>R</i>)-2-Cyano-<i>N</i>-(1-phenylethyl)acetamide","","- C11 H12 N2 O -","- C11 H12 N2 O -","- C44 H48 N8 O4 -","4","1","GK2561","Kumar, Mohan; Madhukar, B. S.; Sridhar, M. A.; Bhadregowda, D. G.; Kapoor, Kamini; Gupta, Vivek K.; Kant, Rajni","(<i>R</i>)-2-Cyano-<i>N</i>-(1-phenylethyl)acetamide","Acta Crystallographica Section E","2013","69","5","o653","","10.1107/S1600536813008131","","","0.71073","MoKα","","0.037","0.0326","","","0.0767","0.0791","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237835","19.6446","0.0004","21.5251","0.0004","22.9585","0.0004","90","","90","","90","","9708","0.3","193","2","193","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","(4-Ethoxybenzoyl)[8-(4-ethoxybenzoyl)-2,7-dimethoxynaphthalen-1-yl]methanone","","- C30 H28 O6 -","- C30 H28 O6 -","- C480 H448 O96 -","16","0.5","GK2562","Sasagawa, Kosuke; Sakamoto, Rei; Hijikata, Daichi; Yonezawa, Noriyuki; Okamoto, Akiko","(4-Ethoxybenzoyl)[8-(4-ethoxybenzoyl)-2,7-dimethoxynaphthalen-1-yl]methanone","Acta Crystallographica Section E","2013","69","5","o651","","10.1107/S1600536813008581","","","1.54187","CuKα","","0.0421","0.041","","","0.0976","0.0986","","","","","","1.148","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237836","20.8009","0.0012","10.1124","0.0007","6.6121","0.0005","90","","100.787","0.006","90","","1366.26","0.16","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[2-(hydroxyimino)cyclohexan-1-one oximato-κ^2^<i>N</i>,<i>N</i>']copper(II)","","- C12 H18 Cu N4 O4 -","- C12 H18 Cu N4 O4 -","- C48 H72 Cu4 N16 O16 -","4","0.5","GK2564","Melnic, Elena; Coropceanu, Eduard B.; Croitor, Lilia","Bis[2-(hydroxyimino)cyclohexan-1-one oximato-κ^2^<i>N</i>,<i>N</i>']copper(II)","Acta Crystallographica Section E","2013","69","5","m240","","10.1107/S160053681300785X","","","0.71073","MoKα","","0.0686","0.0419","","","0.0915","0.1089","","","","","","0.998","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237837","11.1865","0.0005","18.1771","0.0008","13.4748","0.0006","90","","112.883","0.001","90","","2524.3","0.2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Ir(TpMe2)(C4H8)(PMe3) M-37","(Butane-1,4-diyl)(trimethylphosphane-κ<i>P</i>)[tris(3,5-dimethylpyrazol-1-yl-κ<i>N</i>^2^)hydroborato]iridium(III)","","- C22 H39 B Ir N6 P -","- C22 H39 B Ir N6 P -","- C88 H156 B4 Ir4 N24 P4 -","4","1","GK2565","Gómez, Margarita; Santos, Laura L.; Paneque, Margarita; Mereiter, Kurt","(Butane-1,4-diyl)(trimethylphosphane-κ<i>P</i>)[tris(3,5-dimethylpyrazol-1-yl-κ<i>N</i>^2^)hydroborato]iridium(III)","Acta Crystallographica Section E","2013","69","5","m234","m235","10.1107/S1600536813008040","","","0.71073","MoKα","","0.0185","0.0165","","","0.0397","0.0404","","","","","","1.076","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237838","9.3986","0.0003","10.3793","0.0003","12.6207","0.0003","80.735","0.002","81.959","0.002","77.999","0.002","1181.3","0.06","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","6-[3-(<i>p</i>-Tolylsulfonylamino)propyl]diquinothiazine","<i>N</i>-[3-(Diquino[3,2-<i>b</i>;2',3'-<i>e</i>][1,4]thiazin-6-yl)propyl]-4-methylbenzenesulfonamide","","- C28 H24 N4 O2 S2 -","- C28 H24 N4 O2 S2 -","- C56 H48 N8 O4 S4 -","2","1","GK2566","Jeleń, Małgorzata; Shkurenko, Aleksander; Suwińska, Kinga; Pluta, Krystian; Morak-Młodawska, Beata","6-[3-(<i>p</i>-Tolylsulfonylamino)propyl]diquinothiazine","Acta Crystallographica Section E","2013","69","6","o972","o973","10.1107/S1600536813013950","","","0.71073","MoKα","","0.0363","0.0332","","","0.0902","0.0927","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237839","7.642","0.003","8.111","0.004","14.043","0.006","97.539","0.008","98.055","0.008","92.695","0.008","852.5","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 7-oxo-7<i>H</i>-benzo[<i>de</i>]imidazo[5,1-<i>a</i>]isoquinoline-11-carboxylate‒trifluoroacetic acid (1/1)","","- C19 H13 F3 N2 O5 -","- C19 H13 F3 N2 O5 -","- C38 H26 F6 N4 O10 -","2","1","GK2567","Stibrany, Robert T.; Potenza, Joseph A.","Ethyl 7-oxo-7<i>H</i>-benzo[<i>de</i>]imidazo[5,1-<i>a</i>]isoquinoline-11-carboxylate‒trifluoroacetic acid (1/1)","Acta Crystallographica Section E","2013","69","6","o977","o978","10.1107/S1600536813013834","","","0.71073","MoKα","","0.0653","0.0495","","","0.1284","0.1398","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237840","18.929","0.0005","16.1945","0.0007","19.0895","0.0017","90","","97.368","0.007","90","","5803.5","0.6","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis[μ-1,3-bis(diphenylphosphanyl)propane-κ^2^<i>P</i>:<i>P</i>']digold(I) tetrachloridonickelate(II) diethyl ether monosolvate","","- C58 H62 Au2 Cl4 Ni O P4 -","- C58 H62 Au2 Cl4 Ni O P4 -","- C232 H248 Au8 Cl16 Ni4 O4 P16 -","4","1","GK2571","Igashira-Kamiyama, Asako; Itai, Takuma; Arai, Yuka; Konno, Takumi","Bis[μ-1,3-bis(diphenylphosphanyl)propane-κ^2^<i>P</i>:<i>P</i>']digold(I) tetrachloridonickelate(II) diethyl ether monosolvate","Acta Crystallographica Section E","2013","69","6","m339","","10.1107/S1600536813013470","","","0.71075","MoKα","","0.0706","0.0475","","","0.078","0.0834","","","","","","1.138","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237841","8.113","0.003","11.733","0.005","12.713","0.002","76.397","0.001","73.49","0.002","86.185","0.005","1127.7","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","2-(4-(trifluoromethyl)phenyl)-1H-phenanthro[9,10-d]imidazole","1-(4-Methylphenyl)-2-[4-(trifluoromethyl)phenyl]-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazole","","- C29 H19 F3 N2 -","- C29 H19 F3 N2 -","- C58 H38 F6 N4 -","2","1","GO2084","Mohandas, T.; Sathishkumar, R.; Jayabharathi, J.; Pasupathy, A.; Sakthivel, P.","1-(4-Methylphenyl)-2-[4-(trifluoromethyl)phenyl]-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazole","Acta Crystallographica Section E","2013","69","5","o710","","10.1107/S1600536813009471","","","0.71073","MoKα","","0.0978","0.0682","","","0.2072","0.2357","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237842","15.6277","0.0007","4.0784","0.0002","12.1026","0.0005","90","","105.81","0.004","90","","742.19","0.06","290.51","0.1","290.51","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(<i>E</i>,<i>E</i>,<i>E</i>)-1,6-Bis(4-chlorophenyl)hexa-1,3,5-triene","<i>trans</i>,<i>trans</i>,<i>trans</i>-1,6-Bis(4-chlorophenyl)hexa-1,3,5-triene","","- C18 H14 Cl2 -","- C18 H14 Cl2 -","- C36 H28 Cl4 -","2","0.5","GO2085","Li, Zhiying","(<i>E</i>,<i>E</i>,<i>E</i>)-1,6-Bis(4-chlorophenyl)hexa-1,3,5-triene","Acta Crystallographica Section E","2013","69","5","o699","","10.1107/S160053681300932X","","","0.7107","MoKα","","0.0533","0.0394","","","0.0905","0.1046","","","","","","1.059","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237843","10.015","0.005","4.647","0.003","10.904","0.005","90","","109.755","0.007","90","","477.6","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","[(2<i>S</i>,3a<i>R</i>,6a<i>R</i>)-5-Oxohexahydrofuro[3,2-<i>b</i>]furan-2-yl]methyl acetate","","- C9 H12 O5 -","- C9 H12 O5 -","- C18 H24 O10 -","2","1","GO2086","González, María; Martínez, Andrea; Rivadulla, Marcos L.; Matos, Maria J.","[(2<i>S</i>,3a<i>R</i>,6a<i>R</i>)-5-Oxohexahydrofuro[3,2-<i>b</i>]furan-2-yl]methyl acetate","Acta Crystallographica Section E","2013","69","5","o772","","10.1107/S1600536813010313","","","0.71073","MoKα","","0.0535","0.0436","","","0.0924","0.0967","","","","","","1.067","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237844","5.2892","0.0008","10.7213","0.0016","19.559","0.003","90","","90","","90","","1109.1","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1<i>S</i>,2<i>S</i>,5<i>S</i>)-2-Methyl-3-oxo-5-(prop-1-en-2-yl)cyclohexane-1-carbonitrile","","- C11 H15 N O -","- C11 H15 N O -","- C44 H60 N4 O4 -","4","1","GO2087","Rivadulla, Marcos L.; Fall, Alioune; González, María; Matos, Maria J.","(1<i>S</i>,2<i>S</i>,5<i>S</i>)-2-Methyl-3-oxo-5-(prop-1-en-2-yl)cyclohexane-1-carbonitrile","Acta Crystallographica Section E","2013","69","5","o799","","10.1107/S1600536813011197","","","0.71073","MoKα","","0.065","0.0523","","","0.1485","0.1641","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237845","8.4669","0.0002","15.0636","0.0003","21.4516","0.0004","90","","90","","90","","2735.98","0.1","173","2","173.15","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","3,4,5-Trimethoxy-4'-methylbiphenyl","","- C16 H18 O3 -","- C16 H18 O3 -","- C128 H144 O24 -","8","1","GO2088","Lahtinen, Manu; Nättinen, Kalle; Nummelin, Sami","3,4,5-Trimethoxy-4'-methylbiphenyl","Acta Crystallographica Section E","2013","69","5","o810","o811","10.1107/S1600536813010969","","","0.71069","MoKα","","0.0632","0.0431","","","0.1059","0.1172","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237846","29.993","0.004","7.9105","0.0006","21.458","0.003","90","","119.86","0.016","90","","4415.2","1.2","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-1,3-dimethyl-1<i>H</i>-chromeno[2,3-<i>d</i>]pyrimidine-2,4(3<i>H</i>,5<i>H</i>)-dione 3.5-hydrate","","- C19 H26 N5 O8.5 -","- C19 H26 N5 O8.5 -","- C152 H208 N40 O68 -","8","1","GO2089","Roy, Subhadip; Das, Subrata","5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-1,3-dimethyl-1<i>H</i>-chromeno[2,3-<i>d</i>]pyrimidine-2,4(3<i>H</i>,5<i>H</i>)-dione 3.5-hydrate","Acta Crystallographica Section E","2013","69","6","o974","o975","10.1107/S1600536813013986","","","0.71073","MoKα","","0.1123","0.0603","","","0.1094","0.1368","","","","","","0.977","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237847","9.1934","0.0002","9.8641","0.0003","10.0778","0.0003","94.033","0.002","114.207","0.002","102.512","0.002","800.64","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Benzoyl-4-chlorophenyl benzoate","","- C20 H13 Cl O3 -","- C20 H13 Cl O3 -","- C40 H26 Cl2 O6 -","2","1","GO2090","Begum A, Bushra; Al-Ghorbani, Mohammed; Sharma, Suresh; Gupta, Vivek K.; Khanum, Shaukath Ara","2-Benzoyl-4-chlorophenyl benzoate","Acta Crystallographica Section E","2013","69","6","o999","o1000","10.1107/S1600536813014396","","","0.71073","MoKα","","0.0443","0.035","","","0.0783","0.0841","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237848","8.328","0.005","16.407","0.005","14.759","0.005","90","","99.509","0.005","90","","1988.9","1.5","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-{[5-(4-Chlorophenyl)-3-methyl-1<i>H</i>-pyrazol-1-yl]methyl}-4-<i>m</i>-tolyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","","- C20 H18 Cl N5 S -","- C20 H18 Cl N5 S -","- C80 H72 Cl4 N20 S4 -","4","1","GW2132","Farrukh, Muhammad A.; Ahmed, Maqsood; Mohamed, Shaaban K.; Marzouk, Adel A.; El-Moghazy, Samir M.","3-{[5-(4-Chlorophenyl)-3-methyl-1<i>H</i>-pyrazol-1-yl]methyl}-4-<i>m</i>-tolyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2013","69","6","o936","o937","10.1107/S1600536813013494","","","0.71073","MoKα","","0.0496","0.0383","","","0.099","0.1124","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237849","6.9388","0.0012","10.1962","0.0018","17.002","0.003","82.45","0.003","78.615","0.003","80.064","0.003","1155.6","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Bis(pyridine-4-carboxaldehyde) fumaric acid","Pyridine-4-carbaldehyde‒fumaric acid (2/1)","","- C16 H14 N2 O6 -","- C16 H14 N2 O6 -","- C48 H42 N6 O18 -","3","1.5","GW2133","Sandhu, Bhupinder; Draguta, Sergiu; Fonari, Marina S.; Antipin, Mikhail; Timofeeva, Tatiana V.","Pyridine-4-carbaldehyde‒fumaric acid (2/1)","Acta Crystallographica Section E","2013","69","6","o940","","10.1107/S1600536813013445","","","0.71073","MoKα","","0.0393","0.0333","","","0.0909","0.094","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237850","9.038","0.004","14.237","0.005","10.405","0.004","90","","107.456","0.005","90","","1277.2","0.9","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","<i>N</i>-(2-Methoxyphenyl)phthalamic acid","2-[(2-Methoxyphenyl)carbamoyl]benzoic acid","","- C15 H13 N O4 -","- C15 H13 N O4 -","- C60 H52 N4 O16 -","4","1","GW2134","Waddell, Paul G.; Rutledge, Rupert J.; Cole, Jacqueline M.","<i>N</i>-(2-Methoxyphenyl)phthalamic acid","Acta Crystallographica Section E","2013","69","6","o930","","10.1107/S1600536813013408","","","0.71073","MoKα","","0.0479","0.0435","","","","0.1112","","","","","","1.09","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237851","8.7017","0.0015","10.2205","0.0016","10.3082","0.0015","117.624","0.002","92.371","0.002","113.744","0.002","713.5","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","2,4-Bis(dimethylamino)-1,3,5-trimethyl-6-(nitrooxy)borazine","","- C7 H21 B3 N6 O3 -","- C7 H21 B3 N6 O3 -","- C14 H42 B6 N12 O6 -","2","1","HB7055","Rodriguez, Mark A.; Borek, Theodore T.","2,4-Bis(dimethylamino)-1,3,5-trimethyl-6-(nitrooxy)borazine","Acta Crystallographica Section E","2013","69","5","o634","","10.1107/S1600536813007484","","","0.71073","MoKα","","0.071","0.0461","","","0.1084","0.1235","","","","","","1.028","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237852","7.9564","0.0001","24.117","0.0004","8.466","0.0001","90","","105.38","0.001","90","","1566.32","0.04","100","1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[5-(2<i>H</i>-1,3-Benzodioxol-5-yl)-3-(4-methylphenyl)-2-pyrazolin-1-yl]ethanone","","- C19 H18 N2 O3 -","- C19 H18 N2 O3 -","- C76 H72 N8 O12 -","4","1","HB7056","Loh, Wan-Sin; Razak, Ibrahim Abdul; Abdul Rahiman, M.; Ravikumar, G. N.","1-[5-(2<i>H</i>-1,3-Benzodioxol-5-yl)-3-(4-methylphenyl)-2-pyrazolin-1-yl]ethanone","Acta Crystallographica Section E","2013","69","5","o726","","10.1107/S1600536813008817","","","0.71073","MoKα","","0.0839","0.0622","","","0.1247","0.1356","","","","","","1.092","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237853","18.88","0.002","5.8979","0.001","20.916","0.002","90","","90","","90","","2329","0.5","298","2","298","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","<i>catena</i>-Poly[[manganese(III)-bis{μ-2-[(2-hydroxyethyl)iminomethyl]-6-methoxyphenolato-κ^3^<i>O</i>^1^,<i>N</i>:<i>O</i>^2^;κ^3^<i>O</i>^2^:<i>N</i>,<i>O</i>^1^}] iodide]","","- C20 H24 I Mn N2 O6 -","- C20 H24 I Mn N2 O6 -","- C80 H96 I4 Mn4 N8 O24 -","4","1","HB7060","Petrusenko, Svitlana R.; Stetsyuk, Oleg M.; Omelchenko, Irina V.","<i>catena</i>-Poly[[manganese(III)-bis{μ-2-[(2-hydroxyethyl)iminomethyl]-6-methoxyphenolato-κ^3^<i>O</i>^1^,<i>N</i>:<i>O</i>^2^;κ^3^<i>O</i>^2^:<i>N</i>,<i>O</i>^1^}] iodide]","Acta Crystallographica Section E","2013","69","6","m326","m327","10.1107/S1600536813012695","","","0.71073","MoKα","","0.1895","0.0756","","","0.1373","0.1731","","","","","","0.922","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237854","6.289","0.0005","10.8874","0.0008","11.9691","0.0009","101.144","0.007","92.634","0.006","91.634","0.006","802.65","0.11","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","(2<i>E</i>)-3-(4-Fluorophenyl)-1-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]prop-2-en-1-one","","- C19 H16 F N3 O -","- C19 H16 F N3 O -","- C38 H32 F2 N6 O2 -","2","1","HB7061","Abdel-Wahab, Bakr F.; Mohamed, Hanan A.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-3-(4-Fluorophenyl)-1-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]prop-2-en-1-one","Acta Crystallographica Section E","2013","69","5","o638","","10.1107/S1600536813008246","","","0.71073","MoKα","","0.09","0.053","","","0.111","0.1387","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237855","12.9514","0.0016","13.1","0.0013","13.3735","0.0014","77.666","0.009","74.123","0.01","81.044","0.009","2120.6","0.4","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","(2<i>E</i>)-1-[5-Methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]-3-[4-(piperidin-1-yl)phenyl]prop-2-en-1-one","","- C24 H26 N4 O -","- C24 H26 N4 O -","- C96 H104 N16 O4 -","4","2","HB7062","Abdel-Wahab, Bakr F.; Abdel-Latif, Ehab; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-1-[5-Methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]-3-[4-(piperidin-1-yl)phenyl]prop-2-en-1-one","Acta Crystallographica Section E","2013","69","5","o639","o640","10.1107/S1600536813008258","","","0.71073","MoKα","","0.0966","0.0576","","","0.1433","0.1743","","","","","","1.028","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237856","26.1721","0.0017","5.7253","0.0003","23.7008","0.0018","90","","97.802","0.006","90","","3518.5","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-[(4-Phenylpiperazin-1-yl)methyl]-5-(thiophen-2-yl)-2,3-dihydro-1,3,4-oxadiazole-2-thione","","- C17 H18 N4 O S2 -","- C17 H18 N4 O S2 -","- C136 H144 N32 O8 S16 -","8","1","HB7064","El-Emam, Ali A.; Al-Omar, Mohamed A.; Al-Obaid, Abdul-Rahman M.; Ng, Seik Weng; Tiekink, Edward R. T.","3-[(4-Phenylpiperazin-1-yl)methyl]-5-(thiophen-2-yl)-2,3-dihydro-1,3,4-oxadiazole-2-thione","Acta Crystallographica Section E","2013","69","5","o684","","10.1107/S1600536813009252","","","0.71073","MoKα","","0.0717","0.0465","","","0.1053","0.1231","","","","","","1.062","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237857","17.0824","0.0011","7.8212","0.0006","19.6691","0.0014","90","","92.249","0.006","90","","2625.9","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(Adamantan-1-yl)-4-[(<i>E</i>)-(2,6-difluorobenzylidene)amino]-1-[(4-ethylpiperazin-1-yl)methyl]-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione","","- C26 H34 F2 N6 S -","- C26 H34 F2 N6 S -","- C104 H136 F8 N24 S4 -","4","1","HB7065","Al-Tamimi, Abdul-Malek S.; Al-Abdullah, Ebtehal S.; El-Emam, Ali A.; Ng, Seik Weng; Tiekink, Edward R. T.","3-(Adamantan-1-yl)-4-[(<i>E</i>)-(2,6-difluorobenzylidene)amino]-1-[(4-ethylpiperazin-1-yl)methyl]-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione","Acta Crystallographica Section E","2013","69","5","o685","o686","10.1107/S1600536813009264","","","0.71073","MoKα","","0.0898","0.0526","","","0.1144","0.1384","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237858","7.4842","0.0006","7.542","0.0006","8.4262","0.0007","79.985","0.002","84.329","0.002","64.508","0.001","422.62","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[silver(I)-bis[μ-4-methyl-1<i>H</i>-1,2,4-triazole-3(4<i>H</i>)-thione-κ^2^<i>S</i>:<i>S</i>]-silver(I)-di-μ-thiocyanato-κ^2^<i>S</i>:<i>N</i>;κ^2^<i>N</i>:<i>S</i>]","","- C8 H10 Ag2 N8 S4 -","- C8 H10 Ag2 N8 S4 -","- C8 H10 Ag2 N8 S4 -","1","0.5","HB7066","Kodcharat, Kultida; Pakawatchai, Chaveng; Saithong, Saowanit","<i>catena</i>-Poly[silver(I)-bis[μ-4-methyl-1<i>H</i>-1,2,4-triazole-3(4<i>H</i>)-thione-κ^2^<i>S</i>:<i>S</i>]-silver(I)-di-μ-thiocyanato-κ^2^<i>S</i>:<i>N</i>;κ^2^<i>N</i>:<i>S</i>]","Acta Crystallographica Section E","2013","69","5","m265","m266","10.1107/S160053681300946X","","","0.71073","MoKα","","0.0322","0.029","","","0.068","0.0695","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237859","9.0884","0.0006","6.4559","0.0005","39.827","0.003","90","","95.404","0.003","90","","2326.4","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","4-[2-(4-Butoxyphenyl)ethenyl]-1-methylpyridinium tosylate","4-[2-(4-Butoxyphenyl)ethenyl]-1-methylpyridinium 4-methylbenzenesulfonate","","- C25 H29 N O4 S -","- C25 H29 N O4 S -","- C100 H116 N4 O16 S4 -","4","1","HB7067","Kumar, M. Krishna; Margret, S. Mabel; Chakkaravarthi, G.; Velmurugan, D.; Kumar, R. Mohan","4-[2-(4-Butoxyphenyl)ethenyl]-1-methylpyridinium tosylate","Acta Crystallographica Section E","2013","69","5","o709","","10.1107/S1600536813009616","","","0.71073","MoKα","","0.0885","0.0689","","","0.1521","0.1596","","","","","","1.157","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237860","14.1326","0.0013","7.1179","0.0005","18.3685","0.0016","90","","105.546","0.01","90","","1780.2","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-(Adamantan-1-yl)-3-anilinomethyl-2,3-dihydro-1,3,4-oxadiazole-2-thione","","- C19 H23 N3 O S -","- C19 H23 N3 O S -","- C76 H92 N12 O4 S4 -","4","1","HB7068","Al-Tamimi, Abdul-Malek S.; Al-Deeb, Omar A.; El-Emam, Ali A.; Ng, Seik Weng; Tiekink, Edward R. T.","5-(Adamantan-1-yl)-3-anilinomethyl-2,3-dihydro-1,3,4-oxadiazole-2-thione","Acta Crystallographica Section E","2013","69","5","o729","","10.1107/S1600536813009835","","","0.71073","MoKα","","0.0749","0.0472","","","0.1106","0.1306","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237861","7.1683","0.0008","10.6621","0.0011","23.592","0.003","90","","90","","90","","1803.1","0.4","295","2","295","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","5-(Adamantan-1-yl)-3-[(4-fluoroanilino)methyl]-2,3-dihydro-1,3,4-oxadiazole-2-thione","","- C19 H22 F N3 O S -","- C19 H22 F N3 O S -","- C76 H88 F4 N12 O4 S4 -","4","1","HB7069","Al-Tamimi, Abdul-Malek S.; Alafeefy, Ahmed M.; El-Emam, Ali A.; Ng, Seik Weng; Tiekink, Edward R. T.","5-(Adamantan-1-yl)-3-[(4-fluoroanilino)methyl]-2,3-dihydro-1,3,4-oxadiazole-2-thione","Acta Crystallographica Section E","2013","69","5","o730","","10.1107/S1600536813009823","","","0.71073","MoKα","","0.1182","0.0625","","","0.1283","0.1583","","","","","","0.983","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237862","7.6084","0.0002","25.5788","0.0004","7.6524","0.0002","90","","111.974","0.003","90","","1381.07","0.06","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Acetyl-3-(5-phenyl-1<i>H</i>-pyrazol-3-yl)-1,3,4-thiadiazol-2(3<i>H</i>)-one monohydrate","","- C13 H12 N4 O3 S -","- C13 H12 N4 O3 S -","- C52 H48 N16 O12 S4 -","4","1","HB7073","Asiri, Abdullah M.; Arshad, Muhammad Nadeem; Obaid, Abdullah Y.; Mustafa, Ghulam","5-Acetyl-3-(5-phenyl-1<i>H</i>-pyrazol-3-yl)-1,3,4-thiadiazol-2(3<i>H</i>)-one monohydrate","Acta Crystallographica Section E","2013","69","5","o798","","10.1107/S1600536813010817","","","1.54184","CuKα","","0.0409","0.0363","","","0.0997","0.1057","","","","","","1.066","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237863","9.6003","0.0005","11.6568","0.0006","18.1993","0.0009","90","","98.066","0.003","90","","2016.51","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","<i>N</i>,<i>N</i>-Diethyl-2-hydroxyethanaminium 5-(2,4-dinitrophenyl)barbiturate sesquihydrate","<i>N</i>,<i>N</i>-Diethyl-2-hydroxyethanaminium 5-(2,4-dinitrophenyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate sesquihydrate","","- C16 H24 N5 O9.5 -","- C16 H23 N5 O9.5 -","- C64 H92 N20 O38 -","4","1","HB7074","Mangaiyarkarasi, Govindan; Kalaivani, Doraisamyraja","<i>N</i>,<i>N</i>-Diethyl-2-hydroxyethanaminium 5-(2,4-dinitrophenyl)barbiturate sesquihydrate","Acta Crystallographica Section E","2013","69","6","o863","o864","10.1107/S1600536813012257","","","0.71073","MoKα","","0.0685","0.0433","","","0.1079","0.1309","","","","","","1.092","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2237864","8.2548","0.0011","8.4781","0.0009","13.6714","0.0018","90","","99.064","0.006","90","","944.8","0.2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Hydroxy-1,2,6-trimethylpyridinium chloride monohydrate","","- C8 H14 Cl N O2 -","- C8 H14 Cl N O2 -","- C32 H56 Cl4 N4 O8 -","4","1","HB7075","Seethalakshmi, T.; Manivannan, S.; Dhanuskodi, S.; Lynch, Daniel E.; Thamotharan, S.","4-Hydroxy-1,2,6-trimethylpyridinium chloride monohydrate","Acta Crystallographica Section E","2013","69","6","o835","o836","10.1107/S1600536813011616","","","0.71073","MoKα","","0.0883","0.0606","","","0.1521","0.1742","","","","","","1.015","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237865","8.195","0.003","7.289","0.003","6.721","0.003","90","","90","","90","","401.5","0.3","100","2","100","2","","","","","","","","4","P m n 21","P 2ac -2","31","","4-Cyano-1-methylpyridinium nitrate","","- C7 H7 N3 O3 -","- C7 H7 N3 O3 -","- C14 H14 N6 O6 -","2","0.5","HB7076","McCormick, Cameron A.; Nguyen, Vu D.; Renfro, Heather E.; Koplitz, Lynn V.; Mague, Joel T.","4-Cyano-1-methylpyridinium nitrate","Acta Crystallographica Section E","2013","69","6","o981","o982","10.1107/S1600536813014025","","","0.71073","MoKα","","0.039","0.0384","","","0.0912","0.0918","","","","","","1.09","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237866","17.44","0.0009","8.4734","0.0004","15.6069","0.0009","90","","119.626","0.002","90","","2004.82","0.19","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","(<i>O</i>-Methyl dithiocarbonato-κ<i>S</i>)triphenyltin(IV)","","- C20 H18 O S2 Sn -","- C20 H18 O S2 Sn -","- C80 H72 O4 S8 Sn4 -","4","1","HB7077","Javed, Fatima; Ali, Saqib; Shah, Wajid; Tahir, M. Nawaz; Ullah, Hameed","(<i>O</i>-Methyl dithiocarbonato-κ<i>S</i>)triphenyltin(IV)","Acta Crystallographica Section E","2013","69","6","m316","","10.1107/S1600536813012300","","","0.71073","MoKα","","0.0237","0.0223","","","0.0541","0.055","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237867","8.159","0.0008","17.047","0.003","20.3974","0.0014","90","","90","","90","","2837","0.6","90","2","90","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Tris(ethylenediamine) cobalt II chloride","Tris(ethylenediamine)cobalt(II) dichloride'","","- C6 H24 Cl2 Co N6 -","- C6 H24 Cl2 Co N6 -","- C48 H192 Cl16 Co8 N48 -","8","1","HB7079","Cooke, Kristin; Olenev, Andrei V.; Kovnir, Kirill","Tris(ethylenediamine)cobalt(II) dichloride","Acta Crystallographica Section E","2013","69","6","m332","","10.1107/S1600536813013135","","","1.54178","CuKα","","0.0288","0.0243","","","0.0574","0.0594","","","","","","1.062","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237868","8.0091","0.0001","11.7289","0.0002","11.8923","0.0002","79.008","0.001","80.628","0.001","83.936","0.001","1078.79","0.03","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-[(2,6-Diethylphenyl)carbamothioyl]-2,2-diphenylacetamide","","- C25 H26 N2 O S -","- C25 H26 N2 O S -","- C50 H52 N4 O2 S2 -","2","1","HB7080","Yusof, Mohd Sukeri Mohd; Razali, Nur Rafikah; Arshad, Suhana; Rahman, Azhar Abdul; Razak, Ibrahim Abdul","<i>N</i>-[(2,6-Diethylphenyl)carbamothioyl]-2,2-diphenylacetamide","Acta Crystallographica Section E","2013","69","6","o967","","10.1107/S1600536813013354","","","0.71073","MoKα","","0.0512","0.0384","","","0.0781","0.0871","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237869","7.232","0.0014","7.447","0.0015","16.78","0.003","99.78","0.03","93.35","0.03","98.58","0.03","877.4","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-Diphenylphosphanyl-8-methyl-1,5-naphthyridine","","- C21 H17 N2 P -","- C21 H17 N2 P -","- C42 H34 N4 P2 -","2","1","HB7082","Chen, Chen; Wang, Kun-Yan; Liu, Jin-Fang; Wang, Dan-Feng; Zhu, Hong-Jun","4-Diphenylphosphanyl-8-methyl-1,5-naphthyridine","Acta Crystallographica Section E","2013","69","6","o928","","10.1107/S1600536813013196","","","0.71073","MoKα","","0.0803","0.0502","","","0.1327","0.1545","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237870","23.294","0.0013","11.2517","0.0007","19.7702","0.001","90","","112.659","0.003","90","","4781.8","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","6a-Nitro-6-phenyl-6,6a,6b,7,8,9,10,12a-octahydrospiro[chromeno[3,4-<i>a</i>]indolizine-12,3'-indolin]-2'-one","","- C28 H25 N3 O4 -","- C28 H25 N3 O4 -","- C224 H200 N24 O32 -","8","1","HB7084","Devi, Seenivasan Karthiga; Srinivasan, Thothadri; Rao, Jonnalagadda Naga Siva; Raghunathan, Raghavachary; Velmurugan, Devadasan","6a-Nitro-6-phenyl-6,6a,6b,7,8,9,10,12a-octahydrospiro[chromeno[3,4-<i>a</i>]indolizine-12,3'-indolin]-2'-one","Acta Crystallographica Section E","2013","69","6","o993","","10.1107/S1600536813014062","","","0.71073","MoKα","","0.0751","0.0456","","","0.1069","0.1273","","","","","","1.004","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237871","14.7659","0.0004","7.6507","0.0003","18.2922","0.0005","90","","97.153","0.002","90","","2050.38","0.11","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-{4'-[(5-Benzyl-2<i>H</i>-tetrazol-2-yl)methyl]biphenyl-2-yl}-1<i>H</i>-tetrazole monohydrate","","- C22 H20 N8 O -","- C22 H20 N8 O -","- C88 H80 N32 O4 -","4","1","HG5301","Meti, Gangadhar Y.; Jeyaseelan, S.; Kamble, R. R.; Dorababu, Atakuri; Devarajegowda, H. C.","5-{4'-[(5-Benzyl-2<i>H</i>-tetrazol-2-yl)methyl]biphenyl-2-yl}-1<i>H</i>-tetrazole monohydrate","Acta Crystallographica Section E","2013","69","5","o743","o744","10.1107/S1600536813009963","","","0.71073","MoKα","","0.0546","0.0477","","0.1068","0.1048","0.1065","","","","","","1.0006","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237872","5.3262","0.0002","10.5083","0.0004","10.8096","0.0004","83.9","0.003","86.301","0.003","87.279","0.004","599.82","0.04","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","2-(2,4-Dichlorophenyl)-<i>N</i>-(1,3-thiazol-2-yl)acetamide","","- C11 H8 Cl2 N2 O S -","- C11 H8 Cl2 N2 O S -","- C22 H16 Cl4 N4 O2 S2 -","2","1","HG5302","Nayak, Prakash S.; Narayana, B.; Yathirajan, H. S.; Jasinski, Jerry P.; Butcher, Ray J.","2-(2,4-Dichlorophenyl)-<i>N</i>-(1,3-thiazol-2-yl)acetamide","Acta Crystallographica Section E","2013","69","5","o656","o657","10.1107/S1600536813008532","","","0.71073","MoKα","","0.0736","0.0461","","","0.0953","0.1118","","","","","","1.069","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237873","14.0476","0.0008","17.1365","0.0009","13.823","0.0008","90","","115.893","0.001","90","","2993.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-(4-chlorobenzoyl)-1-(4-chlorobenzyl)-4-(4-chlorophenyl)-2,2-dioxo-3,4,6,7,8,8a-hexahydro-1<i>H</i>-pyrrolo[2,1-<i>c</i>][1,4]thiazine-1-carboxylate","","- C30 H28 Cl3 N O5 S -","- C30 H28 Cl3 N O5 S -","- C120 H112 Cl12 N4 O20 S4 -","4","1","HG5304","Chitradevi, A.; Athimoolam, S.; Bahadur, S. Asath; Indumathi, S.; Perumal, S.","Ethyl 3-(4-chlorobenzoyl)-1-(4-chlorobenzyl)-4-(4-chlorophenyl)-2,2-dioxo-3,4,6,7,8,8a-hexahydro-1<i>H</i>-pyrrolo[2,1-<i>c</i>][1,4]thiazine-1-carboxylate","Acta Crystallographica Section E","2013","69","5","o706","o707","10.1107/S1600536813009148","","","0.71073","MoKα","","0.054","0.0482","","","0.1377","0.1443","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237874","10.4394","0.0012","13.091","0.0013","10.8871","0.0015","90","","118.008","0.016","90","","1313.6","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-(Adamantan-1-yl)-<i>N</i>-methyl-1,3,4-thiadiazol-2-amine","","- C13 H19 N3 S -","- C13 H19 N3 S -","- C52 H76 N12 S4 -","4","1","HG5305","Al-Tamimi, Abdul-Malek S.; Alafeefy, Ahmed M.; El-Emam, Ali A.; Ng, Seik Weng; Tiekink, Edward R. T.","5-(Adamantan-1-yl)-<i>N</i>-methyl-1,3,4-thiadiazol-2-amine","Acta Crystallographica Section E","2013","69","5","o683","","10.1107/S1600536813009033","","","0.71073","MoKα","","0.0905","0.0539","","","0.1176","0.144","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237875","13.576","0.003","16.964","0.003","11.025","0.002","90","","120.11","0.03","90","","2196.5","1","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","4-Hydroxy-<i>N</i>-methylbenzamide","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C96 H108 N12 O24 -","12","3","HG5306","Jasinski, Jerry P.; St. John, Joel P.; Butcher, Ray J.; Narayana, B.; Yathirajan, H. S.; Sarojini, B. K.","4-Hydroxy-<i>N</i>-methylbenzamide","Acta Crystallographica Section E","2013","69","5","o738","","10.1107/S1600536813009781","","","0.71073","MoKα","","0.0623","0.0592","","","0.1863","0.1923","","","","","","1.103","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237876","28.81","0.0015","6.6052","0.0004","25.7717","0.0014","90","","90","","90","","4904.2","0.5","295","2","295","2","","","","","","","","5","P n a 21","P 2c -2n","33","","3-(Adamantan-1-yl)-4-methyl-1-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione","","- C25 H32 F3 N5 S -","- C25 H32 F3 N5 S -","- C200 H256 F24 N40 S8 -","8","2","HG5307","El-Emam, Ali A.; Al-Tamimi, Abdul-Malek S.; Alrashood, Khalid A.; Ng, Seik Weng; Tiekink, Edward R. T.","3-(Adamantan-1-yl)-4-methyl-1-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione","Acta Crystallographica Section E","2013","69","5","o695","o696","10.1107/S1600536813009495","","","0.71073","MoKα","","0.0839","0.0577","","","0.1321","0.1513","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237877","13.422","0.002","6.167","0.0007","16.596","0.002","90","","111.972","0.015","90","","1273.9","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Benzyl-3-(thiophen-2-yl)-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione","","- C13 H11 N3 S2 -","- C13 H11 N3 S2 -","- C52 H44 N12 S8 -","4","1","HG5308","Al-Shehri, Mona M.; El-Emam, Ali A.; El-Brollosy, Nasser R.; Ng, Seik Weng; Tiekink, Edward R. T.","4-Benzyl-3-(thiophen-2-yl)-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione","Acta Crystallographica Section E","2013","69","5","o697","","10.1107/S1600536813009501","","","0.71073","MoKα","","0.072","0.0446","","","0.0944","0.1086","","","","","","1.023","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237878","6.5308","0.0002","8.2253","0.0002","25.686","0.0008","90","","103.191","0.0009","90","","1343.39","0.07","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Formyl-2-nitrophenyl 4-bromobenzoate","","- C14 H8 Br N O5 -","- C14 H8 Br N O5 -","- C56 H32 Br4 N4 O20 -","4","1","HG5309","Moreno-Fuquen, Rodolfo; Hernandez, Geraldine; Ellena, Javier; De Simone, Carlos A.; Tenorio, Juan C.","4-Formyl-2-nitrophenyl 4-bromobenzoate","Acta Crystallographica Section E","2013","69","5","o793","","10.1107/S1600536813010830","","","0.71073","MoKα","","0.055","0.0408","","","0.1037","0.1133","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237879","9.0164","0.0003","18.6017","0.0005","9.8574","0.0003","90","","111.653","0.003","90","","1536.62","0.09","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Chloro-6-(2,3-dichlorobenzenesulfonamido)benzoic acid","","- C13 H8 Cl3 N O4 S -","- C13 H8 Cl3 N O4 S -","- C52 H32 Cl12 N4 O16 S4 -","4","1","HG5312","Munir, Ayesha; Mubashar-ur-Rehman, Hafiz; Asiri, Abdullah M.; Khan, Islam Ullah; Arshad, Muhammad Nadeem","2-Chloro-6-(2,3-dichlorobenzenesulfonamido)benzoic acid","Acta Crystallographica Section E","2013","69","6","o832","","10.1107/S1600536813011574","","","1.54184","CuKα","","0.0456","0.0382","","","0.0973","0.1035","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237880","4.9136","0.0003","6.0218","0.0004","42.514","0.002","90","","90","","90","","1257.93","0.13","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2-(4-Bromophenyl)-<i>N</i>-(3,4-difluorophenyl)acetamide","","- C14 H10 Br F2 N O -","- C14 H10 Br F2 N O -","- C56 H40 Br4 F8 N4 O4 -","4","1","HG5313","Praveen, A.S.; Yathirajan, H. S.; Jasinski, Jerry P.; Keeley, Amanda C.; Narayana, B.; Sarojini, B. K.","2-(4-Bromophenyl)-<i>N</i>-(3,4-difluorophenyl)acetamide","Acta Crystallographica Section E","2013","69","6","o900","o901","10.1107/S1600536813012865","","","1.54184","CuKα","","0.0416","0.0408","","","0.1052","0.1056","","","","","","1.154","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237881","11.0633","0.0004","9.656","0.0004","14.0251","0.0006","90","","94.009","0.002","90","","1494.6","0.1","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,4,6-trinitrophenyl 3-chlorobenzoate","2,4,6-Trinitrophenyl 3-chlorobenzoate","","- C13 H6 Cl N3 O8 -","- C13 H6 Cl N3 O8 -","- C52 H24 Cl4 N12 O32 -","4","1","HG5316","Moreno-Fuquen, Rodolfo; Mosquera, Fabricio; Ellena, Javier; De Simone, C. A.; Tenorio, Juan C.","2,4,6-Trinitrophenyl 3-chlorobenzoate","Acta Crystallographica Section E","2013","69","6","o966","","10.1107/S1600536813013792","","","0.71073","MoKα","","0.096","0.0511","","","0.1337","0.1616","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237882","10.2655","0.0003","11.3341","0.0004","18.8111","0.0006","90","","90.874","0.003","90","","2188.42","0.12","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Rupatidine","8-Chloro-11-{1-[(5-methylpyridin-3-yl)methyl]piperidin-4-ylidene}-6,11-dihydro-5<i>H</i>-benzo[5,6]cyclohepta[1,2-<i>b</i>]pyridine","","- C26 H26 Cl N3 -","- C26 H26 Cl N3 -","- C104 H104 Cl4 N12 -","4","1","HG5317","Kaur, Manpreet; Jasinski, Jerry P.; Luopa, Zane A.; Kumar, Neeraj; Patel, Nilesh G.; Gudaparthi, Omprakash; Yathirajan, H. S.","Rupatadine","Acta Crystallographica Section E","2013","69","6","o980","","10.1107/S1600536813014256","","","1.5418","CuKα","","0.0498","0.0412","","","0.114","0.1218","","","","","","1.054","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237883","8.491","0.0017","9.141","0.0018","9.258","0.0019","91.55","0.03","96.03","0.03","110.68","0.03","667","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(2,2',2''-nitrilotriacetamide-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')cobalt(II) dinitrate tetrahydrate","","- C12 H32 Co N10 O16 -","- C12 H32 Co N10 O16 -","- C12 H32 Co N10 O16 -","1","0.5","HY2611","Ran, Jing-Wen; Pei, Jun","Bis(2,2',2''-nitrilotriacetamide-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')cobalt(II) dinitrate tetrahydrate","Acta Crystallographica Section E","2013","69","6","m325","","10.1107/S1600536813012968","","","0.71073","MoKα","","0.0297","0.0282","","","0.0782","0.0798","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237884","16.993","0.005","16.218","0.005","7.754","0.002","90","","113.427","0.003","90","","1960.8","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(3,3'-{(1<i>E</i>,1'<i>E</i>)-1,1'-[Ethane-1,2-diylbis(azan-1-yl-1-ylidene-κ<i>N</i>)]bis(ethan-1-yl-1-ylidene)}dipyrazine 1-oxide-κ<i>N</i>^4^)bis(nitrato-κ<i>O</i>)nickel(II) monohydrate","","- C14 H18 N8 Ni O9 -","- C14 H18 N8 Ni O9 -","- C56 H72 N32 Ni4 O36 -","4","0.5","HY2621","Omer, Mohammed A. S.; Liu, Jia-Cheng","(3,3'-{(1<i>E</i>,1'<i>E</i>)-1,1'-[Ethane-1,2-diylbis(azan-1-yl-1-ylidene-κ<i>N</i>)]bis(ethan-1-yl-1-ylidene)}dipyrazine 1-oxide-κ<i>N</i>^4^)bis(nitrato-κ<i>O</i>)nickel(II) monohydrate","Acta Crystallographica Section E","2013","69","5","m263","m264","10.1107/S1600536813009355","","","0.71073","MoKα","","0.0448","0.0324","","","0.0658","0.0701","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237885","8.1766","0.0002","11.9362","0.0003","12.7519","0.0003","102.982","0.001","97.799","0.001","97.684","0.001","1184.02","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Pyridinium bis(pyridine-κ<i>N</i>)tetrakis(thiocyanato-κ<i>N</i>)ferrate(III)‒pyrazine-2-carbonitrile‒pyridine (1/4/1)","","- C44 H33 Fe N20 S4 -","- C44 H33 Fe N20 S4 -","- C44 H33 Fe N20 S4 -","1","0.5","HY2622","Shylin, Sergii I.; Gural'skiy, Il'ya A.; Haukka, Matti; Golenya, Irina A.","Pyridinium bis(pyridine-κ<i>N</i>)tetrakis(thiocyanato-κ<i>N</i>)ferrate(III)‒pyrazine-2-carbonitrile‒pyridine (1/4/1)","Acta Crystallographica Section E","2013","69","5","m280","","10.1107/S1600536813010362","","","0.71073","MoKα","","0.0435","0.0307","","","0.0712","0.0762","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237886","7.5912","0.0002","8.0973","0.0003","10.6706","0.0003","103.493","0.003","98.589","0.003","92.24","0.003","628.78","0.04","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","Poly[tetraaqua(5-hydroxypyridin-1-ium-3-carboxylato-κ<i>O</i>^3^)tris(μ-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^)dieuropium(III)]","","- C18 H18 Eu2 N2 O22 -","- C18 H18 Eu2 N2 O22 -","- C18 H18 Eu2 N2 O22 -","1","0.5","HY2623","Xu, Shan-Shan; Mi, Jun-Long; Chen, Hong-Ji","Poly[tetraaqua(5-hydroxypyridin-1-ium-3-carboxylato-κ<i>O</i>^3^)tris(μ-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^)dieuropium(III)]","Acta Crystallographica Section E","2013","69","5","m294","m295","10.1107/S1600536813011057","","","0.71073","MoKα","","0.0209","0.0183","","","0.0366","0.0378","","","","","","1.085","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237887","7.7598","0.001","12.3811","0.0015","12.6572","0.0016","77.676","0.002","72.791","0.002","84.122","0.002","1133.8","0.2","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","1,1'-(Ethane-1,2-diyl)dipyridinium bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')cuprate(II)","","- C20 H14 Cu N6 S4 -","- C20 H14 Cu N6 S4 -","- C40 H28 Cu2 N12 S8 -","2","1","HY2624","Hu, Bing-Xiang; Zhou, Chang-Xiao; Liu, Yang-Mei; Chen, Li-Zhuang; Wang, Fang-Ming","1,1'-(Ethane-1,2-diyl)dipyridinium bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')cuprate(II)","Acta Crystallographica Section E","2013","69","6","m312","","10.1107/S1600536813012439","","","0.71073","MoKα","","0.0434","0.0358","","","0.0808","0.0832","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237888","15.1133","0.0013","13.9144","0.0012","13.3121","0.0012","90","","99.275","0.002","90","","2762.8","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tris(acetonitrile-κ<i>N</i>)dichlorido(triphenylphosphane-κ<i>P</i>)ruthenium(II) acetonitrile monosolvate","","- C26 H27 Cl2 N4 P Ru -","- C26 H27 Cl2 N4 P Ru -","- C104 H108 Cl8 N16 P4 Ru4 -","4","1","HY2625","Yin, Xiao-Feng; Qin, Yi; Shi, Hua-Tian; Chen, Qun; Zhang, Qian-Feng","Tris(acetonitrile-κ<i>N</i>)dichlorido(triphenylphosphane-κ<i>P</i>)ruthenium(II) acetonitrile monosolvate","Acta Crystallographica Section E","2013","69","6","m340","","10.1107/S1600536813014128","","","0.71073","MoKα","","0.0343","0.0251","","","0.058","0.0631","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237889","8.9676","0.0008","10.5073","0.0009","19.1085","0.0017","81.281","0.002","88.678","0.002","82.175","0.002","1763.1","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Tris(diisopropyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')ruthenium(III)","","- C18 H42 O6 P3 Ru S6 -","- C18 H42 O6 P3 Ru S6 -","- C36 H84 O12 P6 Ru2 S12 -","2","1","HY2626","Chao, Guo-Ping; Wu, Xiuli; Shi, Hua-Tian; Chen, Qun; Zhang, Qian-Feng","Tris(diisopropyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')ruthenium(III)","Acta Crystallographica Section E","2013","69","6","m341","","10.1107/S1600536813014141","","","0.71073","MoKα","","0.045","0.0318","","","0.0752","0.0828","","","","","","1.022","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237890","8.7791","0.0002","9.7807","0.0002","20.2209","0.0004","90","","96.792","0.002","90","","1724.1","0.06","290","2","290","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-1-[2-Hydroxy-4,6-bis(methoxymethoxy)phenyl]-3-phenylprop-2-en-1-one","","- C19 H20 O6 -","- C19 H20 O6 -","- C76 H80 O24 -","4","1","IM2424","Niu, Chao; Liu, Y. Q.; He, Y. W.; Aisa, H. A.","(<i>E</i>)-1-[2-Hydroxy-4,6-bis(methoxymethoxy)phenyl]-3-phenylprop-2-en-1-one","Acta Crystallographica Section E","2013","69","5","o715","","10.1107/S1600536813009380","","","1.54184","CuKα","","0.0618","0.0552","","","0.1505","0.1606","","","","","","1.019","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2237891","25.005","0.006","5.5023","0.0014","14.79","0.004","90","","90","","90","","2034.9","0.9","291","2","291","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2-(4-Methylphenyl)-3-oxo-4-phenyl-2,3,3a,4,9,9a-hexahydro-1<i>H</i>-benzo[<i>f</i>]isoindole-6-carbonitrile","","- C26 H22 N2 O -","- C26 H22 N2 O -","- C104 H88 N8 O4 -","4","1","IM2425","Wen, Lei; Hu, Yimin","2-(4-Methylphenyl)-3-oxo-4-phenyl-2,3,3a,4,9,9a-hexahydro-1<i>H</i>-benzo[<i>f</i>]isoindole-6-carbonitrile","Acta Crystallographica Section E","2013","69","5","o652","","10.1107/S1600536813008568","","","0.71073","MoKα","","0.1261","0.0519","","","0.0806","0.0952","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237892","17.233","0.003","22.001","0.004","28.26","0.005","90","","92.49","0.02","90","","10704","3","90","2","90","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Tetraphenylphosphonium iodide‒1,3,5-trifluoro-2,4,6-triiodobenzene‒methanol (3/4/1)","","- C97 H64 F12 I15 O P3 -","- C97 H64 F12 I15 O P3 -","- C388 H256 F48 I60 O4 P12 -","4","2","IM2426","Cavallo, Gabriella; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo","Tetraphenylphosphonium iodide‒1,3,5-trifluoro-2,4,6-triiodobenzene‒methanol (3/4/1)","Acta Crystallographica Section E","2013","69","6","o865","o866","10.1107/S1600536813012397","","","0.71073","MoKα","","0.0455","0.0399","","","0.0787","0.0807","","","","","","1.087","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237893","8.299","0.002","11.785","0.003","9.769","0.003","90","","106.204","0.004","90","","917.5","0.4","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[tri-μ-aqua-diaqua-μ-phosphonoformato-cobalt(II)sodium]","","- C H10 Co Na O10 P -","- C H10 Co Na O10 P -","- C4 H40 Co4 Na4 O40 P4 -","4","1","IM2427","Luo, Xu-Jian; Zhang, Xiu-Qing","Poly[tri-μ-aqua-diaqua-μ-phosphonoformato-cobalt(II)sodium]","Acta Crystallographica Section E","2013","69","6","i35","","10.1107/S1600536813012853","","","0.71075","MoKα","","0.0405","0.0352","","","0.0637","0.0661","","","","","","1.092","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237894","6.0602","0.0014","11.61","0.003","13.892","0.004","90","","101.838","0.008","90","","956.6","0.4","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-(Pyridin-4-yl)-1<i>H</i>-benzimidazole","","- C12 H9 N3 -","- C12 H9 N3 -","- C48 H36 N12 -","4","1","IM2430","Geiger, David K.; Bond, Christopher J.","2-(Pyridin-4-yl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2013","69","6","o869","","10.1107/S160053681301252X","","","0.71073","MoKα","","0.0814","0.0462","","","0.1045","0.1283","","","","","","0.959","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237895","12.367","0.007","12.558","0.006","13.626","0.007","89.802","0.017","87.964","0.013","86.312","0.018","2110.5","1.9","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","Tetraphenylphosphonium [μ~3~-(4-methylphenyl)tellurolato]tris[tetracarbonyliron(0)]","","- C43 H27 Fe3 O12 P Te -","- C43 H27 Fe3 O12 P Te -","- C86 H54 Fe6 O24 P2 Te2 -","2","1","IM2431","Li, Yu-Long; Xie, Bin; Zou, Li-Ke","Tetraphenylphosphonium [μ~3~-(4-methylphenyl)tellurolato]tris[tetracarbonyliron(0)]","Acta Crystallographica Section E","2013","69","6","m328","","10.1107/S1600536813013056","","","0.71073","MoKα","","0.0517","0.0379","","","0.0632","0.0676","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237896","16.6972","0.0005","4.5602","0.0001","21.25","0.0005","90","","96.352","0.002","90","","1608.1","0.07","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-Bis(prop-2-yn-1-yl)-1<i>H</i>-anthra[1,2-<i>d</i>]imidazole-2,6,11(3<i>H</i>)-trione","","- C21 H12 N2 O3 -","- C21 H12 N2 O3 -","- C84 H48 N8 O12 -","4","1","IM2432","Afrakssou, Zahra; Haoudi, Amal; Capet, Frédéric; Mazzah, Ahmed; Rolando, Christian; El Ammari, Lahcen","1,3-Bis(prop-2-yn-1-yl)-1<i>H</i>-anthra[1,2-<i>d</i>]imidazole-2,6,11(3<i>H</i>)-trione","Acta Crystallographica Section E","2013","69","6","o944","","10.1107/S1600536813013688","","","0.71073","MoKα","","0.066","0.0439","","","0.1125","0.1289","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237897","8.093","0.0002","12.1191","0.0003","12.2743","0.0002","87.109","0.001","73.612","0.001","72.283","0.001","1099.35","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","1-(Prop-2-en-1-yl)-3-{[3-(pyridin-4-yl)-4,5-dihydroisoxazol-5-yl]methyl}-1<i>H</i>-anthra[1,2-<i>d</i>]imidazole-2,6,11(3<i>H</i>)-trione","","- C27 H20 N4 O4 -","- C27 H20 N4 O4 -","- C54 H40 N8 O8 -","2","1","IM2433","Afrakssou, Zahra; Kandri Rodia, Youssef; Capet, Frédéric; Essassi, El Mokhtar; Rolando, Christian; El Ammari, Lahcen","1-(Prop-2-en-1-yl)-3-{[3-(pyridin-4-yl)-4,5-dihydroisoxazol-5-yl]methyl}-1<i>H</i>-anthra[1,2-<i>d</i>]imidazole-2,6,11(3<i>H</i>)-trione","Acta Crystallographica Section E","2013","69","6","o945","o946","10.1107/S160053681301369X","","","0.71073","MoKα","","0.075","0.0475","","","0.1276","0.148","","","","","","1.024","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237898","7.611","0.0002","10.7375","0.0003","29.499","0.0007","90","","90","","90","","2410.75","0.11","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,3-Dimethoxy-10-oxostrychnidinium hydrogen oxalate dihydrate","","- C25 H32 N2 O10 -","- C25 H32 N2 O10 -","- C100 H128 N8 O40 -","4","1","IS5247","Krishnan, P.; Gayathri, K.; Sivakumar, N.; Chakkaravarthi, G.; Anbalagan, G.","2,3-Dimethoxy-10-oxostrychnidinium hydrogen oxalate dihydrate","Acta Crystallographica Section E","2013","69","5","o659","","10.1107/S1600536813008623","","","0.71073","MoKα","","0.0463","0.0423","","","0.1129","0.1163","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237899","12.0593","0.0007","8.3684","0.0004","12.8611","0.0006","90","","113.021","0.006","90","","1194.54","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Chloro-5-fluoro-6-methyl-<i>N</i>-<i>o</i>-tolylpyrimidin-4-amine","","- C12 H11 Cl F N3 -","- C12 H11 Cl F N3 -","- C48 H44 Cl4 F4 N12 -","4","1","IS5256","Jiang, Yufei; Wu, Kong; Cui, Dongmei; Zhou, Wei","2-Chloro-5-fluoro-6-methyl-<i>N</i>-<i>o</i>-tolylpyrimidin-4-amine","Acta Crystallographica Section E","2013","69","5","o626","","10.1107/S160053681300812X","","","0.71073","MoKα","","0.0439","0.0342","","","0.0899","0.0958","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237900","5.391","0.005","11.742","0.01","19.975","0.016","90","","90","","90","","1264.4","1.9","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-{2-[(2<i>R</i>)-2-Amino-4-methylpentanamido]acetamido}acetic acid","<i>L</i>-Leucylglycylglycine","","- C10 H19 N3 O4 -","- C10 H19 N3 O4 -","- C40 H76 N12 O16 -","4","1","IS5257","Ootaki, Masanori; Nawa, Yukino; Hiroi, Tomoko; Matsui, Hiroaki; Sugawara, Yoko","<small>L</small>-Leucylglycylglycine","Acta Crystallographica Section E","2013","69","5","o660","","10.1107/S1600536813008490","","","0.7107","MoKα","","0.0528","0.0381","","","0.0781","0.0866","","","","","","0.961","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237901","7.7463","0.0001","9.3776","0.0001","10.4449","0.0002","79.689","0.001","87.168","0.001","87.461","0.001","745.085","0.019","100","1","100","0.1","","","","","","","","5","P -1","-P 1","2","3-(<i>p</i>-Tolyl)-sydnone-4-thiosemicarbazone 1,4-dioxane hemisolvate","3-(4-Methylphenyl)-4-[(thiosemicarbazono)methyl]-1,2,3-oxadiazol-3-ium-5-olate 1,4-dioxane hemisolvate","","- C13 H15 N5 O3 S -","- C13 H15 N5 O3 S -","- C26 H30 N10 O6 S2 -","2","1","IS5258","Abdul Rahiman, M.; Ravikumar, G. N.; Loh, Wan-Sin; Razak, Ibrahim Abdul","3-(4-Methylphenyl)-4-[(thiosemicarbazono)methyl]-1,2,3-oxadiazol-3-ium-5-olate 1,4-dioxane hemisolvate","Acta Crystallographica Section E","2013","69","5","o727","","10.1107/S1600536813008805","","","0.71073","MoKα","","0.0416","0.0349","","","0.0853","0.0903","","","","","","1.081","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237902","9.4804","0.0004","9.6401","0.0004","10.7013","0.0005","81.308","0.002","67.801","0.002","69.085","0.002","845.71","0.07","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","<i>rac</i>-Methyl 3-(2-methoxyphenyl)-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carboxylate","","- C19 H17 N O5 -","- C19 H17 N O5 -","- C38 H34 N2 O10 -","2","1","IS5259","Paramasivam, S.; Srinivasan, J.; Seshadri, P. R.; Bakthadoss, M.","<i>rac</i>-Methyl 3-(2-methoxyphenyl)-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carboxylate","Acta Crystallographica Section E","2013","69","5","o664","","10.1107/S1600536813008635","","","0.71073","MoKα","","0.0457","0.04","","","0.1063","0.1123","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237903","12.2879","0.0012","9.6422","0.0011","10.3642","0.0012","90","","90","","90","","1228","0.2","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","2-[(2-Chloroquinolin-3-yl)(hydroxy)methyl]acrylonitrile","","- C13 H9 Cl N2 O -","- C13 H9 Cl N2 O -","- C52 H36 Cl4 N8 O4 -","4","1","IS5260","Anuradha, T.; Srinivasan, J.; Seshadri, P. R.; Bakthadoss, M.","2-[(2-Chloroquinolin-3-yl)(hydroxy)methyl]acrylonitrile","Acta Crystallographica Section E","2013","69","5","o779","","10.1107/S1600536813010155","","","0.71073","MoKα","","0.039","0.0335","","","0.0862","0.09","","","","","","1.018","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237904","9.7233","0.0006","13.1987","0.0007","13.3217","0.0008","93.51","0.004","108.858","0.005","93.494","0.004","1608.93","0.17","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","[Diaquasesqui(nitrato-κ<i>O</i>)hemi(perchlorato-κ<i>O</i>)copper(II)]-μ-{bis[5-methyl-3-(pyridin-2-yl)-1<i>H</i>-pyrazol-4-yl] selenide}-[triaqua(perchlorato-κ<i>O</i>)copper(II)] nitrate monohydrate","","- C18 H28 Cl1.5 Cu2 N8.5 O19.5 Se -","- C18 H28 Cl1.5 Cu2 N8.5 O19.5 Se -","- C36 H56 Cl3 Cu4 N17 O39 Se2 -","2","1","IS5261","Seredyuk, Maksym; Pavlenko, Vadim A.; Znovjyak, Kateryna O.; Gumienna-Kontecka, Elzbieta; Iskenderov, Turganbay S.","[Diaquasesqui(nitrato-κ<i>O</i>)hemi(perchlorato-κ<i>O</i>)copper(II)]-μ-{bis[5-methyl-3-(pyridin-2-yl)-1<i>H</i>-pyrazol-4-yl] selenide}-[triaqua(perchlorato-κ<i>O</i>)copper(II)] nitrate monohydrate","Acta Crystallographica Section E","2013","69","6","m314","m315","10.1107/S1600536813012178","","","0.71073","MoKα","","0.053","0.0413","","","0.1062","0.1129","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237905","12.5728","0.0006","19.5997","0.0007","22.9708","0.0008","90","","107.041","0.0012","90","","5412","0.4","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tris(μ~4~-azepane-1-carbodithioato)bis(μ~3~-azepane-1-carbodithioato)-μ~9~-bromido-tetra-μ~2~-bromido-octacopper(I)copper(II)","","- C35 H60 Br5 Cu9 N5 S10 -","- C35 H60 Br5 Cu9 N5 S10 -","- C140 H240 Br20 Cu36 N20 S40 -","4","1","IS5263","Okubo, Takashi; Anma, Haruho; Maekawa, Masahiko; Kuroda-Sowa, Takayoshi","Tris(μ~4~-azepane-1-carbodithioato)bis(μ~3~-azepane-1-carbodithioato)-μ~9~-bromido-tetra-μ~2~-bromido-octacopper(I)copper(II)","Acta Crystallographica Section E","2013","69","5","m275","m276","10.1107/S1600536813009938","","","0.71075","MoKα","","","0.0499","","","","0.1215","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237906","12.4517","0.0003","13.268","0.0004","15.1666","0.0011","113.527","0.008","98.425","0.007","108.557","0.008","2067.3","0.3","200","2","200","2","","","","","","","","6","P 1","P 1","1","","<i>cyclo</i>-Tetrakis(μ~2~-<i>D</i>-penicillaminato-κ^4^<i>N</i>,<i>S</i>:<i>O</i>,<i>S</i>)tetrapalladium(II) 9.75-hydrate","","- C20 H55.5 N4 O17.75 Pd4 S4 -","- C20 H55.5 N4 O17.75 Pd4 S4 -","- C40 H111 N8 O35.5 Pd8 S8 -","2","2","IS5266","Yokoi, Anzu; Yoshinari, Nobuto; Konno, Takumi","<i>cyclo</i>-Tetrakis(μ~2~-<small>D</small>-penicillaminato-κ^4^<i>N</i>,<i>S</i>:<i>O</i>,<i>S</i>)tetrapalladium(II) 9.75-hydrate","Acta Crystallographica Section E","2013","69","5","m288","m289","10.1107/S160053681301088X","","","0.71075","MoKα","","0.0259","0.025","","","0.0614","0.0621","","","","","","1.079","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237907","7.3481","0.0003","10.2285","0.0004","11.0625","0.0004","114.134","0.002","91.056","0.002","106.624","0.002","718.3","0.05","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","2,5-Dimethyl-3-(4-methylphenylsulfonyl)-1-benzofuran","","- C17 H16 O3 S -","- C17 H16 O3 S -","- C34 H32 O6 S2 -","2","1","IS5267","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","2,5-Dimethyl-3-(4-methylphenylsulfonyl)-1-benzofuran","Acta Crystallographica Section E","2013","69","5","o817","","10.1107/S1600536813011392","","","0.71073","MoKα","","0.0497","0.0411","","","0.1023","0.1082","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237908","6.8142","0.0012","8.1942","0.0014","16.832","0.003","90","","100.081","0.004","90","","925.3","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Methyl-3-(2-oxo-2<i>H</i>-chromen-3-yl)-1<i>H</i>-imidazol-3-ium picrate","","- C19 H13 N5 O9 -","- C19 H13 N5 O9 -","- C38 H26 N10 O18 -","2","1","IS5268","Tuyen, Nguyen Van; Anh, Le Tuan; Festa, Alexey A.; Voskressensky, Leonid G.; Khrustalev, Victor N.","1-Methyl-3-(2-oxo-2<i>H</i>-chromen-3-yl)-1<i>H</i>-imidazol-3-ium picrate","Acta Crystallographica Section E","2013","69","6","o839","","10.1107/S1600536813011690","","","0.71073","MoKα","","0.0754","0.0627","","","0.159","0.1647","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237909","8.7196","0.0001","10.4133","0.0002","11.3658","0.0002","79.312","0.001","74.393","0.001","89.781","0.001","975.56","0.03","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-[4-(dimethylamino)phenyl]-1-phenyl-1<i>H</i>-benzimidazole-5-carboxylate","","- C24 H23 N3 O2 -","- C24 H23 N3 O2 -","- C48 H46 N6 O4 -","2","1","IS5269","Yeong, Keng Yoon; Ali, Mohamed Ashraf; Choon, Tan Soo; Rosli, Mohd Mustaqim; Razak, Ibrahim Abdul","Ethyl 2-[4-(dimethylamino)phenyl]-1-phenyl-1<i>H</i>-benzimidazole-5-carboxylate","Acta Crystallographica Section E","2013","69","6","o886","","10.1107/S1600536813012440","","","0.71073","MoKα","","0.0644","0.0495","","","0.116","0.1251","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237910","8.9018","0.0004","25.6357","0.0008","11.0961","0.0004","90","","113.369","0.001","90","","2324.46","0.15","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Dimethyl 1,8-bis(4-methylphenyl)-11-oxatricyclo[6.2.1.0^2,7^]undeca-2,4,6,9-tetraene-9,10-dicarboxylate","","- C28 H24 O5 -","- C28 H24 O5 -","- C112 H96 O20 -","4","1","IS5270","Balakrishnan, B.; Nandakumar, Meganathan; Seshadri, P. R.; Mohanakrishnan, Arasambattu K.","Dimethyl 1,8-bis(4-methylphenyl)-11-oxatricyclo[6.2.1.0^2,7^]undeca-2,4,6,9-tetraene-9,10-dicarboxylate","Acta Crystallographica Section E","2013","69","6","o951","","10.1107/S1600536813013305","","","0.71073","MoKα","","0.093","0.0552","","","0.1457","0.1697","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237911","7.4324","0.0005","10.9717","0.0003","11.2267","0.0003","117.202","0.001","101.645","0.002","94.032","0.002","783.47","0.06","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","6-(4-Methylphenyl)-1,3,5-triazine-2,4-diamine‒benzoic acid (1/1)","","- C17 H17 N5 O2 -","- C17 H17 N5 O2 -","- C34 H34 N10 O4 -","2","1","IS5271","Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Razak, Ibrahim Abdul; Lavanya, Palanisamy; Balasubramani, Kasthuri","6-(4-Methylphenyl)-1,3,5-triazine-2,4-diamine‒benzoic acid (1/1)","Acta Crystallographica Section E","2013","69","6","o968","o969","10.1107/S1600536813013883","","","0.71073","MoKα","","0.076","0.0615","","","0.1502","0.1567","","","","","","1.109","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237912","11.1271","0.0003","20.9492","0.0006","7.4189","0.0002","90","","101.321","0.002","90","","1695.73","0.08","100","1","100","1","","","","","","","","4","C 1 c 1","C -2yc","9","","6-(4-Methylphenyl)-1,3,5-triazine-2,4-diamine‒4-methylbenzoic acid (1/1)","","- C18 H19 N5 O2 -","- C18 H19 N5 O2 -","- C72 H76 N20 O8 -","4","1","IS5272","Thanigaimani, Kaliyaperumal; Arshad, Suhana; Razak, Ibrahim Abdul; Makeshvaran, Duraisamy; Balasubramani, Kasthuri","6-(4-Methylphenyl)-1,3,5-triazine-2,4-diamine‒4-methylbenzoic acid (1/1)","Acta Crystallographica Section E","2013","69","6","o970","","10.1107/S1600536813013895","","","0.71073","MoKα","","0.0584","0.0553","","","0.1332","0.1345","","","","","","1.187","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237913","5.8317","0.0005","9.2114","0.0008","16.8967","0.0016","90","","95.855","0.003","90","","902.92","0.14","123","","123","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Isopropyl-5-methyl-2-sulfanylideneimidazolidin-4-one","","- C7 H12 N2 O S -","- C7 H12 N2 O S -","- C28 H48 N8 O4 S4 -","4","1","IS5273","Ichitani, Masaki; Kitoh, Soh-ichi; Fujinami, Shuhei; Suda, Mitsuhiro; Honda, Mitsunori; Kunimoto, Ko-Ki","5-Isopropyl-5-methyl-2-sulfanylideneimidazolidin-4-one","Acta Crystallographica Section E","2013","69","6","o953","","10.1107/S1600536813013639","","","0.7107","MoKα","","","0.0498","","","","0.1255","","","","","","1.141","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237914","4.8822","0.0002","23.4752","0.0009","22.4311","0.0009","90","","91.494","0.002","90","","2569.97","0.18","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-[3-(2-Benzyloxy-6-hydroxy-4-methylphenyl)-5-[3,5-bis(trifluoromethyl)phenyl]-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]propane-1-one","","- C28 H24 F6 N2 O3 -","- C28 H24 F6 N2 O3 -","- C112 H96 F24 N8 O12 -","4","1","JJ2162","Patel, U. H.; Gandhi, S. A.; Barot, V. M.; Varma, N. V. S.","1-[3-(2-Benzyloxy-6-hydroxy-4-methylphenyl)-5-[3,5-bis(trifluoromethyl)phenyl]-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]propane-1-one","Acta Crystallographica Section E","2013","69","6","o840","","10.1107/S160053681301180X","","","0.71073","MoKα","","0.1123","0.07","","","0.2097","0.246","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237915","11.3119","0.0004","11.3119","0.0004","13.6384","0.0009","90","","90","","90","","1745.16","0.14","293","2","293","2","","","","","","","","4","P 42/m b c","-P 4c 2ab","135","","Dibarium tetraantimony(III) germanium(IV) decasulfide","","- Ba2 Ge S10 Sb4 -","- Ba2 Ge S10 Sb4 -","- Ba8 Ge4 S40 Sb16 -","4","0.25","JJ2163","Geng, Lei","Ba~2~Sb~4~GeS~10~","Acta Crystallographica Section E","2013","69","5","i24","","10.1107/S1600536813007988","","","0.71073","MoKα","","0.0183","0.0177","","","0.0415","0.0418","","","","","","1.145","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237916","8.2175","0.0003","16.3257","0.0008","22.6793","0.001","90","","90","","90","","3042.6","0.2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(Thiocyanato-κ<i>S</i>)tris(thiourea-κ<i>S</i>)mercury(II) chloride","","- C4 H12 Cl Hg N7 S4 -","- C4 H12 Cl Hg N7 S4 -","- C32 H96 Cl8 Hg8 N56 S32 -","8","1","JJ2165","Shihabuddeen Syed, A.; Rajarajan, K.; NizamMohideen, M.","(Thiocyanato-κ<i>S</i>)tris(thiourea-κ<i>S</i>)mercury(II) chloride","Acta Crystallographica Section E","2013","69","6","i33","","10.1107/S1600536813011847","","","0.71073","MoKα","","0.0663","0.0355","","","0.0705","0.0816","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237917","9.37786","0.00013","12.8653","0.00017","14.2891","0.0002","90","","107.916","0.0016","90","","1640.36","0.04","105","2","105","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>trans</i>-Dichloridobis{2-chloro-6-[(3-fluorobenzyl)amino]-9-isopropyl-9<i>H</i>-purine-κ<i>N</i>^7^}platinum(II)","","- C30 H30 Cl4 F2 N10 Pt -","- C30 H30 Cl4 F2 N10 Pt -","- C60 H60 Cl8 F4 N20 Pt2 -","2","0.5","JJ2166","Trávníček, Zdeněk; Štarha, Pavel","<i>trans</i>-Dichloridobis{2-chloro-6-[(3-fluorobenzyl)amino]-9-isopropyl-9<i>H</i>-purine-κ<i>N</i>^7^}platinum(II)","Acta Crystallographica Section E","2013","69","6","m331","","10.1107/S1600536813013202","","","0.71073","MoKα","","0.0158","0.0145","","","0.0365","0.037","","","","","","1.095","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237918","7.9106","0.001","8.3598","0.001","12.6906","0.0015","82.813","0.007","83.979","0.007","67.741","0.006","769.09","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","9-(2-Chlorobenzylidene)anthracen-10(9<i>H</i>)-one","","- C21 H13 Cl O -","- C21 H13 Cl O -","- C42 H26 Cl2 O2 -","2","1","KJ2220","Almansour, Abdulrahman I.; Arumugam, Natarajan; Kumar, Raju Suresh; Vijayalakshmi, P.; Suresh, J.","9-(2-Chlorobenzylidene)anthracen-10(9<i>H</i>)-one","Acta Crystallographica Section E","2013","69","5","o627","","10.1107/S160053681300809X","","","0.71073","MoKα","","0.0517","0.045","","","0.1226","0.1295","","","","","","1.058","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237919","7.05","0.003","7.442","0.003","10.334","0.004","85.166","0.006","86.22","0.006","64.682","0.004","488.1","0.3","105.15","","105.15","","","","","","","","","5","P 1","P 1","1","(2<i>S</i>)-<i>N</i>-(Selenoacetyl)proline methyl ester","Methyl (2<i>S</i>)-1-ethaneselenoylpyrrolidine-2-carboxylate","","- C8 H13 N O2 Se -","- C8 H13 N O2 Se -","- C16 H26 N2 O4 Se2 -","2","2","KJ2221","Guzei, Ilia A.; Choudhary, Amit; Raines, Ronald T.","Pyramidalization of a carbonyl C atom in (2<i>S</i>)-<i>N</i>-(selenoacetyl)proline methyl ester","Acta Crystallographica Section E","2013","69","5","o805","o806","10.1107/S1600536813011112","","","0.71073","MoKα","","0.0516","0.0505","","","0.1336","0.1349","","","","","","1.117","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237920","9.2575","0.0005","12.1707","0.0007","12.1991","0.0007","112.786","0.006","100.997","0.005","106.363","0.005","1143.89","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-[3-(Pyridin-1-ium-2-yl)-1<i>H</i>-pyrazol-1-yl]-6-[3-(pyridin-2-yl)-1<i>H</i>-pyrazol-1-yl]pyridinium sulfate methanol monosolvate","","- C22 H21 N7 O5 S -","- C22 H21 N7 O5 S -","- C44 H42 N14 O10 S2 -","2","1","KJ2223","Huang, Linxia; Shu, Mouhai","2-[3-(Pyridin-1-ium-2-yl)-1<i>H</i>-pyrazol-1-yl]-6-[3-(pyridin-2-yl)-1<i>H</i>-pyrazol-1-yl]pyridinium sulfate methanol monosolvate","Acta Crystallographica Section E","2013","69","5","o689","","10.1107/S1600536813008647","","","0.71073","MoKα","","0.0922","0.0528","","","0.1411","0.1634","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237921","8.317","0.003","15.601","0.006","14.752","0.005","90","","90.884","0.011","90","","1913.9","1.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","5-(benzyloxy)-3-methyl-1-tosyl-1H-indole","5-Benzyloxy-3-methyl-1-tosyl-1<i>H</i>-indole","","- C23 H21 N O3 S -","- C23 H21 N O3 S -","- C92 H84 N4 O12 S4 -","4","1","KJ2226","Pozza Silveira, Gustavo; Oliver, Allen G.; Noll, Bruce C.","5-Benzyloxy-3-methyl-1-tosyl-1<i>H</i>-indole","Acta Crystallographica Section E","2013","69","6","o979","","10.1107/S1600536813014001","","","0.71073","MoKα","","0.0432","0.0365","","","0.0971","0.1022","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237922","6.7891","0.0002","13.9921","0.0003","15.1788","0.0003","90","","101.175","0.001","90","","1414.55","0.06","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>rac</i>-3-(4-Chlorophenyl)-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carbonitrile","","- C17 H11 Cl N2 O2 -","- C17 H11 Cl N2 O2 -","- C68 H44 Cl4 N8 O8 -","4","1","KP2448","Paramasivam, S.; Srinivasan, J.; Seshadri, P.R.; Bakthadoss, M.","<i>rac</i>-3-(4-Chlorophenyl)-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carbonitrile","Acta Crystallographica Section E","2013","69","5","o716","","10.1107/S1600536813009653","","","0.71073","MoKα","","0.0524","0.0417","","","0.1225","0.1316","","","","","","0.997","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237923","9.6063","0.0012","7.0457","0.0009","11.9688","0.0015","90","","96.723","0.001","90","","804.52","0.18","296","2","296","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","2-Bromo-1,6,6-trimethyl-6,7,8,9-tetrahydrophenanthro[1,2-<i>b</i>]furan-10,11-dione","","- C19 H17 Br O3 -","- C19 H17 Br O3 -","- C38 H34 Br2 O6 -","2","0.5","KP2449","Fan, Cui-Ping; Yin, Wei-Ping; Cao, Xin-Xiang; Yao, Jing-Cai","2-Bromo-1,6,6-trimethyl-6,7,8,9-tetrahydrophenanthro[1,2-<i>b</i>]furan-10,11-dione","Acta Crystallographica Section E","2013","69","6","o834","","10.1107/S1600536813011483","","","0.71073","MoKα","","0.0492","0.0329","","","0.0825","0.0866","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237924","9.9618","0.0003","10.2196","0.0004","14.601","0.0006","90","","106.231","0.002","90","","1427.22","0.09","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,3-Bis[(3-chloropyrazin-2-yl)oxy]benzene","","- C14 H8 Cl2 N4 O2 -","- C14 H8 Cl2 N4 O2 -","- C56 H32 Cl8 N16 O8 -","4","0.5","KP2450","Srinivasan, Thothadri; Kalpana, Venkatesan; Rajakumar, Perumal; Velmurugan, Devadasan","1,3-Bis[(3-chloropyrazin-2-yl)oxy]benzene","Acta Crystallographica Section E","2013","69","5","o815","","10.1107/S160053681301129X","","","0.71073","MoKα","","0.0403","0.0356","","","0.1071","0.1128","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237925","7.2372","0.0001","6.6726","0.0001","11.7126","0.0002","90","","106.715","0.001","90","","541.714","0.015","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(4<i>S</i>)-4-[(<i>R</i>)-Chloro(4-nitrophenyl)methyl]-1,3-oxazolidin-2-one","","- C10 H9 Cl N2 O4 -","- C10 H9 Cl N2 O4 -","- C20 H18 Cl2 N4 O8 -","2","1","KP2451","Gaumet, V.; Denis, C.; Madesclaire, M.; Zaitsev, V. P.","(4<i>S</i>)-4-[(<i>R</i>)-Chloro(4-nitrophenyl)methyl]-1,3-oxazolidin-2-one","Acta Crystallographica Section E","2013","69","5","o783","","10.1107/S1600536813010398","","","0.71073","MoKα","","0.0439","0.0369","","","0.0928","0.0981","","","","","","1.06","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237926","10.242","0.002","28.556","0.005","30.214","0.006","90","","90","","90","","8837","3","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3β,6β-Diacetoxy-5,9α-dihydroxy-5α-cholest-7-en-11-one acetic acid 0.04-solvate","","- C31.09 H48.18 O7.09 -","- C31.0873 H48.131 O7.08733 -","- C373.048 H577.572 O85.048 -","12","3","KP2452","Piccialli, Vincenzo; Oliviero, Giorgia; Borbone, Nicola; Centore, Roberto; Tuzi, Angela","3β,6β-Diacetoxy-5,9α-dihydroxy-5α-cholest-7-en-11-one acetic acid 0.04-solvate","Acta Crystallographica Section E","2013","69","6","o879","o880","10.1107/S1600536813012646","","","0.71073","MoKα","","0.1225","0.0627","","","0.155","0.185","","","","","","0.997","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237927","6.3064","0.0002","5.4695","0.0002","14.6481","0.0005","90","","94.303","0.002","90","","503.83","0.03","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","[(2<i>R</i>,3<i>R</i>)-3-(4-Nitrophenyl)aziridin-2-yl]methanol monohydrate","","- C9 H12 N2 O4 -","- C9 H12 N2 O4 -","- C18 H24 N4 O8 -","2","1","KP2453","Gaumet, V.; Denis, C.; Leal, F.; Madesclaire, M.; Zaitsev, V. P.","[(2<i>R</i>,3<i>R</i>)-3-(4-Nitrophenyl)aziridin-2-yl]methanol monohydrate","Acta Crystallographica Section E","2013","69","6","o927","","10.1107/S1600536813013391","","","0.71073","MoKα","","0.0439","0.0349","","","0.0797","0.086","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237928","12.4929","0.0006","10.8699","0.0007","16.0758","0.0008","90","","91.864","0.005","90","","2181.9","0.2","99.95","0.17","99.95","0.17","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-[(5'-Chloro-1,1':3',1''-terphenyl-4'-yl)imino]acenaphthylen-1(2<i>H</i>)-one","","- C30 H18 Cl N O -","- C30 H18 Cl N O -","- C120 H72 Cl4 N4 O4 -","4","1","KQ2002","Du, Zhengyin; Che, Fushou; Yan, Yufei; Liu, Wei","2-[(5'-Chloro-1,1':3',1''-terphenyl-4'-yl)imino]acenaphthylen-1(2<i>H</i>)-one","Acta Crystallographica Section E","2013","69","5","o624","o625","10.1107/S1600536813008015","","","0.7107","MoKα","","0.0905","0.0578","","","0.1074","0.121","","","","","","1.09","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237929","6.914","0.003","11.232","0.004","11.806","0.004","91.079","0.006","100.737","0.005","96.317","0.006","894.6","0.6","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","15-Methoxy-14,15-dihydroandranginine","","- C22 H26 N2 O3 -","- C22 H26 N2 O3 -","- C44 H52 N4 O6 -","2","1","LD2092","Wang, Dian-Lei; Cai, Xiang-Hai; Huang, Peng; Huang, He-Ping","15-Methoxy-14,15-dihydroandranginine","Acta Crystallographica Section E","2013","69","6","o833","","10.1107/S1600536813011604","","","0.71073","MoKα","","0.0624","0.0406","","","0.0832","0.0889","","","","","","0.998","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237930","9.9187","0.0007","16.3916","0.0011","22.2115","0.0015","90","","92.5822","0.0011","90","","3607.6","0.4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 2,5-di-<i>tert</i>-butyl-5-ethoxy-4-oxo-4,5-dihydro-1<i>H</i>-pyrrole-3-carboxylate","","- C17 H29 N O4 -","- C17 H29 N O4 -","- C136 H232 N8 O32 -","8","2","LD2098","Rosen, Gerald M.; Muralidharan, Sukumaran; Zavalij, Peter Y.; Fletcher, Steven; Kao, Joseph P. Y.","Ethyl 2,5-di-<i>tert</i>-butyl-5-ethoxy-4-oxo-4,5-dihydro-1<i>H</i>-pyrrole-3-carboxylate","Acta Crystallographica Section E","2013","69","6","o878","","10.1107/S1600536813012282","","","0.71073","MoKα","","0.0424","0.0387","","","0.0751","0.0774","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237931","9.5723","0.0005","16.7309","0.0008","13.0555","0.0006","90","","92.929","0.002","90","","2088.15","0.18","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[3-(2-Acetoxyphenyl)quinoxalin-2-yl]phenyl acetate","","- C24 H18 N2 O4 -","- C24 H18 N2 O4 -","- C96 H72 N8 O16 -","4","1","LD2099","Shen, Dan-Feng; Lou, Shao-Jie; Xu, Dan-Qian","2-[3-(2-Acetoxyphenyl)quinoxalin-2-yl]phenyl acetate","Acta Crystallographica Section E","2013","69","5","o764","","10.1107/S1600536813009161","","","0.71073","MoKα","","0.0683","0.0452","","","0.0999","0.1173","","","","","","1.004","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237932","7.4523","0.0003","11.7003","0.0004","14.3121","0.0005","72.078","0.002","76.539","0.002","76.773","0.002","1137.98","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Methyl (2<i>Z</i>)-2-bromomethyl-3-(3-chlorophenyl)prop-2-enoate","","- C11 H10 Br Cl O2 -","- C11 H10 Br Cl O2 -","- C44 H40 Br4 Cl4 O8 -","4","2","LD2100","Swaminathan, K.; Sethusankar, K.; Selvakumar, Raman; Bakthadoss, Manickam","Methyl (2<i>Z</i>)-2-bromomethyl-3-(3-chlorophenyl)prop-2-enoate","Acta Crystallographica Section E","2013","69","6","o852","","10.1107/S1600536813012117","","","0.71073","MoKα","","0.0743","0.0355","","","0.0784","0.0915","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237933","8.106","0.0003","10.7771","0.0004","11.2639","0.0004","71.814","0.002","74.496","0.002","79.038","0.002","894.69","0.06","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","2-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuran","","- C21 H14 F I O2 S -","- C21 H14 F I O2 S -","- C42 H28 F2 I2 O4 S2 -","2","1","LD2102","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","2-(4-Fluorophenyl)-5-iodo-7-methyl-3-phenylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2013","69","6","o820","","10.1107/S1600536813011793","","","0.71073","MoKα","","0.0253","0.0234","","","0.0602","0.0615","","","","","","1.049","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237934","8.2402","0.0012","9.1449","0.0014","10.8876","0.0016","95.395","0.003","107.667","0.003","102.837","0.003","750.61","0.19","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","(<i>E</i>)-1-(3,5-Dimethoxyphenyl)-3-(3-methoxyphenyl)prop-2-en-1-one","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","1","LH5590","Ahn, Seunghyun; Lee, Ha-Jin; Lim, Yoongho; Koh, Dongsoo","(<i>E</i>)-1-(3,5-Dimethoxyphenyl)-3-(3-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","5","o666","","10.1107/S1600536813008982","","","0.71073","MoKα","","0.0846","0.0439","","","0.0846","0.1153","","","","","","0.984","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237935","14.6385","0.0006","12.5099","0.0006","26.2017","0.001","90","","92.645","0.001","90","","4793.1","0.4","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4'-(4-Fluorophenyl)-1'-methyldispiro[indan-2,2'-pyrrolidine-3',2''-indan]-1,3,1''-trione methanol hemisolvate","","- C29.5 H26 F N O5.5 -","- C29.5 H26 F N O5.5 -","- C236 H208 F8 N8 O44 -","8","2","LH5596","Ali, Mohamed Ashraf; Manogaran, Elumalai; Choon, Tan Soo; Rosli, Mohd Mustaqim; Razak, Ibrahim Abdul","4'-(4-Fluorophenyl)-1'-methyldispiro[indane-2,2'-pyrrolidine-3',2''-indane]-1,3,1''-trione methanol hemisolvate","Acta Crystallographica Section E","2013","69","5","o746","o747","10.1107/S1600536813009987","","","0.71073","MoKα","","0.0736","0.049","","","0.1324","0.1474","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237936","7.7003","0.001","8.2841","0.0011","11.8677","0.0015","106.005","0.002","91.715","0.002","115.01","0.002","650.07","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-azido-diazidodi-μ-oxalato-dihistaminetetracopper(II) 0.9-hydrate","","- C14 H19.8 Cu4 N18 O8.9 -","- C14 H18 Cu4 N18 O8.894 -","- C14 H18 Cu4 N18 O8.894 -","1","0.5","LH5597","Liu, Chen; Abboud, Khalil A.","Di-μ-azido-diazidodi-μ-oxalato-dihistaminetetracopper(II) 0.9-hydrate","Acta Crystallographica Section E","2013","69","6","m337","m338","10.1107/S1600536813013329","","","0.71073","MoKα","","0.0373","0.0287","","","0.0695","0.0732","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237937","10.9629","0.0002","7.2177","0.0001","16.7812","0.0003","90","","104.711","0.0007","90","","1284.32","0.04","90","0.2","90","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5,5'-Dichloro-2,2'-dimethoxybiphenyl","","- C14 H12 Cl2 O2 -","- C14 H12 Cl2 O2 -","- C56 H48 Cl8 O8 -","4","1","LH5598","Lehmler, Hans-Joachim; Wu, Huimin; Parkin, Sean","5,5'-Dichloro-2,2'-dimethoxybiphenyl","Acta Crystallographica Section E","2013","69","5","o650","","10.1107/S160053681300826X","","","0.71073","MoKα","","0.0579","0.0418","","","0.1012","0.1113","","","","","","1.108","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237938","11.571","0.002","14.109","0.003","16.357","0.006","90","","121.03","0.02","90","","2288.2","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichloridobis{2-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-1<i>H</i>-benzimidazole-κ<i>N</i>^3^}zinc(II)","","- C20 H18 Cl2 N10 Zn -","- C20 H18 Cl2 N10 Zn -","- C80 H72 Cl8 N40 Zn4 -","4","1","LH5599","Zhang, Wei-Peng; Zhang, Jiao-Lin; Hao, Bao-Lian; Yang, Huai-Xia","Dichloridobis{2-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-1<i>H</i>-benzimidazole-κ<i>N</i>^3^}zinc(II)","Acta Crystallographica Section E","2013","69","5","m241","","10.1107/S1600536813008283","","","0.71073","MoKα","","0.0775","0.0573","","","0.0996","0.1083","","","","","","1.134","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237939","14.8723","0.0007","12.4829","0.0006","19.2103","0.0009","90","","96.126","0.001","90","","3546","0.3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","(<i>anti</i>-Chloridothiosemicabazide-κ<i>S</i>)bis(triphenylphosphane-κ<i>P</i>)copper(I) 0.48-hydrate","","- C37 H35.96 Cl Cu N3 O0.48 P2 S -","- C37 H35.958 Cl Cu N3 O0.479 P2 S -","- C148 H143.832 Cl4 Cu4 N12 O1.916 P8 S4 -","4","1","LH5600","Nimthong, Ruthairat; Pakawatchai, Chaveng; Phongphayak, Nutchanat; Wattanakanjana, Yupa","(<i>anti</i>-Chloridothiosemicabazide-κ<i>S</i>)bis(triphenylphosphane-κ<i>P</i>)copper(I) 0.48-hydrate","Acta Crystallographica Section E","2013","69","5","m244","m245","10.1107/S1600536813008556","","","0.71073","MoKα","","0.0651","0.0474","","","0.1021","0.1098","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237940","31.6697","0.0011","7.5883","0.0002","12.5915","0.0006","90","","108.514","0.004","90","","2869.4","0.2","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Methyl 2-{2-[(2-methylphenoxy)methyl]phenyl}-2-oxoacetate","","- C17 H16 O4 -","- C17 H16 O4 -","- C136 H128 O32 -","8","1","LH5601","Kaur, Manpreet; Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Siddaraju, B. P.","Methyl 2-{2-[(2-methylphenoxy)methyl]phenyl}-2-oxoacetate","Acta Crystallographica Section E","2013","69","5","o671","","10.1107/S1600536813008878","","","1.54184","CuKα","","0.0435","0.0384","","","0.1023","0.1067","","","","","","1.069","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237941","8.1832","0.0002","8.8473","0.0002","9.5814","0.0002","75.355","0.001","81.624","0.001","77.134","0.001","651.35","0.03","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","1-(10-Bromoanthracen-9-yl)-1<i>H</i>-imidazole","","- C17 H11 Br N2 -","- C17 H11 Br N2 -","- C34 H22 Br2 N4 -","2","1","LH5602","Lee, Hon Man; Lee, Hong-Jyun","1-(10-Bromoanthracen-9-yl)-1<i>H</i>-imidazole","Acta Crystallographica Section E","2013","69","5","o672","","10.1107/S160053681300891X","","","0.71073","MoKα","","0.0367","0.0317","","","0.0978","0.0996","","","","","","1.11","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237942","9.4447","0.0003","19.1818","0.0006","28.1141","0.0007","90","","90","","90","","5093.3","0.3","100","1","100","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Betulone","Lup-20(29)-en-28-ol-3-one","","- C30 H48 O2 -","- C30 H48 O2 -","- C240 H384 O16 -","8","2","LH5603","Boryczka, Stanisław; Michalik, Ewa; Kusz, Joachim; Nowak, Maria; Chrobak, Elwira","Lup-20(29)-en-28-ol-3-one (betulone)","Acta Crystallographica Section E","2013","69","5","o795","o796","10.1107/S1600536813011008","","","0.71073","MoKα","","0.0586","0.051","","","0.1371","0.1406","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237943","7.7873","0.0002","9.5982","0.0002","9.6041","0.0002","76.608","0.002","70.602","0.002","68.57","0.002","625.3","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-Methyl-4-{(<i>E</i>)-[4-(methylsulfanyl)benzylidene]amino}-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","","- C11 H12 N4 S2 -","- C11 H12 N4 S2 -","- C22 H24 N8 S4 -","2","1","LH5604","Sarojini, B. K.; Manjula, P. S.; Hegde, Gurumurthy; Kour, Dalbir; Gupta, Vivek K.; Kant, Rajni","3-Methyl-4-{(<i>E</i>)-[4-(methylsulfanyl)benzylidene]amino}-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2013","69","5","o718","o719","10.1107/S1600536813009690","","","0.71073","MoKα","","0.0378","0.032","","","0.0836","0.0881","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237944","7.458","0.0003","5.8006","0.0002","25.2817","0.001","90","","94.513","0.004","90","","1090.32","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Amino-3-(3-methoxybenzyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","","- C10 H12 N4 O S -","- C10 H12 N4 O S -","- C40 H48 N16 O4 S4 -","4","1","LH5605","Sarojini, B. K.; Manjula, P. S.; Hegde, Gurumurthy; Kour, Dalbir; Anthal, Sumati; Gupta, Vivek K.; Kant, Rajni","4-Amino-3-(3-methoxybenzyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2013","69","5","o728","","10.1107/S1600536813009859","","","0.71073","MoKα","","0.0461","0.0355","","","0.0826","0.088","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237945","11.3776","0.0006","11.9579","0.0005","11.0459","0.0006","90","","90.943","0.002","90","","1502.62","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,2-Bis(2,4-dinitrophenyl)disulfane","","- C12 H6 N4 O8 S2 -","- C12 H6 N4 O8 S2 -","- C48 H24 N16 O32 S8 -","4","1","LH5606","Muthulakshmi, Selvarasu; Kalaivani, Doraisamyraja","1,2-Bis(2,4-dinitrophenyl)disulfane","Acta Crystallographica Section E","2013","69","5","o808","o809","10.1107/S1600536813011082","","","0.71073","MoKα","","0.0722","0.0471","","","0.1238","0.1408","","","","","","1.021","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237946","9.2614","0.0004","11.0309","0.0004","13.8161","0.0006","102.557","0.002","100.646","0.002","103.704","0.002","1296.29","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl 2-[(2-chloroquinolin-3-yl)(hydroxy)methyl]acrylate","","- C14 H12 Cl N O3 -","- C14 H12 Cl N O3 -","- C56 H48 Cl4 N4 O12 -","4","2","LH5607","Anuradha, T.; Srinivasan, J.; Seshadri, P. R.; Bakthadoss, M.","Methyl 2-[(2-chloroquinolin-3-yl)(hydroxy)methyl]acrylate","Acta Crystallographica Section E","2013","69","6","o990","","10.1107/S1600536813014050","","","0.71073","MoKα","","0.0401","0.0322","","","0.0866","0.0929","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237947","8.842","0.001","10.743","0.001","15.268","0.003","90","","98.32","0.01","90","","1435","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Sodium bis(ethylenediamine)copper(II) tetracyanidocuprate(I)","","- C8 H16 Cu2 N8 Na -","- C8 H16 Cu2 N8 Na -","- C32 H64 Cu8 N32 Na4 -","4","1","LH5608","Corfield, Peter W. R.; Dobbs, Robert K.; Bell, Brian","Sodium bis(ethylenediamine)copper(II) tetracyanidocuprate(I)","Acta Crystallographica Section E","2013","69","6","m307","m308","10.1107/S1600536813012075","","","1.5418","CuKα","","0.03","0.0293","","","0.0862","0.0867","","","","","","1.192","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237948","3.5875","0.0003","24.8548","0.0017","8.819","0.006","90","","95.546","0.004","90","","782.7","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[1<i>H</i>-imidazol-3-ium [di-μ-nitrato-sodium]]","","- C3 H5 N4 Na O6 -","- C3 H5 N4 Na O6 -","- C12 H20 N16 Na4 O24 -","4","1","LH5609","Trifa, Chahrazed; Bouhali, Amira; Bouacida, Sofiane; Boudaren, Chaouki; Bataille, Thierry","Poly[1<i>H</i>-imidazol-3-ium [di-μ-nitrato-sodium]]","Acta Crystallographica Section E","2013","69","6","m303","m304","10.1107/S1600536813011951","","","0.71073","MoKα","","0.0429","0.0343","","","0.0795","0.0842","","","","","","1.098","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237949","9.7939","0.0015","5.1123","0.0009","16.776","0.003","90","","115.838","0.011","90","","756","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(3-aminopyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)diaquanickel(II) dihydrate","","- C10 H16 N6 Ni O8 -","- C10 H16 N6 Ni O8 -","- C20 H32 N12 Ni2 O16 -","2","0.5","LH5610","Bouchene, Rafika; Khadri, Amina; Bouacida, Sofiane; Berrah, Fadila; Merazig, Hocine","Bis(3-aminopyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)diaquanickel(II) dihydrate","Acta Crystallographica Section E","2013","69","6","m309","m310","10.1107/S1600536813012208","","","0.71073","MoKα","","0.0368","0.0275","","","0.0681","0.0729","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237950","7.8205","0.0002","13.356","0.0003","8.5621","0.0002","90","","90","","90","","894.32","0.04","120","2","120","2","","","","","","","","4","P n a 21","P 2c -2n","33","","1-Allyl-2-aminopyridin-1-ium bromide","","- C8 H11 Br N2 -","- C8 H11 Br N2 -","- C32 H44 Br4 N8 -","4","1","LH5611","Seethalakshmi, T.; Venkatesan, P.; Nallu, M.; Lynch, Daniel E.; Thamotharan, S.","1-Allyl-2-aminopyridin-1-ium bromide","Acta Crystallographica Section E","2013","69","6","o884","","10.1107/S1600536813012452","","","0.71073","MoKα","","0.0241","0.0228","","","0.0521","0.0529","","","","","","1.059","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237951","10.471","0.0003","10.4957","0.0003","11.9774","0.0003","84.941","0.002","83.633","0.002","69.084","0.003","1220.32","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis(but-2-enoato-κ<i>O</i>)triphenylbismuth(V)","","- C26 H25 Bi O4 -","- C26 H25 Bi O4 -","- C52 H50 Bi2 O8 -","2","1","LH5612","Andreev, Pavel V.; Somov, Nikolay V.; Kalistratova, Olga S.; Gushchin, Alexey V.; Chuprunov, Evgeny V.","Bis(but-2-enoato-κ<i>O</i>)triphenylbismuth(V)","Acta Crystallographica Section E","2013","69","6","m333","","10.1107/S1600536813013317","","","0.71073","MoKα","","0.0228","0.0199","","","","0.0501","","","","","","1.114","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237952","8.8015","0.0014","11.2619","0.0014","11.838","0.003","62.86","0.017","73.625","0.016","79.593","0.012","1000","0.4","102","2","102","2","","","","","","","","4","P -1","-P 1","2","","3,4-Bis[1-(prop-2-ynyl)-1<i>H</i>-indol-3-yl]-1<i>H</i>-pyrrole-2,5-dione","","- C26 H17 N3 O2 -","- C26 H17 N3 O2 -","- C52 H34 N6 O4 -","2","1","LH5613","Huang, Mu-Hua; Gao, Yong-Chen; Yang, Feng-Ling; Luo, Yun-Jun","3,4-Bis[1-(prop-2-ynyl)-1<i>H</i>-indol-3-yl]-1<i>H</i>-pyrrole-2,5-dione","Acta Crystallographica Section E","2013","69","6","o924","o925","10.1107/S1600536813012889","","","0.71073","MoKα","","0.066","0.049","","","0.1051","0.1138","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237953","7.095","0.016","15.14","0.04","17.86","0.05","90","","90","","90","","1918","9","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Methoxy-1-(2-methoxy-4-nitronaphthalen-1-yl)-6-nitronaphthalene","","- C22 H16 N2 O6 -","- C22 H16 N2 O6 -","- C88 H64 N8 O24 -","4","1","LR2099","Wannalerse, Boontana; Pannil, Wilasinee; Loriang, Jaruwan; Tuntulani, Thawatchai; Duangthongyou, Tanwawan","2-Methoxy-1-(2-methoxy-4-nitronaphthalen-1-yl)-6-nitronaphthalene","Acta Crystallographica Section E","2013","69","5","o682","","10.1107/S1600536813008660","","","0.71073","MoKα","","0.0537","0.0345","","","0.0801","0.0901","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237954","8.1818","0.0011","9.7103","0.0013","13.9435","0.0019","69.642","0.001","75.448","0.001","67.032","0.001","947.6","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)-9-(But-2-en-1-yl)-6-chloro-9<i>H</i>-purine","","- C9 H9 Cl N4 -","- C9 H9 Cl N4 -","- C36 H36 Cl4 N16 -","4","2","LR2100","Lundvall, Fredrik; Kania, Jindrich; Gundersen, Lise-Lotte","(<i>E</i>)-9-(But-2-en-1-yl)-6-chloro-9<i>H</i>-purine","Acta Crystallographica Section E","2013","69","6","o849","","10.1107/S1600536813010416","","","0.71073","MoKα","","0.0293","0.0266","","","0.0684","0.0704","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237955","11.645","0.0002","7.167","0.0001","16.308","0.0003","90","","107.654","0.001","90","","1296.96","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Methylanilinium 4-hydroxybenzenesulfonate","","- C13 H15 N O4 S -","- C13 H15 N O4 S -","- C52 H60 N4 O16 S4 -","4","1","LR2102","Jovita, J. V.; Sathya, S.; Usha, G.; Vasanthi, R.; Sagayaraj, P.","4-Methylanilinium 4-hydroxybenzenesulfonate","Acta Crystallographica Section E","2013","69","5","o725","","10.1107/S1600536813009410","","","0.71073","MoKα","","0.0347","0.0304","","","0.0873","0.0907","","","","","","1.059","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237956","6.4716","0.0003","9.8468","0.0006","16.9206","0.0007","75.438","0.004","80.307","0.004","75.863","0.004","1005.42","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","8-{(<i>E</i>)-[(4-Chlorophenyl)imino]methyl}-1,1,7,7-tetramethyl-1,2,3,5,6,7-hexahydropyrido[3,2,1-<i>ij</i>]quinolin-9-ol","","- C23 H27 Cl N2 O -","- C23 H27 Cl N2 O -","- C46 H54 Cl2 N4 O2 -","2","1","LR2103","Kantar, Esen Nur; Köysal, Yavuz; Akdemir, Nesuhi; Ağar, Ayşen Alaman; Soylu, Mustafa Serkan","8-{(<i>E</i>)-[(4-Chlorophenyl)imino]methyl}-1,1,7,7-tetramethyl-1,2,3,5,6,7-hexahydropyrido[3,2,1-<i>ij</i>]quinolin-9-ol","Acta Crystallographica Section E","2013","69","6","o883","","10.1107/S1600536813012579","","","0.71073","MoKα","","0.0696","0.0552","","","0.1307","0.1421","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237957","5.1947","0.0001","12.1221","0.0003","18.2724","0.0005","90","","98.067","0.001","90","","1139.24","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(Ammoniomethyl)pyridinium bis(perchlorate)","","- C6 H10 Cl2 N2 O8 -","- C6 H10 Cl2 N2 O8 -","- C24 H40 Cl8 N8 O32 -","4","1","LR2104","Bayar, Imen; Kefi, Riadh; Sidonio Pereira da Silva, Pedro; Ramos Silva, Manuela; Ben Nasr, Cherif","3-(Ammoniomethyl)pyridinium bis(perchlorate)","Acta Crystallographica Section E","2013","69","6","o843","","10.1107/S1600536813012038","","","0.71073","MoKα","","0.0579","0.0512","","","0.1421","0.1484","","","","","","1.059","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2237958","9.156","0.005","17.668","0.008","10.103","0.005","90","","107.914","0.007","90","","1555.1","1.3","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(2-Methyl-3-oxo-1,3-diphenylpropyl)acetamide","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C72 H76 N4 O8 -","4","1","LX2279","Yang, Deli; Shi, Daxin; Zhang, Qi; Chai, Hongxin; Li, Jiarong","<i>N</i>-(2-Methyl-3-oxo-1,3-diphenylpropyl)acetamide","Acta Crystallographica Section E","2013","69","5","o633","","10.1107/S1600536813007320","","","0.71073","MoKα","","0.0893","0.0697","","","0.145","0.156","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237959","9.4761","0.0002","11.9967","0.0003","15.9238","0.0004","75.944","0.002","86.163","0.001","69.368","0.003","1643.07","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","3,3'-{[(Biphenyl-2,2'-diyl)bis(methylene)]bis(oxy)}bis[<i>N</i>-(4-chlorophenyl)benzamide]","","- C40 H30 Cl2 N2 O4 -","- C40 H30 Cl2 N2 O4 -","- C80 H60 Cl4 N4 O8 -","2","1","LX2280","Rajadurai, Raj; Padmanabhan, Ramar; Meenakshi Sundaram, Soma Sundaram; Ananthan, Sarkkarai","3,3'-{[(Biphenyl-2,2'-diyl)bis(methylene)]bis(oxy)}bis[<i>N</i>-(4-chlorophenyl)benzamide]","Acta Crystallographica Section E","2013","69","6","o914","o915","10.1107/S160053681301009X","","","0.71073","MoKα","","0.0665","0.0394","","","0.0873","0.1011","","","","","","1.016","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237960","10.2115","0.0007","9.9667","0.0007","21.3672","0.0016","90","","100.971","0.007","90","","2134.9","0.3","223","","223","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>cis</i>-Tetrakis(μ-<i>N</i>-phenylacetamidato)-κ^4^<i>N</i>:<i>O</i>;κ^4^<i>O</i>:<i>N</i>-bis[(benzonitrile-κ<i>N</i>)rhodium(II)](<i>Rh</i>—<i>Rh</i>)","","- C46 H42 N6 O4 Rh2 -","- C46 H42 N6 O4 Rh2 -","- C92 H84 N12 O8 Rh4 -","2","0.5","MW2103","Eagle, Cassandra T.; Quarshie, Fredricka; Ketron, Megan E.; Atem-Tambe, Nkongho","<i>cis</i>-Tetrakis(μ-<i>N</i>-phenylacetamidato)-κ^4^<i>N</i>:<i>O</i>;κ^4^<i>O</i>:<i>N</i>-bis[(benzonitrile-κ<i>N</i>)rhodium(II)](<i>Rh</i>—<i>Rh</i>)","Acta Crystallographica Section E","2013","69","6","m329","","10.1107/S1600536813012828","","","0.71075","MoKα","","","0.0214","","","","0.0544","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237961","10.2048","0.0006","18.517","0.0011","9.6164","0.0006","90","","90.494","0.004","90","","1817.07","0.19","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(9<i>H</i>-Fluoren-9-yl)-4-(4-fluoroanilino)-4-oxobutanoic acid","","- C23 H18 F N O3 -","- C23 H18 F N O3 -","- C92 H72 F4 N4 O12 -","4","1","MW2107","Matviiuk, Tetiana; Baltas, Michel; Voitenko, Zoia; Gorichko, Marian; Lherbet, Christian","2-(9<i>H</i>-Fluoren-9-yl)-4-(4-fluoroanilino)-4-oxobutanoic acid","Acta Crystallographica Section E","2013","69","6","o963","","10.1107/S1600536813013779","","","0.71073","MoKα","","0.1283","0.0544","","","0.0846","0.1038","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237962","6.5529","0.0005","10.0457","0.0008","14.5282","0.0011","83.372","0.002","86.697","0.002","87.427","0.002","947.69","0.13","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","4-(1<i>H</i>-Pyrrolo[2,3-<i>b</i>]pyridin-2-yl)pyridine","","- C12 H9 N3 -","- C12 H9 N3 -","- C48 H36 N12 -","4","2","NC2308","Huang, Ping-Hsin; Wen, Yuh-Sheng; Shen, Jiun-Yi","4-(1<i>H</i>-Pyrrolo[2,3-<i>b</i>]pyridin-2-yl)pyridine","Acta Crystallographica Section E","2013","69","5","o674","","10.1107/S1600536813008672","","","0.71073","MoKα","","0.0801","0.0578","","","0.1145","0.1239","","","","","","1.139","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237963","8.7444","0.0009","8.4832","0.0009","19.829","0.002","90","","94.053","0.002","90","","1467.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-3-(3,4-Difluorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one","","- C17 H14 F2 O3 -","- C17 H14 F2 O3 -","- C68 H56 F8 O12 -","4","1","NC2310","Zhu, He-Ping; Yu, Peng-Tian; Wang, Zhe; Yang, Sheng-Li; Liu, Zhi-Guo","(<i>E</i>)-3-(3,4-Difluorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","6","o960","","10.1107/S1600536813013767","","","0.71073","MoKα","","0.0602","0.0428","","","0.1171","0.1286","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237964","7.1786","0.0011","7.3213","0.001","16.042","0.002","90","","102.196","0.004","90","","824.1","0.2","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","<i>tert</i>-Butyl <i>N</i>-[(3<i>R</i>,4<i>R</i>)-1-(2-cyanoacetyl)-4-methylpiperidin-3-yl]-<i>N</i>-methylcarbamate","","- C15 H25 N3 O3 -","- C15 H25 N3 O3 -","- C30 H50 N6 O6 -","2","1","NC2311","Gehringer, Matthias; Forster, Michael; Schollmeyer, Dieter; Laufer, Stefan","<i>tert</i>-Butyl <i>N</i>-[(3<i>R</i>,4<i>R</i>)-1-(2-cyanoacetyl)-4-methylpiperidin-3-yl]-<i>N</i>-methylcarbamate","Acta Crystallographica Section E","2013","69","6","o935","","10.1107/S1600536813013512","","","0.71073","MoKα","","0.0476","0.0384","","","0.0949","0.1012","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237965","21.219","0.003","9.4756","0.0014","21.596","0.004","90","","92.845","0.01","90","","4336.8","1.2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetraacetonitrilelithium tetraisothiocyanatoborate","","- C12 H12 B Li N8 S4 -","- C12 H12 B Li N8 S4 -","- C96 H96 B8 Li8 N64 S32 -","8","1","NG5320","Breunig, Jens Michael; Wietelmann, Ulrich; Lerner, Hans-Wolfram; Bolte, Michael","Tetraacetonitrilelithium tetraisothiocyanatoborate","Acta Crystallographica Section E","2013","69","5","m253","","10.1107/S1600536813009082","","","0.71073","MoKα","","0.0641","0.0379","","","0.0837","0.092","","","","","","0.965","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237966","17.4615","0.0013","19.0291","0.0015","11.9501","0.0009","90","","91.825","0.005","90","","3968.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2,2-Dichloroacetyl)-3-ethyl-2,6-diphenylpiperidin-4-one","","- C21 H21 Cl2 N O2 -","- C21 H21 Cl2 N O2 -","- C168 H168 Cl16 N8 O16 -","8","2","NG5321","Sugumar, P.; Kayalvizhi, R.; Nirmala, P.; Ponnuswamy, S.; Ponnuswamy, M. N.","1-(2,2-Dichloroacetyl)-3-ethyl-2,6-diphenylpiperidin-4-one","Acta Crystallographica Section E","2013","69","5","o800","","10.1107/S1600536813010957","","","0.71073","MoKα","","0.1219","0.0544","","","0.1342","0.1751","","","","","","0.998","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237967","22.04","0.004","11.844","0.002","9.5102","0.0019","90","","101.69","0.03","90","","2431.1","0.8","123","2","123.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","5-Bromo-2-hydroxybenzaldehyde 4-ethylthiosemicarbazone","","- C10 H12 Br N3 O S -","- C10 H12 Br N3 O S -","- C80 H96 Br8 N24 O8 S8 -","8","1","NG5322","Li, Zhaoyang; Sato, Osamu","5-Bromo-2-hydroxybenzaldehyde 4-ethylthiosemicarbazone","Acta Crystallographica Section E","2013","69","5","o762","","10.1107/S1600536813008787","","","0.710747","MoKα","","0.0542","0.0415","","","0.1082","0.1135","","","","","","0.953","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237968","22.672","0.003","8.8049","0.0011","24.431","0.003","90","","110.487","0.002","90","","4568.6","1","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 9-(4-methoxyphenyl)-19-methyl-3,12-diazapentacyclo[10.7.0.0^2,10^.0^3,8^.0^13,18^]nonadeca-1(19),13(18),14,16-tetraene-10-carboxylate","","- C27 H30 N2 O3 -","- C27 H30 N2 O3 -","- C216 H240 N16 O24 -","8","2","NG5324","Selvanayagam, S.; Sridhar, B.; Kathiravan, S.; Raghunathan, R.","Methyl 9-(4-methoxyphenyl)-19-methyl-3,12-diazapentacyclo[10.7.0.0^2,10^.0^3,8^.0^13,18^]nonadeca-1(19),13(18),14,16-tetraene-10-carboxylate","Acta Crystallographica Section E","2013","69","5","o776","","10.1107/S1600536813010489","","","0.71073","MoKα","","0.127","0.0922","","","0.167","0.1822","","","","","","1.181","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237969","9.1342","0.0006","9.2874","0.0006","27.0454","0.0014","90","","90","","90","","2294.3","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3,5-Dimethyl-1-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}-2,6-diphenylpiperidin-4-one","","- C24 H25 N3 O2 S2 -","- C24 H25 N3 O2 S2 -","- C96 H100 N12 O8 S8 -","4","1","NG5326","Ganesan, S.; Sugumar, P.; Ananthan, S.; Ponnuswamy, M. N.","3,5-Dimethyl-1-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}-2,6-diphenylpiperidin-4-one","Acta Crystallographica Section E","2013","69","6","o845","","10.1107/S1600536813012014","","","0.71073","MoKα","","0.0495","0.0396","","","0.0927","0.0975","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237970","10.3301","0.0002","10.5415","0.0002","15.216","0.0003","90","","90","","90","","1656.94","0.06","90","0.2","90","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,2',5',6-Tetrachloro-4-[(1<i>S</i>)-1-methylpropoxy]biphenyl","","- C16 H14 Cl4 O -","- C16 H14 Cl4 O -","- C64 H56 Cl16 O4 -","4","1","NG5329","Lehmler, Hans-Joachim; Wu, Huimin; Parkin, Sean","2,2',5',6-Tetrachloro-4-[(1<i>S</i>)-1-methylpropoxy]biphenyl","Acta Crystallographica Section E","2013","69","6","o983","","10.1107/S1600536813014098","","","0.71073","MoKα","","0.0435","0.0336","","","0.0763","0.0813","","","","","","1.092","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237971","10.93439","0.00014","11.83205","0.00018","13.51039","0.00019","84.7158","0.0012","84.3918","0.0011","85.624","0.0011","1728.16","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(Cyclobutane-1,1-dicarboxylato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')platinum(II) dihydrate","","- C18 H18 N2 O6 Pt -","- C18 H18 N2 O6 Pt -","- C72 H72 N8 O24 Pt4 -","4","2","NG5330","Štarha, Pavel; Trávníček, Zdeněk","(Cyclobutane-1,1-dicarboxylato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')platinum(II) dihydrate","Acta Crystallographica Section E","2013","69","6","m334","","10.1107/S1600536813013378","","","0.71073","MoKα","","0.0235","0.0214","","","0.0575","0.0583","","","","","","1.117","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237972","14.3408","0.0006","9.1904","0.0004","26.4029","0.0012","90","","93.451","0.002","90","","3473.5","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(<i>N</i>,<i>N</i>-dimethylanilinium) hexabromidostannate(IV) bromide","","- C24 H36 Br7 N3 Sn -","- C24 H36 Br7 N3 Sn -","- C96 H144 Br28 N12 Sn4 -","4","1","NK2205","Chouaib, Hassen; Kamoun, Slaheddine; Ayedi, Hassine Ferid","Tris(<i>N</i>,<i>N</i>-dimethylanilinium) hexabromidostannate(IV) bromide","Acta Crystallographica Section E","2013","69","6","m311","","10.1107/S1600536813012403","","","0.71073","MoKα","","0.053","0.0304","","","0.0567","0.0636","","","","","","1.014","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237973","10.036","0.002","10.064","0.002","14.264","0.003","90","","107.3","0.01","90","","1375.5","0.5","297","2","297","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Li3[AsS4].8H2O","Trilithium thioarsenate octahydrate","","- As H16 Li3 O8 S4 -","- As H16 Li3 O8 S4 -","- As4 H64 Li12 O32 S16 -","4","1","PJ2002","Mereiter, Kurt","Trilithium thioarsenate octahydrate","Acta Crystallographica Section E","2013","69","5","i30","i31","10.1107/S1600536813010921","","","0.71073","MoKα","","0.0485","0.0278","","","0.0515","0.0573","","","","","","1.051","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237974","20.219","0.007","7.246","0.002","33.885","0.011","90","","103.017","0.007","90","","4837","3","193","2","193","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","6,12-Bis[(tricyclohexylsilyl)ethynyl]indeno[1,2-<i>b</i>]fluorene","","- C60 H76 Si2 -","- C60 H76 Si2 -","- C240 H304 Si8 -","4","0.5","PK2470","Rose, Bradley D.; Zakharov, Lev N.; Haley, Michael M.","6,12-Bis[(tricyclohexylsilyl)ethynyl]indeno[1,2-<i>b</i>]fluorene","Acta Crystallographica Section E","2013","69","6","o890","","10.1107/S160053681301218X","","","0.71073","MoKα","","0.1672","0.0761","","","0.1195","0.1506","","","","","","1.006","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237975","13.037","0.002","23.355","0.003","13.787","0.002","90","","104.83","0.03","90","","4058","1.1","295","2","295","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(Tris{2-[2-(2,3,5,6-tetrafluoro-4-iodophenoxy)ethoxy]ethyl}amine)potassium iodide","","- C30 H24 F12 I4 K N O6 -","- C30 H24 F12 I4 K N O6 -","- C120 H96 F48 I16 K4 N4 O24 -","4","1","PK2473","Cavallo, Gabriella; Neukirch, Hannes; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo","(Tris{2-[2-(2,3,5,6-tetrafluoro-4-iodophenoxy)ethoxy]ethyl}amine)potassium iodide","Acta Crystallographica Section E","2013","69","5","m284","m285","10.1107/S1600536813010532","","","0.71073","MoKα","","0.0508","0.0406","","","0.1141","0.1194","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237976","23.55","0.008","18.814","0.007","12.114","0.005","90","","90","","90","","5367","3","295","","295","","","","","","","","","5","P b c n","-P 2n 2ab","60","","Aquabis(4-methylbenzenesulfonato-κ<i>O</i>)(η^5^-pentamethylcyclopentadienyl)rhodium(III) monohydrate","","- C24 H33 O8 Rh S2 -","- C24 H33 O8 Rh S2 -","- C192 H264 O64 Rh8 S16 -","8","1","PK2474","Roy, Christopher P.; Boyer, Pauline M.; Merola, Joseph S.","Aquabis(4-methylbenzenesulfonato-κ<i>O</i>)(η^5^-pentamethylcyclopentadienyl)rhodium(III) monohydrate","Acta Crystallographica Section E","2013","69","5","m259","m260","10.1107/S160053681300860X","","","0.71073","MoKα","","0.0682","0.0383","","","0.0755","0.0861","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237977","22.4689","0.0007","22.4689","0.0007","8.2443","0.0003","90","","90","","90","","4162.1","0.2","296","2","296","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","Diethyl 4-(2-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate","","- C20 H25 N O5 -","- C20 H25 N O5 -","- C160 H200 N8 O40 -","8","1","PK2475","Wang, Ke; Wang, Yifeng; Yao, Minjie; Xu, Danqian","Diethyl 4-(2-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2013","69","5","o785","","10.1107/S1600536813009951","","","0.71073","MoKα","","0.09","0.0587","","","0.1472","0.1671","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237978","10.245","0.003","12.966","0.004","10.91","0.004","90","","111","0.03","90","","1353","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[bis(piperazine-1,4-diium) [(μ~4~-<i>cyclo</i>-hexaphosphato)dilithium] tetrahydrate]","","- C8 H32 Li2 N4 O22 P6 -","- C8 H32 Li2 N4 O22 P6 -","- C16 H64 Li4 N8 O44 P12 -","2","0.5","PK2476","Ameur, Iness; Abid, Sonia; Al-Deyab, Salem S.; Rzaigui, Mohamed","Poly[bis(piperazine-1,4-diium) [(μ~4~-<i>cyclo</i>-hexaphosphato)dilithium] tetrahydrate]","Acta Crystallographica Section E","2013","69","6","m305","m306","10.1107/S1600536813011756","","","0.56085","AgKα","","0.1142","0.0498","","","0.1081","0.1279","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237979","10.0804","0.0017","10.5784","0.0017","11.1573","0.0018","80.982","0.004","85.152","0.004","80.27","0.004","1156.1","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","(<i>Z</i>)-<i>N</i>-<i>tert</i>-Butyl-2-(4-methoxyanilino)-<i>N</i>'-(4-methoxyphenyl)-2-phenylacetimidamide","","- C26 H31 N3 O2 -","- C26 H31 N3 O2 -","- C52 H62 N6 O4 -","2","1","PK2477","Roberts, Sue A.; Saha, Biswajit; Frett, Brendan; Li, Hong-Yu","(<i>Z</i>)-<i>N</i>-<i>tert</i>-Butyl-2-(4-methoxyanilino)-<i>N</i>'-(4-methoxyphenyl)-2-phenylacetimidamide","Acta Crystallographica Section E","2013","69","6","o902","","10.1107/S1600536813012877","","","0.71073","MoKα","","0.0539","0.0434","","","0.0989","0.1055","","","","","","0.944","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237980","12.9926","0.0005","21.1673","0.0007","11.2622","0.0006","90","","114.274","0.005","90","","2823.5","0.2","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-Benzyl-9-isopropyl-9<i>H</i>-purin-6-amine","","- C15 H17 N5 -","- C15 H17 N5 -","- C120 H136 N40 -","8","2","PK2482","Gergela, David; Rouchal, Michal; Bartoš, Peter; Vícha, Robert","<i>N</i>-Benzyl-9-isopropyl-9<i>H</i>-purin-6-amine","Acta Crystallographica Section E","2013","69","6","o954","o955","10.1107/S1600536813013500","","","0.71073","MoKα","","0.0552","0.0293","","","0.0546","0.0575","","","","","","0.829","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237981","9.3696","0.0002","10.3141","0.0002","11.7579","0.0003","68.665","0.002","78.18","0.002","70.63","0.002","993.9","0.04","100.05","0.1","99.95","0.1","","","","","","","","6","P -1","-P 1","2","","2-[(Dimethylphenylphosphanylidene)azaniumyl]-5-methylbenzenesulfonate benzene monosolvate","","- C21 H24 N O3 P S -","- C21 H24 N O3 P S -","- C42 H48 N2 O6 P2 S2 -","2","1","PK2483","Burns, Christopher T.; Shang, Suisheng; Mashuta, Mark S.","2-[(Dimethylphenylphosphanylidene)azaniumyl]-5-methylbenzenesulfonate benzene monosolvate","Acta Crystallographica Section E","2013","69","6","o964","o965","10.1107/S1600536813013755","","","0.71073","MoKα","","0.0437","0.0408","","","0.0941","0.0957","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237982","8.5437","0.0015","9.2984","0.0018","11.545","0.002","88.592","0.01","74.974","0.009","73.231","0.009","846.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl 3,5-bis[(3-chloropyrazin-2-yl)oxy]benzoate","","- C16 H10 Cl2 N4 O4 -","- C16 H10 Cl2 N4 O4 -","- C32 H20 Cl4 N8 O8 -","2","1","PV2625","Srinivasan, Thothadri; Kalpana, Venkatesan; Rajakumar, Perumal; Velmurugan, Devadasan","Methyl 3,5-bis[(3-chloropyrazin-2-yl)oxy]benzoate","Acta Crystallographica Section E","2013","69","5","o777","","10.1107/S1600536813010465","","","0.71073","MoKα","","0.0438","0.0393","","","0.1175","0.1239","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237983","13.506","0.003","17.675","0.004","14.755","0.003","90","","105.12","0.03","90","","3400.4","1.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[6-(Furan-2-yl)-7-nitro-2,3,4,6,7,8-hexahydro-1<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidin-9-yl](phenyl)methanone","","- C19 H19 N3 O4 -","- C19 H19 N3 O4 -","- C152 H152 N24 O32 -","8","2","PV2626","Zhang, Wen-Feng; Xia, Jian-Hui; Xu, Zhao-Hui; Wang, Li-Ben; Yu, Chu-Yi","[6-(Furan-2-yl)-7-nitro-2,3,4,6,7,8-hexahydro-1<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidin-9-yl](phenyl)methanone","Acta Crystallographica Section E","2013","69","6","o986","","10.1107/S160053681301386X","","","0.71073","MoKα","","0.0819","0.0486","","","0.1145","0.1264","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237984","5.211","0.0003","5.4165","0.0004","18.4544","0.0012","87.232","0.002","83.993","0.006","80.862","0.004","511.18","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-Hydroxy-1-[(morpholin-4-yl)methyl]pyridazin-6(1<i>H</i>)-one","","- C9 H13 N3 O3 -","- C9 H13 N3 O3 -","- C18 H26 N6 O6 -","2","1","PV2627","Santhi, P. R.; Selvanathan, G.; Poongothai, G.; Srinivasan, T.; Velmurugan, D.","3-Hydroxy-1-[(morpholin-4-yl)methyl]pyridazin-6(1<i>H</i>)-one","Acta Crystallographica Section E","2013","69","5","o778","","10.1107/S1600536813010477","","","0.71073","MoKα","","0.0787","0.0508","","","0.1397","0.158","","","","","","1.066","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237985","40.0712","0.0018","5.684","0.0002","18.647","0.0008","90","","92.903","0.002","90","","4241.7","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione","","- C26 H22 Cl F O2 -","- C26 H22 Cl F O2 -","- C208 H176 Cl8 F8 O16 -","8","1","PV2628","Srinivasan, Thothadri; Senthilkumar, Govindaraj; Manikandan, Haridoss; Gopalakrishnan, Mannathusamy; Velmurugan, Devadasan","3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione","Acta Crystallographica Section E","2013","69","5","o816","","10.1107/S1600536813011276","","","0.71073","MoKα","","0.077","0.044","","","0.1071","0.1251","","","","","","1.015","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237986","15.465","0.003","6.3578","0.001","15.634","0.003","90","","103.687","0.005","90","","1493.5","0.5","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Chloro-2-(thiophen-2-yl)-1-[(thiophen-2-yl)methyl]-1<i>H</i>-benzimidazole","","- C16 H11 Cl N2 S2 -","- C16 H11 Cl N2 S2 -","- C64 H44 Cl4 N8 S8 -","4","1","PV2630","Geiger, David K.; Nellist, Michael R.","6-Chloro-2-(thiophen-2-yl)-1-[(thiophen-2-yl)methyl]-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2013","69","5","o807","","10.1107/S1600536813011124","","","0.71073","MoKa","","0.0715","0.0559","","","0.1396","0.1482","","","","","","1.106","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237987","8.846","0.0018","10.742","0.002","10.024","0.002","90","","107.27","0.03","90","","909.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Methyl-<i>N</i>-(1,3-thiazol-2-yl)isoxazole-4-carboxamide","","- C8 H7 N3 O2 S -","- C8 H7 N3 O2 S -","- C32 H28 N12 O8 S4 -","4","1","PV2631","Wang, De-Cai; Sun, Xiang; Su, Peng; Ou-Yang, Ping-Kai","5-Methyl-<i>N</i>-(1,3-thiazol-2-yl)isoxazole-4-carboxamide","Acta Crystallographica Section E","2013","69","6","o853","","10.1107/S1600536813012105","","","0.71073","MoKα","","0.0672","0.0508","","","0.1363","0.1519","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237988","5.2888","0.0002","14.9139","0.0006","20.0275","0.0008","90","","100.867","0.002","90","","1551.37","0.11","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(4-Bromophenyl)-2-oxoethyl naphthalene-1-carboxylate","2-(4-Bromophenyl)-2-oxoethyl naphthalene-1-carboxylate","","- C19 H13 Br O3 -","- C19 H13 Br O3 -","- C76 H52 Br4 O12 -","4","1","QK2054","Garudachari, Bhadrachari; Isloor, Arun M.; Gerber, Thomas; Hosten, Eric; Betz, Richard","2-(4-Bromophenyl)-2-oxoethyl naphthalene-1-carboxylate","Acta Crystallographica Section E","2013","69","5","o649","","10.1107/S160053681300843X","","","0.71073","MoKα","","0.0621","0.034","","","0.0718","0.0804","","","","","","1.019","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237989","6.1423","0.0012","26.065","0.005","7.1289","0.0014","90","","109.07","0.03","90","","1078.7","0.4","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2<i>H</i>-1,3-Benzodioxol-5-yl)ethanone thiosemicarbazone","","- C10 H11 N3 O2 S -","- C10 H11 N3 O2 S -","- C40 H44 N12 O8 S4 -","4","1","QK2055","de Oliveira, Adriano Bof; de Farias, Renan Lira; Näther, Christian; Jess, Inke; Bresolin, Leandro","1-(2<i>H</i>-1,3-Benzodioxol-5-yl)ethanone thiosemicarbazone","Acta Crystallographica Section E","2013","69","5","o644","","10.1107/S1600536813008398","","","0.71073","MoKα","","0.0435","0.0373","","","0.1021","0.1067","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237990","17.425","0.003","4.5225","0.0008","8.6167","0.0016","90","","90","","90","","679","0.2","200","2","200","2","","","","","","","","3","P c a 21","P 2c -2ac","29","3,4-diaminobenzonitrile","3,4-Diaminobenzonitrile","","- C7 H7 N3 -","- C7 H7 N3 -","- C28 H28 N12 -","4","1","QK2056","Geiger, David K.; Parsons, Dylan E.","An orthorhombic polymorph of 3,4-diaminobenzonitrile","Acta Crystallographica Section E","2013","69","5","o658","","10.1107/S1600536813008489","","","0.71073","MoKα","","0.0334","0.0303","","","0.0785","0.0805","","","","","","1.083","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237991","7.9877","0.0001","8.3523","0.0002","10.8908","0.0002","93.146","0.001","94.605","0.001","112.15","0.001","667.93","0.02","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","5-Bromo-2-(2-fluorophenyl)-3-methylsulfinyl-1-benzofuran","","- C15 H10 Br F O2 S -","- C15 H10 Br F O2 S -","- C30 H20 Br2 F2 O4 S2 -","2","1","QK2058","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Bromo-2-(2-fluorophenyl)-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2013","69","5","o784","","10.1107/S1600536813010519","","","0.71073","MoKα","","0.0295","0.0263","","","0.0662","0.0679","","","","","","1.07","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237992","6.056","0.0012","10.963","0.002","18.554","0.004","90","","98.62","0.03","90","","1217.9","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","N,N-dimethyldehydroabietylamine hydrochloride ethanol solvate","1-[(1<i>R</i>,4a<i>S</i>,10a<i>R</i>)-7-isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthren-1-yl]-<i>N</i>,<i>N</i>-dimethylmethanaminium chloride ethanol monosolvate","","- C24 H42 Cl N O -","- C24 H42 Cl N O -","- C48 H84 Cl2 N2 O2 -","2","1","QK2059","Huang, Xiu-Zhi; Rao, Xiao-Ping; Cui, Yan-Jie","<i>N</i>,<i>N</i>-Dimethyldehydroabietylammonium chloride ethanol monosolvate","Acta Crystallographica Section E","2013","69","6","o959","","10.1107/S1600536813013846","","","0.71073","MoKα","","0.1174","0.0735","","","0.1665","0.1897","","","","","","0.991","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237993","13.747","0.002","5.6695","0.0013","14.28","0.003","90","","106.94","0.02","90","","1064.7","0.4","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","2-[3-(4-Bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]-4-phenyl-1,3-thiazole","","- C24 H17 Br F N3 S -","- C24 H17 Br F N3 S -","- C48 H34 Br2 F2 N6 S2 -","2","1","QM2094","Abdel-Wahab, Bakr F.; Mohamed, Hanan A.; Ng, Seik Weng; Tiekink, Edward R. T.","2-[3-(4-Bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]-4-phenyl-1,3-thiazole","Acta Crystallographica Section E","2013","69","5","o735","","10.1107/S1600536813010039","","","0.71073","MoKα","","0.1329","0.052","","","0.0985","0.136","","","","","","0.954","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237994","5.9131","0.0002","9.5826","0.0003","13.3149","0.0004","96.729","0.001","91.533","0.001","94.503","0.001","746.46","0.04","308","2","308","2","","","","","","","","5","P -1","-P 1","2","","3-Benzoyl-1-[4-(methylsulfanyl)phenyl]thiourea","","- C15 H14 N2 O S2 -","- C15 H14 N2 O S2 -","- C30 H28 N4 O2 S4 -","2","1","QM2097","de Castro, Rosane; Macedo, Jr, Fernando C.; Brito, Tiago O.; Fátima, Angelo de; Sabino, José R.","3-Benzoyl-1-[4-(methylsulfanyl)phenyl]thiourea","Acta Crystallographica Section E","2013","69","6","o923","","10.1107/S1600536813013159","","","0.71073","MoKα","","0.0389","0.0342","","","","0.0989","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237995","6.4164","0.0002","10.8091","0.0003","19.1335","0.0006","96.843","0.003","92.018","0.003","93.901","0.003","1313.25","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(1-Amino-4-<i>tert</i>-butylcyclohexyl)acetic acid hemihydrate","","- C12 H24 N O2.5 -","- C12 H24 N O2.5 -","- C48 H96 N4 O10 -","4","2","QM2098","Ahmad Wani, Naiem; Gupta, Vivek K.; Kant, Rajni; Aravinda, Subrayashastry; Rai, Rajkishor","2-(1-Amino-4-<i>tert</i>-butylcyclohexyl)acetic acid (tBu-β^3,3^-Ac~6~c) hemihydrate","Acta Crystallographica Section E","2013","69","6","o888","","10.1107/S1600536813012725","","","0.71073","MoKα","","0.0941","0.0533","","","0.1213","0.141","","","","","","1.015","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2237996","5.659","0.0007","9.8279","0.0012","14.6732","0.0018","95.258","0.002","95.263","0.002","98.888","0.002","798.21","0.17","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>,<i>N</i>'-(Propane-1,3-diyl)bis(2-aminobenzamide)","","- C17 H20 N4 O2 -","- C17 H20 N4 O2 -","- C34 H40 N8 O4 -","2","1","RK2394","Sreedasyam, Jagannatha Swamy; Sunkari, Jyothi; Kundha, Shashank; Gundapaneni, Raghava Rao","<i>N</i>,<i>N</i>'-(Propane-1,3-diyl)bis(2-aminobenzamide)","Acta Crystallographica Section E","2013","69","5","o673","","10.1107/S160053681300888X","","","0.71073","MoKα","","0.0565","0.0466","","","0.1164","0.1239","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237997","10.0183","0.0004","12.7374","0.0005","13.2489","0.0005","114.365","0.002","96.96","0.002","92.281","0.002","1521.17","0.11","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","1'-(1,3-Diphenyl-1<i>H</i>-pyrazol-4-yl)-2',3',5',6',7',7a'-hexahydro-1'<i>H</i>-dispiro[acenaphthylene-1,3'-pyrrolizine-2',3''-chromane]-2,4''(1<i>H</i>)-dione","","- C41 H31 N3 O3 -","- C41 H31 N3 O3 -","- C82 H62 N6 O6 -","2","1","RK2396","Jagadeesan, G.; Kathirvelan, D.; Haribabu, J.; Reddy, B. S. R.; Sethusankar, K.","1'-(1,3-Diphenyl-1<i>H</i>-pyrazol-4-yl)-2',3',5',6',7',7a'-hexahydro-1'<i>H</i>-dispiro[acenaphthylene-1,3'-pyrrolizine-2',3''-chromane]-2,4''(1<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","5","o711","","10.1107/S1600536813009562","","","0.71073","MoKα","","0.1144","0.0546","","","0.1291","0.1655","","","","","","1.005","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237998","5.8438","0.0002","18.5756","0.0007","12.2148","0.0005","90","","95.116","0.001","90","","1320.66","0.09","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>rac</i>-(1<i>S</i>*,4a<i>S</i>*,8a<i>S</i>*)-4a-Hydroxy-2-methylperhydrospiro[isoquinoline-4,1'-cyclohexan]-2'-one","","- C15 H25 N O2 -","- C15 H25 N O2 -","- C60 H100 N4 O8 -","4","1","RK2397","Siaka, Sorho; Soldatenkov, Anatoly T.; Malkova, Anastasia V.; Soldatova, Svetlana A.; Khrustalev, Victor N.","<i>rac</i>-(1<i>S</i>*,4a<i>S</i>*,8a<i>S</i>*)-4a-Hydroxy-2-methylperhydrospiro[isoquinoline-4,1'-cyclohexan]-2'-one","Acta Crystallographica Section E","2013","69","5","o628","","10.1107/S1600536813007010","","","0.71073","MoKα","","0.0461","0.0368","","","0.0968","0.1015","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237999","8.0063","0.0006","10.6688","0.0008","20.3796","0.0015","90","","97.458","0.001","90","","1726.1","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Fluorobenzoyl)-3-phenyl-3,4-dihydronaphthalen-1(2<i>H</i>)-one","","- C23 H17 F O2 -","- C23 H17 F O2 -","- C92 H68 F4 O8 -","4","1","RK2398","Zhang, Hao; Hu, Yi-Min","4-(4-Fluorobenzoyl)-3-phenyl-3,4-dihydronaphthalen-1(2<i>H</i>)-one","Acta Crystallographica Section E","2013","69","5","o678","","10.1107/S1600536813008829","","","0.71073","MoKα","","0.0551","0.0436","","","0.1084","0.1171","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238000","13.939","0.005","12.37","0.005","15.321","0.005","90","","90.646","0.005","90","","2641.6","1.7","295","2","295","2","","","","","","","","4","C 1 2 1","C 2y","5","","Bis(2,3-dimethoxy-10-oxostrychnidinium) phthalate nonahydrate","","- C54 H76 N4 O21 -","- C54 H76 N4 O21 -","- C108 H152 N8 O42 -","2","0.5","RK2399","Krishnan, P.; Gayathri, K.; Sivakumar, N.; Gunasekaran, B.; Anbalagan, G.","Bis(2,3-dimethoxy-10-oxostrychnidinium) phthalate nonahydrate","Acta Crystallographica Section E","2013","69","6","o870","","10.1107/S160053681301204X","","","0.71073","MoKα","","0.0701","0.0488","","","0.1119","0.1251","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238001","7.8033","0.0006","25.524","0.002","9.9776","0.0005","90","","128.671","0.004","90","","1551.5","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","12-Dimethylamino-2,2-difluoro-8-phenyl-1λ^5^,3-diaza-2λ^4^-boratricyclo[7.3.0.0^3,7^]dodeca-1(12),4,6,8,10-pentaen-1-ylium","","- C17 H16 B F2 N3 -","- C17 H16 B F2 N3 -","- C68 H64 B4 F8 N12 -","4","1","RK2400","Wang, Zhao-Yun","12-Dimethylamino-2,2-difluoro-8-phenyl-1λ^5^,3-diaza-2λ^4^-boratricyclo[7.3.0.0^3,7^]dodeca-1(12),4,6,8,10-pentaen-1-ylium","Acta Crystallographica Section E","2013","69","5","o781","","10.1107/S1600536813010404","","","0.71073","MoKα","","0.0563","0.041","","","0.1078","0.1193","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238002","8.1406","0.0002","8.7328","0.0002","21.4351","0.0005","90","","95.97","0.001","90","","1515.56","0.06","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5,5'-(Ethyne-1,2-diyl)diisophthalic acid dimethyl sulfoxide tetrasolvate","","- C26 H34 O12 S4 -","- C26 H34 O12 S4 -","- C52 H68 O24 S8 -","2","0.5","RK2402","Münch, Alexander S.; Katzsch, Felix; Weber, Edwin; Mertens, Florian O. R. L.","5,5'-(Ethyne-1,2-diyl)diisophthalic acid dimethyl sulfoxide tetrasolvate","Acta Crystallographica Section E","2013","69","6","o908","o909","10.1107/S1600536813013068","","","0.71073","MoKα","","0.0244","0.0235","","","0.0584","0.0589","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238003","5.5649","0.0008","7.929","0.001","21.778","0.004","86.26","0.012","83.596","0.012","70.739","0.01","901.1","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","2-{[3-Chloro-4-(4-chlorophenoxy)phenyl]iminomethyl}-4-nitrophenol","","- C19 H12 Cl2 N2 O4 -","- C19 H12 Cl2 N2 O4 -","- C38 H24 Cl4 N4 O8 -","2","1","RN2114","Karadayı, Nevzat; Köysal, Yavuz; Şahin, Songül; Coşkun, Emine; Büyükgüngör, Orhan","2-{[3-Chloro-4-(4-chlorophenoxy)phenyl]iminomethyl}-4-nitrophenol","Acta Crystallographica Section E","2013","69","6","o889","","10.1107/S1600536813012518","","","0.71073","MoKα","","0.1526","0.0677","","","0.144","0.1863","","","","","","1.047","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238004","9.3664","0.0001","9.3664","0.0001","16.2981","0.0002","90","","90","","120","","1238.26","0.02","100","2","100","2","","","","","","","","4","P -3 1 c","-P 3 2c","163","","Trisodium potassium dodecamolybdenum tetradecasulfide","","- K Mo12 Na2.9 S14 -","- K Mo12 Na2.9 S14 -","- K2 Mo24 Na5.8 S28 -","2","0.166667","RU2051","Gougeon, Patrick; Gall, Philippe; Salloum, Diala","Na~2.9~KMo~12~S~14~: a novel quaternary reduced molybdenum sulfide containing Mo~12~ clusters with a channel structure","Acta Crystallographica Section E","2013","69","6","i38","","10.1107/S1600536813013603","","","0.71069","MoKα","","0.0306","0.0273","","","0.0695","0.0725","","","","","","1.132","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238005","7.8592","0.0018","21.243","0.005","13.941","0.003","90","","105.141","0.003","90","","2246.7","0.9","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,8-bis(4-fluorobenzoyl)-2,7-diethoxynaphthalene","[2,7-Diethoxy-8-(4-fluorobenzoyl)naphthalen-1-yl](4-fluorophenyl)methanone","","- C28 H22 F2 O4 -","- C28 H22 F2 O4 -","- C112 H88 F8 O16 -","4","1","RZ5052","Mouri, Saki; Hijikata, Daichi; Isozaki, Katsuhiro; Yonezawa, Noriyuki; Okamoto, Akiko","[2,7-Diethoxy-8-(4-fluorobenzoyl)naphthalen-1-yl](4-fluorophenyl)methanone","Acta Crystallographica Section E","2013","69","5","o637","","10.1107/S1600536813008295","","","0.7107","MoKα","","0.0411","0.0364","","","0.1022","0.1078","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238006","27.251","0.004","7.4457","0.0006","11.99","0.009","90","","90","","90","","2432.8","1.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(4-Methylphenyl)-6-nitro-1,3-benzoxazole","","- C14 H10 N2 O3 -","- C14 H10 N2 O3 -","- C112 H80 N16 O24 -","8","1","RZ5053","Centore, Roberto; Piccialli, Vincenzo; Tuzi, Angela","2-(4-Methylphenyl)-6-nitro-1,3-benzoxazole","Acta Crystallographica Section E","2013","69","5","o667","o668","10.1107/S1600536813008970","","","0.71073","Mokα","","0.1687","0.0554","","","0.1378","0.1675","","","","","","1.113","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238007","9.6314","0.0005","16.6596","0.0009","10.0749","0.0005","90","","98.097","0.003","90","","1600.46","0.14","296","2","296","2","","","","","","","","4","C 1 c 1","C -2yc","9","","3-[2-(3-Phenyl-2-oxo-1,2-dihydroquinoxalin-1-yl)ethyl]-1,3-oxazolidin-2-one","","- C19 H17 N3 O3 -","- C19 H17 N3 O3 -","- C76 H68 N12 O12 -","4","1","RZ5054","Daouda, Ballo; Doumbia, Mouhamadou Lamine; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen","3-[2-(3-Phenyl-2-oxo-1,2-dihydroquinoxalin-1-yl)ethyl]-1,3-oxazolidin-2-one","Acta Crystallographica Section E","2013","69","5","o662","","10.1107/S1600536813008702","","","0.71073","MoKα","","0.0459","0.038","","","0.0925","0.0973","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238008","4.6311","0.001","16.596","0.004","15.897","0.003","90","","98.321","0.004","90","","1208.9","0.5","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Isopropyl 3-phenylisoxazole-5-carboxylate","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C52 H52 N4 O12 -","4","1","RZ5055","Wang, Li; Liu, Xue-Ying; Li, Zheng-Wei; Zhang, Sheng-Yong","Isopropyl 3-phenylisoxazole-5-carboxylate","Acta Crystallographica Section E","2013","69","5","o733","","10.1107/S1600536813009392","","","0.71073","MoKα","","0.0688","0.0458","","","0.1112","0.1259","","","","","","1.025","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238009","6.5993","0.0002","12.6166","0.0004","13.8702","0.0005","90","","100.131","0.002","90","","1136.84","0.06","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-Chloro-5-methyl-2-phenylpyrazolo[1,5-<i>a</i>]pyrimidine","","- C13 H10 Cl N3 -","- C13 H10 Cl N3 -","- C52 H40 Cl4 N12 -","4","1","RZ5056","Bassoude, Ibtissam; Berteina-Raboin, Sabine; Essassi, El Mokhtar; Guillaumet, Gérald; El Ammari, Lahcen","7-Chloro-5-methyl-2-phenylpyrazolo[1,5-<i>a</i>]pyrimidine","Acta Crystallographica Section E","2013","69","5","o749","","10.1107/S1600536813009896","","","0.71073","MoKα","","0.0412","0.0346","","","0.0974","0.1029","","","","","","1.062","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238010","8.0542","0.0008","16.4104","0.0019","21.635","0.002","90","","90","","90","","2859.6","0.5","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ethyl 7-methyl-2-phenylpyrazolo[1,5-<i>a</i>]pyrimidine-5-carboxylate","","- C16 H15 N3 O2 -","- C16 H15 N3 O2 -","- C128 H120 N24 O16 -","8","1","RZ5057","Bassoude, Ibtissam; Berteina-Raboin, Sabine; Essassi, El Mokhtar; Guillaumet, Gérald; El Ammari, Lahcen","Ethyl 7-methyl-2-phenylpyrazolo[1,5-<i>a</i>]pyrimidine-5-carboxylate","Acta Crystallographica Section E","2013","69","5","o740","","10.1107/S1600536813009902","","","0.71073","MoKα","","0.0801","0.052","","","0.1475","0.1697","","","","","","1.039","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238011","6.686","0.0002","23.3658","0.0007","24.3281","0.0008","90","","90","","90","","3800.6","0.2","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","<i>catena</i>-Poly[[bis(2-methoxyaniline-κ<i>N</i>)cadmium]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]","","- C16 H18 Cd N4 O2 S2 -","- C16 H18 Cd N4 O2 S2 -","- C128 H144 Cd8 N32 O16 S16 -","8","1","RZ5058","Chemli, Rakia; Kamoun, Slaheddine; Roisnel, Thierry","<i>catena</i>-Poly[[bis(2-methoxyaniline-κ<i>N</i>)cadmium]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]","Acta Crystallographica Section E","2013","69","5","m292","m293","10.1107/S1600536813010738","","","0.71073","MoKα","","0.0379","0.0253","","","0.0504","0.055","","","","","","1.023","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238012","9.8102","0.0006","7.2915","0.0004","27.0162","0.0014","90","","92.942","0.003","90","","1929.95","0.19","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(2-Bromo-4-methylphenyl)-2-(5-methyl-2-phenylpyrazolo[1,5-<i>a</i>]pyrimidin-7-yl)acetamide","","- C22 H19 Br N4 O -","- C22 H19 Br N4 O -","- C88 H76 Br4 N16 O4 -","4","1","RZ5060","Bassoude, Ibtissam; Berteina-Raboin, Sabine; Essassi, El Mokhtar; Guillaumet, Gérald; El Ammari, Lahcen","<i>N</i>-(2-Bromo-4-methylphenyl)-2-(5-methyl-2-phenylpyrazolo[1,5-<i>a</i>]pyrimidin-7-yl)acetamide","Acta Crystallographica Section E","2013","69","6","o829","","10.1107/S1600536813011811","","","0.71073","MoKα","","0.089","0.041","","","0.0924","0.1065","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238013","18.6882","0.0011","10.742","0.0006","6.3186","0.0004","90","","90","","90","","1268.45","0.13","100","","100","0.1","","","","","","","","4","P n a 21","P 2c -2n","33","(<i>E</i>)-4-Ethoxy-4'-hydroxy-aza-stilbene","4-[(<i>E</i>)-(4-Ethoxybenzylidene)amino]phenol","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C60 H60 N4 O8 -","4","1","RZ5061","Kaewmanee, Narissara; Chantrapromma, Suchada; Boonnak, Nawong; Fun, Hoong-Kun","4-[(<i>E</i>)-(4-Ethoxybenzylidene)amino]phenol","Acta Crystallographica Section E","2013","69","6","o903","o904","10.1107/S1600536813012580","","","0.71073","MoKα","","0.0312","0.0301","","","0.0831","0.0859","","","","","","1.101","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238014","19.7213","0.0002","6.4245","0.0002","6.7197","0.0006","90","","90","","90","","851.38","0.08","295","","295","","","","","","","","","4","P n m a","-P 2ac 2n","62","","3-Amino-5,6-dimethyl-1,2,4-triazin-2-ium nitrate","","- C5 H9 N5 O3 -","- C5 H9 N5 O3 -","- C20 H36 N20 O12 -","4","0.5","RZ5062","Bel Haj Salah, Souhir; Mrad, Mohamed Lahbib; Ferretti, Valeria; Lefebvre, Frederic; Ben Nasr, Cherif","3-Amino-5,6-dimethyl-1,2,4-triazin-2-ium nitrate","Acta Crystallographica Section E","2013","69","6","o844","","10.1107/S1600536813012026","","","0.71073","MoKα","","0.0602","0.0487","","","0.1478","0.1605","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238015","14.0516","0.0006","7.7446","0.0003","12.5113","0.0005","90","","113.727","0.001","90","","1246.44","0.09","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Dimethyl 2-(4-methylbenzylidene)malonate","","- C13 H14 O4 -","- C13 H14 O4 -","- C52 H56 O16 -","4","1","RZ5063","Barakat, Assem; Al-Majid, Abdullah Mohammed; Mabkhot, Yahia Nasser; Choudhary, M. Iqbal; Yousuf, Sammer","Dimethyl 2-(4-methylbenzylidene)malonate","Acta Crystallographica Section E","2013","69","6","o919","","10.1107/S1600536813012464","","","0.71073","MoKα","","0.0569","0.0454","","","0.1247","0.136","","","","","","1.084","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238016","6.493","0.0002","29","0.0008","9.2854","0.0004","90","","110.454","0.001","90","","1638.18","0.1","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(1<i>S</i>,3<i>S</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-10,10-Dichloro-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","","- C17 H26 Cl2 -","- C17 H26 Cl2 -","- C68 H104 Cl8 -","4","2","RZ5066","Benharref, Ahmed; Ourhriss, Najia; El Ammari, Lahcen; Saadi, Mohamed; Berraho, Moha","(1<i>S</i>,3<i>S</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-10,10-Dichloro-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","Acta Crystallographica Section E","2013","69","6","o933","o934","10.1107/S1600536813013457","","","0.71073","MoKα","","0.0532","0.0498","","","0.1215","0.1233","","","","","","1.092","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238017","10.217","0.003","7.848","0.003","11.369","0.003","90","","97.316","0.004","90","","904.2","0.5","93","","93","","","","","","","","","4","P 1 21 1","P 2yb","4","","2-Methyl-3-(10<i>H</i>-phenothiazin-10-yl)buta-1,3-diene-1,1,4,4-tetracarbonitrile","","- C21 H11 N5 S -","- C21 H11 N5 S -","- C42 H22 N10 S2 -","2","1","SJ5308","Okuno, Tsunehisa; Iwahashi, Hirokazu","2-Methyl-3-(10<i>H</i>-phenothiazin-10-yl)buta-1,3-diene-1,1,4,4-tetracarbonitrile","Acta Crystallographica Section E","2013","69","5","o665","","10.1107/S1600536813008799","","","0.71075","MoKα","","","0.0317","","","","0.0778","","","","","","1.044","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238018","5.285","0.0007","10.6663","0.0012","16.505","0.002","86.454","0.007","83.424","0.008","89.376","0.007","922.5","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-oxo-3-(3-phthalimidopropyl)-2,3-dihydro-1<i>H</i>-1,3-benzimidazole-1-carboxylate","","- C21 H19 N3 O5 -","- C21 H19 N3 O5 -","- C42 H38 N6 O10 -","2","1","SJ5310","Belaziz, Dounia; Kandri Rodi, Youssef; Kandri Rodi, Adiba; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen","Ethyl 2-oxo-3-(3-phthalimidopropyl)-2,3-dihydro-1<i>H</i>-1,3-benzimidazole-1-carboxylate","Acta Crystallographica Section E","2013","69","5","o641","o642","10.1107/S1600536813008325","","","0.71073","MoKα","","0.0759","0.0509","","","0.1282","0.145","","","","","","1.043","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238019","4.6185","0.0003","7.7741","0.0007","17.1188","0.0012","100.278","0.007","94.25","0.006","105.001","0.007","579.47","0.08","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","2-(3,4-Dichlorophenyl)-<i>N</i>-(1,3-thiazol-2-yl)acetamide","","- C11 H8 Cl2 N2 O S -","- C11 H8 Cl2 N2 O S -","- C22 H16 Cl4 N4 O2 S2 -","2","1","SJ5311","Nayak, Prakash S.; Narayana, B.; Yathirajan, H. S.; Jasinski, Jerry P.; Butcher, Ray J.","2-(3,4-Dichlorophenyl)-<i>N</i>-(1,3-thiazol-2-yl)acetamide","Acta Crystallographica Section E","2013","69","5","o645","o646","10.1107/S1600536813008374","","","0.71073","MoKα","","0.0948","0.0473","","","0.1084","0.1179","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238020","9.2543","0.0004","18.1387","0.0007","12.5147","0.0005","90","","105.026","0.002","90","","2028.9","0.14","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 5''-chloro-1',1''-dimethyl-2,2''-dioxodispiro[indoline-3,2'-pyrrolidine-3',3''-indoline]-4'-carboxylate","","- C22 H20 Cl N3 O4 -","- C22 H20 Cl N3 O4 -","- C88 H80 Cl4 N12 O16 -","4","1","SJ5312","Kannan, Piskala Subburaman; Yuvaraj, PanneerSelvam; Manivannan, Karthikeyan; Reddy, Boreddy Siva Rami; SubbiahPandi, Arunachalathevar","Methyl 5''-chloro-1',1''-dimethyl-2,2''-dioxodispiro[indoline-3,2'-pyrrolidine-3',3''-indoline]-4'-carboxylate","Acta Crystallographica Section E","2013","69","6","o825","o826","10.1107/S1600536813011501","","","0.71073","MoKα","","0.0598","0.0414","","","0.1098","0.1249","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238021","7.7748","0.0003","11.1557","0.0005","12.1205","0.0005","110.738","0.004","97.688","0.004","104.331","0.005","923.67","0.08","173","1","173","1","","","","","","","","7","P -1","-P 1","2","","<i>trans</i>-Dichloridotetrakis[(dimethylphosphoryl)methanaminium-κ<i>O</i>]cobalt(II) bis[tetrachloridocobaltate(II)]","","- C12 H44 Cl10 Co3 N4 O4 P4 -","- C12 H44 Cl10 Co3 N4 O4 P4 -","- C12 H44 Cl10 Co3 N4 O4 P4 -","1","0.5","SJ5313","Reiss, Guido J.","<i>trans</i>-Dichloridotetrakis[(dimethylphosphoryl)methanaminium-κ<i>O</i>]cobalt(II) tetrachloridocobaltate(II)","Acta Crystallographica Section E","2013","69","5","m248","m249","10.1107/S1600536813008945","","","0.71073","MoKα","","0.0211","0.0183","","","0.0405","0.0416","","","","","","1.094","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238022","9.5061","0.0006","11.2152","0.0007","12.7752","0.0007","90","","101.823","0.004","90","","1333.11","0.14","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-[4-Acetyl-5-(4-fluorophenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide","","- C12 H12 F N3 O2 S -","- C12 H12 F N3 O2 S -","- C48 H48 F4 N12 O8 S4 -","4","1","SJ5314","Kavitha, H. D.; Marganakop, Sheetal B.; Kamble, Ravindra R.; Roopashree, K. R.; Devarajegowda, H. C.","<i>N</i>-[4-Acetyl-5-(4-fluorophenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide","Acta Crystallographica Section E","2013","69","5","o701","o702","10.1107/S1600536813009367","","","0.71073","MoKα","","0.0466","0.0407","","","0.1175","0.1214","","","","","","1.068","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238023","7.678","0.005","9.612","0.005","10.86","0.005","77.208","0.005","74.117","0.004","81.522","0.005","748.5","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-(4-Methoxybenzyl)-1,5-benzothiazepin-4(5<i>H</i>)-one","","- C17 H15 N O2 S -","- C17 H15 N O2 S -","- C34 H30 N2 O4 S2 -","2","1","SJ5315","Selvakumar, R.; Bakthadoss, M.; Vijayakumar, S.; Murugavel, S.","3-(4-Methoxybenzyl)-1,5-benzothiazepin-4(5<i>H</i>)-one","Acta Crystallographica Section E","2013","69","5","o693","","10.1107/S1600536813009215","","","0.71073","MoKα","","0.0725","0.045","","","0.1175","0.1339","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238024","10.6095","0.0005","12.387","0.0004","14.6878","0.0004","101.376","0.003","93.421","0.003","101.996","0.003","1840.79","0.12","99.95","0.1","99.95","0.1","","","","","","","","6","P 1","P 1","1","","(</i>S</i>)-α-Benzylprolinium <i>cis</i>-[(</i>S</i>)-α-benzylprolinato]dichloridopalladium(II)","","- C24 H30 Cl2 N2 O4 Pd -","- C24 H30 Cl2 N2 O4 Pd -","- C72 H90 Cl6 N6 O12 Pd3 -","3","3","SJ5316","Hobart, Jr, David B.; Merola, Joseph S.","(<i>S</i>)-α-Benzylprolinium <i>cis</i>-[(<i>S</i>)-α-benzylprolinato]dichloridopalladium(II)","Acta Crystallographica Section E","2013","69","5","m261","m262","10.1107/S1600536813009525","","","0.71073","MoKα","","0.047","0.0388","","","0.0779","0.0823","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238025","10.045","0.002","10.393","0.002","11.028","0.002","99.42","0.03","101.97","0.03","98.56","0.03","1091","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ^2^<i>O</i>,<i>O</i>')nickel(II) 2.5-hydrate","","- C20 H21 N4 Ni O6.5 S -","- C20 H21 N4 Ni O6.5 S -","- C40 H42 N8 Ni2 O13 S2 -","2","1","SJ5321","Iskenderov, Turganbay","Bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ^2^<i>O</i>,<i>O</i>')nickel(II) 2.5-hydrate","Acta Crystallographica Section E","2013","69","6","m347","m348","10.1107/S1600536813014219","","","0.71073","MoKα","","0.0561","0.0423","","","0.1157","0.1242","","","","","","1.07","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238026","9.9587","0.0003","10.5458","0.0003","11.0885","0.0003","100.887","0.001","105.891","0.001","107.889","0.001","1017.38","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(Adipato-κ^2^<i>O</i>,<i>O</i>')diaqua[bis(pyridin-2-yl-κ<i>N</i>)amine]cobalt(II) trihydrate","","- C16 H27 Co N3 O9 -","- C16 H27 Co N3 O9 -","- C32 H54 Co2 N6 O18 -","2","1","SJ5322","Setifi, Zouaoui; Setifi, Fatima; Smith, Graham; El-Ghozzi, Malika; Rouag, Djamil-Azzeddine; Avignant, Daniel; Merazig, Hocine","(Adipato-κ^2^<i>O</i>,<i>O</i>')diaqua[bis(pyridin-2-yl-κ<i>N</i>)amine]cobalt(II) trihydrate","Acta Crystallographica Section E","2013","69","6","m335","m336","10.1107/S1600536813012981","","","0.71073","MoKα","","0.0388","0.0298","","","0.0894","0.0973","","","","","","0.993","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238027","4.8935","0.0005","5.8995","0.0006","42.572","0.004","90","","90","","90","","1229","0.2","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2-(4-Chlorophenyl)-<i>N</i>-(3,4-difluorophenyl)acetamide","","- C14 H10 Cl F2 N O -","- C14 H10 Cl F2 N O -","- C56 H40 Cl4 F8 N4 O4 -","4","1","SJ5323","Praveen, A. S.; Yathirajan, H. S.; Jasinski, Jerry P.; Keeley, Amanda C.; Narayana, B.; Sarojini, B. K.","2-(4-Chlorophenyl)-<i>N</i>-(3,4-difluorophenyl)acetamide","Acta Crystallographica Section E","2013","69","6","o996","o997","10.1107/S1600536813014165","","","1.5418","CuKα","","0.0444","0.0423","","","0.11","0.1109","","","","","","1.144","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238028","7.15","0.0003","8.377","0.0003","11.089","0.0005","74.748","0.0014","79.309","0.0014","86.286","0.003","629.58","0.05","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","2-({1-[2-(Methylsulfanyl)phenyl]-1<i>H</i>-tetrazol-5-yl}sulfanyl)acetic acid","","- C10 H10 N4 O2 S2 -","- C10 H10 N4 O2 S2 -","- C20 H20 N8 O4 S4 -","2","1","SU2571","Mafud, Ana C.; Mascarenhas, Yvonne P.; Nascimento, Alessandro S.","2-({1-[2-(Methylsulfanyl)phenyl]-1<i>H</i>-tetrazol-5-yl}sulfanyl)acetic acid","Acta Crystallographica Section E","2013","69","5","o759","","10.1107/S160053681300980X","","","0.71073","MoKα","","","0.0511","","","","0.15","","","","","","1.044","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238029","9.716","0.004","10.69","0.004","27.017","0.01","90","","92.317","0.004","90","","2803.8","1.9","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","<i>N</i>,<i>N</i>-Diphenyl-4-{3,11,14-triazatetracyclo[11.4.0.0^2,6^.0^7,12^]heptadeca-1(13),2(6),4,7(12),8,10,14,16-octaen-4-yl}aniline","<i>N</i>,<i>N</i>-Diphenyl-4-(1<i>H</i>-pyrrolo[1,2-<i>f</i>][1,10]phenanthrolin-2-yl)aniline ethanol monosolvate","","- C34 H27 N4 O -","- C34 H27 N4 O -","- C136 H108 N16 O4 -","4","1","SU2573","Luo, Jun-Shan; Zhang, Yan-Yan; Liu, Zhao-Di; Tian, Yu-Peng","<i>N</i>,<i>N</i>-Diphenyl-4-(1<i>H</i>-pyrrolo[1,2-<i>f</i>][1,10]phenanthrolin-2-yl)aniline ethanol monosolvate","Acta Crystallographica Section E","2013","69","5","o675","o676","10.1107/S1600536813008477","","","0.71073","MoKα","","0.0837","0.0646","","","0.186","0.2099","","","","","","1.019","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238030","10.7611","0.0005","14.3742","0.0007","11.6657","0.0006","90","","110.107","0.003","90","","1694.5","0.15","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(1<i>S</i>,3'<i>S</i>,3a'<i>R</i>,6'<i>S</i>)-6'-(2-Chlorophenyl)-3'-[(2<i>R</i>,3<i>S</i>)-1-(4-methoxyphenyl)-4-oxo-3-phenylazetidin-2-yl]-2-oxo-3',3'a,4',6'-tetrahydro-2<i>H</i>,2'<i>H</i>-spiro[acenaphthylene-1,1'-pyrrolo[1,2-<i>c</i>][1,3]thiazole]-2',2'-dicarbonitrile","","- C41 H29 Cl N4 O3 S -","- C41 H29 Cl N4 O3 S -","- C82 H58 Cl2 N8 O6 S2 -","2","1","SU2576","Devi, Seenivasan Karthiga; Srinivasan, Thothadri; Rajesh, Raju; Raghunathan, Raghavachary; Velmurugan, Devadasan","(1<i>S</i>,3'<i>S</i>,3a'<i>R</i>,6'<i>S</i>)-6'-(2-Chlorophenyl)-3'-[(2<i>R</i>,3<i>S</i>)-1-(4-methoxyphenyl)-4-oxo-3-phenylazetidin-2-yl]-2-oxo-3',3'a,4',6'-tetrahydro-2<i>H</i>,2'<i>H</i>-spiro[acenaphthylene-1,1'-pyrrolo[1,2-<i>c</i>][1,3]thiazole]-2',2'-dicarbonitrile","Acta Crystallographica Section E","2013","69","5","o750","o751","10.1107/S1600536813009276","","","0.71073","MoKα","","0.0768","0.0446","","","0.0979","0.1139","","","","","","0.998","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238031","12.945","0.009","7.857","0.005","14.497","0.01","90","","113.384","0.008","90","","1353.4","1.6","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>N</i>-[(<i>E</i>)-4-Bromobenzylidene]-2,3-dimethylaniline","","- C15 H14 Br N -","- C15 H14 Br N -","- C60 H56 Br4 N4 -","4","1","SU2578","Sun, Li-Xia; Zhu, Ling-Zhi; Wang, Jun-Kai","<i>N</i>-[(<i>E</i>)-4-Bromobenzylidene]-2,3-dimethylaniline","Acta Crystallographica Section E","2013","69","5","o630","","10.1107/S1600536813008088","","","0.71073","MoKα","","0.1321","0.0424","","","0.0843","0.1118","","","","","","0.939","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238032","14.868","0.007","6.161","0.003","28.609","0.013","90","","90","","90","","2621","2","296","2","296","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","<i>N</i>-[(<i>E</i>)-4-Bromobenzylidene]-3,4-dimethylaniline","","- C15 H14 Br N -","- C15 H14 Br N -","- C120 H112 Br8 N8 -","8","1","SU2579","Sun, Li-Xia; Zhu, Ling-Zhi; Wang, Jun-Kai","<i>N</i>-[(<i>E</i>)-4-Bromobenzylidene]-3,4-dimethylaniline","Acta Crystallographica Section E","2013","69","5","o631","","10.1107/S1600536813008143","","","0.71073","MoKα","","0.1124","0.0577","","","0.125","0.1483","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238033","15.1203","0.0003","21.1088","0.0005","15.6334","0.0003","90","","112.977","0.001","90","","4593.86","0.17","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Methyl (3<i>S</i>,10b'<i>S</i>)-5-chloro-9'-fluoro-1-methyl-2-oxo-5'-phenyl-10b'<i>H</i>-spiro[indoline-3,1'-pyrazolo[3,2-<i>a</i>]isoquinoline]-2'-carboxylate","","- C27 H19 Cl F N3 O3 -","- C27 H19 Cl F N3 O3 -","- C216 H152 Cl8 F8 N24 O24 -","8","1","SU2581","Kannan, Piskala Subburaman; Yuvaraj, PanneerSelvam; Reddy, Boreddy Siva Rami; Raja, Rajamani; SubbiahPandi, Arunachalathevar","Methyl (3<i>S</i>,10b'<i>S</i>)-5-chloro-9'-fluoro-1-methyl-2-oxo-5'-phenyl-10b'<i>H</i>-spiro[indoline-3,1'-pyrazolo[3,2-<i>a</i>]isoquinoline]-2'-carboxylate","Acta Crystallographica Section E","2013","69","6","o823","o824","10.1107/S1600536813011549","","","0.71073","MoKα","","0.0597","0.0413","","","0.1073","0.1232","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238034","19.1388","0.0007","10.7716","0.0004","10.0707","0.0003","90","","104.668","0.002","90","","2008.47","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-5-nitropyridinium trifluoroacetate","","- C14 H12 F6 N6 O8 -","- C14 H12 F6 N6 O8 -","- C56 H48 F24 N24 O32 -","4","1","SU2582","Jovita, Josephine Viavulamary; Sathya, Shanmugam; Usha, Govindasamy; Vasanthi, Ramachandran; Ezhilarasi, Krishnan Sarada","2-Amino-5-nitropyridinium trifluoroacetate","Acta Crystallographica Section E","2013","69","6","o841","o842","10.1107/S1600536813011896","","","0.71073","MoKα","","0.0605","0.0418","","","0.1052","0.1175","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238035","15.489","0.005","16.422","0.005","11.684","0.005","90","","110.646","0.005","90","","2781.1","1.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(<i>Z</i>)-3-(2-Aminoanilino)-1-phenylbut-2-en-1-one","","- C16 H16 N2 O -","- C16 H16 N2 O -","- C128 H128 N16 O8 -","8","1","SU2583","Karthikeyan, Subramani; Srinivasan, Thothadri; Sundaravadivel, Elumalai; Kandaswamy, Muthusamy; Velmurugan, Devadasan","(<i>Z</i>)-3-(2-Aminoanilino)-1-phenylbut-2-en-1-one","Acta Crystallographica Section E","2013","69","5","o780","","10.1107/S160053681301060X","","","0.71073","MoKα","","0.074","0.0498","","","0.1337","0.1522","","","","","","1.009","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238036","17.188","0.0011","4.1124","0.0003","19.6699","0.0013","90","","106.289","0.004","90","","1334.54","0.16","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-3-[4-(Difluoromethoxy)-3-hydroxyphenyl]-1-phenylprop-2-en-1-one","","- C16 H12 F2 O3 -","- C16 H12 F2 O3 -","- C64 H48 F8 O12 -","4","1","SU2584","Srinivasan, Thothadri; Senthilkumar, Govindaraj; Neelakandan, Kaliaperumal; Manikandan, Haridoss; Velmurugan, Devadasan","(<i>E</i>)-3-[4-(Difluoromethoxy)-3-hydroxyphenyl]-1-phenylprop-2-en-1-one","Acta Crystallographica Section E","2013","69","5","o812","","10.1107/S1600536813011288","","","0.71073","MoKα","","0.0588","0.0413","","","0.1063","0.1204","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238037","9.769","0.0007","10.425","0.0007","14.283","0.001","96.626","0.002","91.903","0.002","91.164","0.002","1443.67","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-(2<i>H</i>-1,3-Benzodioxol-5-yl)-1-(4-methylphenyl)-1<i>H</i>-pyrazol-5-amine","","- C17 H15 N3 O2 -","- C17 H15 N3 O2 -","- C68 H60 N12 O8 -","4","2","SU2585","Gajera, Nilesh N.; Patel, Mukesh C.; Jotani, Mukesh M.; Tiekink, Edward R. T.","4-(2<i>H</i>-1,3-Benzodioxol-5-yl)-1-(4-methylphenyl)-1<i>H</i>-pyrazol-5-amine","Acta Crystallographica Section E","2013","69","5","o736","o737","10.1107/S1600536813009914","","","0.71069","MoKα","","0.0686","0.0448","","","0.1183","0.1358","","","","","","1.015","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238038","14.429","0.003","10.162","0.002","8.3313","0.0018","90","","90","","90","","1221.6","0.4","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","8,15-Dioxa-10,13-diazatetracyclo[14.4.0.0^2,7^.0^9,14^]icosa-1(16),2,4,6,9(14),10,12,17,19-nonaene","","- C16 H10 N2 O2 -","- C16 H10 N2 O2 -","- C64 H40 N8 O8 -","4","0.5","SU2586","Srinivasan, Thothadri; Kalpana, Venkatesan; Rajakumar, Perumal; Velmurugan, Devadasan","8,15-Dioxa-10,13-diazatetracyclo[14.4.0.0^2,7^.0^9,14^]icosa-1(16),2,4,6,9(14),10,12,17,19-nonaene","Acta Crystallographica Section E","2013","69","5","o813","o814","10.1107/S1600536813011318","","","0.71073","MoKα","","0.0411","0.0325","","","0.0972","0.1058","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238039","3.9207","0.0002","14.9355","0.0004","18.1494","0.0005","90","","90","","90","","1062.79","0.07","294","2","294","2","","","","","","","","4","P 2 21 21","P 2bc 2","18","9-[<i>N</i>-(carbazol-9-yl)(carbothioyldisulfanyl)carbothioyl]carbazole","9<i>H</i>-Carbazole-9-carbothioic dithioperoxyanhydride","","- C26 H16 N2 S4 -","- C26 H16 N2 S4 -","- C52 H32 N4 S8 -","2","0.5","SU2587","Uludağ, Nesimi; Ateş, Murat; Çaylak Delibaş, Nagihan; Çelik, Ömer; Hökelek, Tuncer","9<i>H</i>-Carbazole-9-carbothioic dithioperoxyanhydride","Acta Crystallographica Section E","2013","69","5","o771","","10.1107/S1600536813010349","","","0.71073","MoKα","","0.1358","0.0718","","","0.1424","0.1564","","","","","","1.41","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238040","20.427","0.0011","13.5433","0.0005","11.4259","0.0005","90","","109.561","0.005","90","","2978.5","0.3","200","1","200","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-[(3,3-Dimethylindolin-2-ylidene)methyl]-4-[(3,3-dimethyl-3<i>H</i>-indol-1-ium-2-yl)methylidene]-3-oxocyclobut-1-en-1-olate chloroform disolvate","","- C28 H26 Cl6 N2 O2 -","- C28 H26 Cl6 N2 O2 -","- C112 H104 Cl24 N8 O8 -","4","0.5","SU2588","Smith, Graham; Lynch, Daniel E.","2-[(3,3-Dimethylindolin-2-ylidene)methyl]-4-[(3,3-dimethyl-3<i>H</i>-indol-1-ium-2-yl)methylidene]-3-oxocyclobut-1-en-1-olate chloroform disolvate","Acta Crystallographica Section E","2013","69","5","o786","o787","10.1107/S1600536813010386","","","0.71073","MoKα","","0.0553","0.0438","","","0.1042","0.1124","","","","","","1.018","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238041","5.27","0.0002","7.3691","0.0003","38.2042","0.0014","90","","90","","90","","1483.67","0.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>L</i>-Histidinium <i>p</i>-toluenesulfonate","","- C13 H17 N3 O5 S -","- C13 H17 N3 O5 S -","- C52 H68 N12 O20 S4 -","4","1","SU2589","Muralidharan, Srinivasan; Nagapandiselvi, Perumal; Srinivasan, Thothadri; Gopalakrishnan, Rengasamy; Velmurugan, Devadasan","<small>L</small>-Histidinium <i>p</i>-toluenesulfonate","Acta Crystallographica Section E","2013","69","5","o804","","10.1107/S1600536813011161","","","0.71073","MoKα","","0.0394","0.0382","","","0.0934","0.094","","","","","","1.195","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238042","12.2049","0.0003","9.8463","0.0002","11.5405","0.0002","90","","107.106","0.001","90","","1325.51","0.05","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-4-methylpyridinium 2-nitrobenzoate","","- C13 H13 N3 O4 -","- C13 H13 N3 O4 -","- C52 H52 N12 O16 -","4","1","SU2590","Muralidharan, Srinivasan; Elavarasu, Narayanan; Srinivasan, Thothadri; Gopalakrishnan, Rengasamy; Velmurugan, Devadasan","2-Amino-4-methylpyridinium 2-nitrobenzoate","Acta Crystallographica Section E","2013","69","6","o910","","10.1107/S1600536813012919","","","0.71073","MoKα","","0.0508","0.0406","","","0.1158","0.1249","","","","","","1.059","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238043","20.958","0.005","12.048","0.003","15.403","0.003","90","","95.483","0.003","90","","3871.5","1.5","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{2-[2,5-bis(pyridin-2-yl)-1<i>H</i>-imidazol-4-yl]pyridinium} tetracyanidoplatinate(II) tetrahydrate","","- C40 H36 N14 O4 Pt -","- C40 H36 N14 O4 Pt -","- C160 H144 N56 O16 Pt4 -","4","0.5","SU2593","Gámez-Heredia, Raquel; Navarro, Rosa E.; Höpfl, Herbert; Cruz-Enríquez, Adriana; Campos-Gaxiola, José J.","Bis{2-[2,5-bis(pyridin-2-yl)-1<i>H</i>-imidazol-4-yl]pyridinium} tetracyanidoplatinate(II) tetrahydrate","Acta Crystallographica Section E","2013","69","6","m300","m301","10.1107/S1600536813011665","","","0.71073","MoKα","","0.0377","0.0318","","","0.077","0.0782","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238044","26.942","0.007","6.3479","0.0017","17.579","0.005","90","","113.985","0.004","90","","2746.8","1.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-(4-Hydroxyphenyl)-2-(2-oxidonaphthalen-1-yl)diazen-1-ium methanol hemisolvate","","- C16.5 H14 N2 O2.5 -","- C16.5 H14 N2 O2.5 -","- C132 H112 N16 O20 -","8","1","SU2594","Benaouida, Mohamed Amine; Chetioui, Souheyla; Bouaoud, Salah Eddine","1-(4-Hydroxyphenyl)-2-(2-oxidonaphthalen-1-yl)diazen-1-ium methanol hemisolvate","Acta Crystallographica Section E","2013","69","6","o867","o868","10.1107/S1600536813012245","","","0.71073","MoKα","","0.1035","0.0524","","","0.128","0.1539","","","","","","1.029","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238045","7.7658","0.0004","11.0901","0.0004","18.8261","0.0008","90","","113.575","0.004","90","","1486.05","0.12","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aquatrimethyl[2-(4-methylpyrimidin-2-ylsulfanyl)acetato-κ<i>O</i>]tin(IV)","","- C10 H18 N2 O3 S Sn -","- C10 H18 N2 O3 S Sn -","- C40 H72 N8 O12 S4 Sn4 -","4","1","SU2595","Gao, Zhiqing; Zhang, Junhong; Hao, Xuyi; Wang, Daqi; Zhang, Tingting","Aquatrimethyl[2-(4-methylpyrimidin-2-ylsulfanyl)acetato-κ<i>O</i>]tin(IV)","Acta Crystallographica Section E","2013","69","6","m313","","10.1107/S1600536813012622","","","1.54184","CuKα","","0.0591","0.047","","","0.1171","0.1318","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238046","9.9858","0.0005","17.883","0.0008","10.2054","0.0004","90","","94.663","0.002","90","","1816.41","0.14","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","8,13,26-Trioxa-23-thia-21-azapentacyclo[18.6.0.0^2,7^.0^14,19^.0^21,25^]hexacosa-2(7),3,5,14,16,18-hexaene","","- C21 H23 N O3 S -","- C21 H23 N O3 S -","- C84 H92 N4 O12 S4 -","4","1","SU2596","Devi, Seenivasan Karthiga; Srinivasan, Thothadri; Purushothaman, Santhanagopalan; Raghunathan, Raghavachary; Velmurugan, Devadasan","8,13,26-Trioxa-23-thia-21-azapentacyclo[18.6.0.0^2,7^.0^14,19^.0^21,25^]hexacosa-2(7),3,5,14,16,18-hexaene","Acta Crystallographica Section E","2013","69","6","o892","","10.1107/S1600536813012804","","","0.71073","MoKα","","0.0738","0.0469","","","0.1312","0.1515","","","","","","1.021","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238047","8.1114","0.0009","10.853","0.0013","18.222","0.002","90","","94.399","0.006","90","","1599.4","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(4-Bromophenyl)-2-methylamino-3-nitro-5,6,7,8-tetrahydro-4<i>H</i>-chromen-5-one","","- C16 H15 Br N2 O4 -","- C15.999 H14.994 Br N2 O4 -","- C63.996 H59.976 Br4 N8 O16 -","4","1","SU2597","Narayanan, P.; Kamalraja, Jayabal; Perumal, Paramasivam T.; Sethusankar, K.","4-(4-Bromophenyl)-2-methylamino-3-nitro-5,6,7,8-tetrahydro-4<i>H</i>-chromen-5-one","Acta Crystallographica Section E","2013","69","6","o931","o932","10.1107/S1600536813012774","","","0.71073","MoKα","","0.079","0.039","","","0.0888","0.1008","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238048","7.8928","0.0003","8.0378","0.0003","11.0889","0.0004","69.72","0.001","75.214","0.001","85.693","0.001","637.96","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","[Hexane-2,5-dione bis(thiosemicarbazonato)]nickel(II)","","- C8 H14 N6 Ni S2 -","- C8 H14 N6 Ni S2 -","- C16 H28 N12 Ni2 S4 -","2","1","SU2598","Shalamzari, Mohammad Safi; Gurbanov, Atash V.; Heidic, Seykens; Kia, Reza; Behrouzi, Shabnam","[Hexane-2,5-dione bis(thiosemicarbazonato)]nickel(II)","Acta Crystallographica Section E","2013","69","6","m322","","10.1107/S1600536813012816","","","0.71073","MoKα","","0.0231","0.0209","","","0.0572","0.0587","","","","","","0.994","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238049","8.1482","0.0004","9.8553","0.0005","11.5265","0.0006","93.218","0.002","99.32","0.003","113.026","0.002","833.31","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>-<i>tert</i>-Butyl-2-(2,6-dichlorophenyl)imidazo[1,2-a]pyrazin-3-amine","","- C16 H16 Cl2 N4 -","- C16 H16 Cl2 N4 -","- C32 H32 Cl4 N8 -","2","1","SU2601","Fatima, Zeenat; Srinivasan, Thothadri; Koorathota, Suman; Thennarasu, Sathiah; Velmurugan, Devadasan","<i>N</i>-<i>tert</i>-Butyl-2-(2,6-dichlorophenyl)imidazo[1,2-a]pyrazin-3-amine","Acta Crystallographica Section E","2013","69","6","o949","o950","10.1107/S1600536813013640","","","0.71073","MoKα","","0.0462","0.0401","","","0.1141","0.1201","","","","","","1.048","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238050","6.606","0.0004","25.7003","0.0013","7.9627","0.0005","90","","107.532","0.007","90","","1289.08","0.14","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","<i>L</i>-Histidinium dipicrate dihydrate","","- C18 H19 N9 O18 -","- C18 H19 N9 O18 -","- C36 H38 N18 O36 -","2","1","SU2602","Sethuram, M.; Rajasekharan, M. V.; Dhandapani, M.; Amirthaganesan, G.; NizamMohideen, M.","<small>L</small>-Histidinium dipicrate dihydrate","Acta Crystallographica Section E","2013","69","6","o957","o958","10.1107/S1600536813013949","","","0.71073","MoKα","","0.0491","0.0392","","","0.082","0.0883","","","","","","1.085","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238051","11.5181","0.0003","8.8191","0.0002","13.5089","0.0003","90","","90.546","0.002","90","","1372.16","0.06","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquabis(3-chlorobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>^1^)cobalt(II)","","- C26 H24 Cl2 Co N4 O8 -","- C26 H24 Cl2 Co N4 O8 -","- C52 H48 Cl4 Co2 N8 O16 -","2","0.5","SU2606","Bozkurt, Nihat; Dilek, Nefise; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","Diaquabis(3-chlorobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>^1^)cobalt(II)","Acta Crystallographica Section E","2013","69","6","m349","m350","10.1107/S160053681301458X","","","0.71073","MoKα","","0.0283","0.0271","","","0.0733","0.0743","","","","","","1.108","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238052","6.1794","0.0006","10.057","0.001","12.5793","0.0012","84.072","0.006","79.738","0.006","85.471","0.006","763.67","0.13","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Bromo-2,7-dimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran","","- C17 H15 Br O2 S -","- C17 H15 Br O2 S -","- C34 H30 Br2 O4 S2 -","2","1","TK5212","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Bromo-2,7-dimethyl-3-(4-methylphenylsulfinyl)-1-benzofuran","Acta Crystallographica Section E","2013","69","5","o720","","10.1107/S1600536813009756","","","0.71073","MoKα","","0.0969","0.0452","","","0.0769","0.089","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238053","28.2896","0.0005","28.2896","0.0005","13.3041","0.0003","90","","90","","120","","9220.8","0.3","296","2","296","2","","","","","","","","6","R -3 :H","-R 3","148","","1-(2,4-Dichlorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine","","- C18 H20 Cl2 N2 O2 S -","- C18 H20 Cl2 N2 O2 S -","- C324 H360 Cl36 N36 O36 S18 -","18","1","TK5213","Sreenivasa, S.; ManojKumar, K. E.; Anitha, H. C.; Suchetan, P. A.; Palakshamurthy, B. S.; Jayashree, Yenagi; Tonannavar, J.","An unknown solvate of 1-(2,4-dichlorobenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine","Acta Crystallographica Section E","2013","69","5","o782","","10.1107/S160053681301012X","","","0.71073","MoKα","","0.0558","0.0382","","","0.1005","0.109","","","","","","0.951","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238054","19.966","0.004","10.355","0.002","15.536","0.003","90","","90","","90","","3212","1.1","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","(<i>Z</i>)-3-(3,4-Dimethoxybenzyl)-1,5-benzothiazepin-4(5<i>H</i>)-one","","- C18 H17 N O3 S -","- C18 H17 N O3 S -","- C144 H136 N8 O24 S8 -","8","1","TK5214","Selvakumar, R.; Bakthadoss, M.; Vijayakumar, S.; Murugavel, S.","(<i>Z</i>)-3-(3,4-Dimethoxybenzyl)-1,5-benzothiazepin-4(5<i>H</i>)-one","Acta Crystallographica Section E","2013","69","5","o708","","10.1107/S1600536813009598","","","0.71073","MoKα","","0.1007","0.0601","","","0.1514","0.1749","","","","","","1.021","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238055","19.343","0.0004","9.46296","0.00016","12.8221","0.0002","90","","94.3231","0.0017","90","","2340.31","0.07","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-Benzylthieno[3,2-<i>d</i>]pyrimidin-4-amine","","- C13 H11 N3 S -","- C13 H11 N3 S -","- C104 H88 N24 S8 -","8","2","TK5215","Štarha, Pavel; Trávníček, Zdeněk","<i>N</i>-Benzylthieno[3,2-<i>d</i>]pyrimidin-4-amine","Acta Crystallographica Section E","2013","69","5","o698","","10.1107/S1600536813009537","","","0.71073","MoKα","","0.0348","0.0289","","","0.0768","0.0784","","","","","","1.072","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238056","4.848","0.00001","12.42","0.0002","14.885","0.0003","101.01","0.001","92.652","0.001","94.117","0.001","875.84","0.02","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","2,4,6-Triamino-1,3,5-triazin-1-ium 3-(prop-2-enoyloxy)propanoate acrylic acid monosolvate monohydrate","","- C12 H20 N6 O7 -","- C12 H20 N6 O7 -","- C24 H40 N12 O14 -","2","1","TK5217","Sangeetha, V.; Kanagathara, N.; Chakkaravarthi, G.; Marchewka, M. K.; Anbalagan, G.","2,4,6-Triamino-1,3,5-triazin-1-ium 3-(prop-2-enoyloxy)propanoate acrylic acid monosolvate monohydrate","Acta Crystallographica Section E","2013","69","5","o741","","10.1107/S1600536813009999","","","0.71073","MoKα","","0.0765","0.0594","","","0.1851","0.2035","","","","","","1.065","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238057","13.0721","0.0012","17.3426","0.0016","6.2154","0.0006","90","","90","","90","","1409.1","0.2","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2-Phenylethanaminium 4-hydroxybenzoate","","- C15 H17 N O3 -","- C15 H17 N O3 -","- C60 H68 N4 O12 -","4","1","TK5220","Sudhahar, S.; Krishnakumar, M.; Sornamurthy, B. M.; Chakkaravarthi, G.; Mohankumar, R.","2-Phenylethanaminium 4-hydroxybenzoate","Acta Crystallographica Section E","2013","69","5","o792","","10.1107/S1600536813010787","","","0.71073","MoKα","","0.0705","0.0384","","","0.0895","0.106","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238058","12.5688","0.0006","25.3381","0.0009","13.1058","0.0007","90","","96.74","0.004","90","","4145","0.3","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","μ~3~-Methoxido-κ^3^<i>O</i>:<i>O</i>:<i>O</i>-tris(μ-<i>L</i>-<i>p</i>-tyrosinato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>)tris(<i>L</i>-<i>p</i>-tyrosinato-κ^2^<i>N</i>,<i>O</i>)trinickel(II,III) methanol tetrasolvate","","- C59 H63 N6 Ni3 O23 -","- C59 H63 N6 Ni3 O23 -","- C118 H126 N12 Ni6 O46 -","2","1","TK5221","Tapala, Weerinradah; Prior, Timothy J.; Rujiwatra, Apinpus","μ~3~-Methoxido-κ^3^<i>O</i>:<i>O</i>:<i>O</i>-tris(μ-<small>L</small>-<i>p</i>-tyrosinato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>)tris(<small>L</small>-<i>p</i>-tyrosinato-κ^2^<i>N</i>,<i>O</i>)trinickel(II,III) methanol tetrasolvate","Acta Crystallographica Section E","2013","69","5","m286","m287","10.1107/S1600536813010696","","","0.71073","MoKα","","0.0525","0.0401","","","0.0945","0.0969","","","","","","0.878","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238059","8.878","0.0003","10.334","0.0003","8.923","0.0003","90","","108.805","0.004","90","","774.94","0.05","180","2","180","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1<i>S</i>,3<i>R</i>,8<i>R</i>)-2,2-Dichloro-3,7,7,10-tetramethyltricyclo[6.4.0.0^1,3^]dodec-9-en-11-one","","- C16 H22 Cl2 O -","- C16 H22 Cl2 O -","- C32 H44 Cl4 O2 -","2","1","TK5222","Ourhriss, Naja; Benharref, Ahmed; Oukhrib, Abdelouahd; Daran, Jean-Claude; Berraho, Moha","(1<i>S</i>,3<i>R</i>,8<i>R</i>)-2,2-Dichloro-3,7,7,10-tetramethyltricyclo[6.4.0.0^1,3^]dodec-9-en-11-one","Acta Crystallographica Section E","2013","69","6","o830","","10.1107/S1600536813011781","","","1.5418","CuKα","","0.0288","0.0276","","","0.0631","0.0645","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238060","8.4796","0.0004","8.5874","0.0006","13.8479","0.0009","90","","99.504","0.004","90","","994.53","0.11","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Hydroxy-1,2,6-trimethylpyridinium bromide monohydrate","","- C8 H14 Br N O2 -","- C8 H14 Br N O2 -","- C32 H56 Br4 N4 O8 -","4","1","TK5224","Seethalakshmi, T.; Manivannan, S.; Dhanuskodi, S.; Lynch, Daniel E.; Thamotharan, S.","4-Hydroxy-1,2,6-trimethylpyridinium bromide monohydrate","Acta Crystallographica Section E","2013","69","6","o941","o942","10.1107/S1600536813013330","","","0.71073","MoKα","","0.0388","0.0261","","","0.0525","0.0561","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238061","33.0231","0.0012","5.6347","0.0002","19.22","0.0006","90","","95.855","0.002","90","","3557.7","0.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-Cyclohexyl-2-(2-fluorophenyl)-3-methylsulfinyl-1-benzofuran","","- C21 H21 F O2 S -","- C21.002 H21 F O2 S -","- C168.016 H168 F8 O16 S8 -","8","1","TK5225","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Cyclohexyl-2-(2-fluorophenyl)-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2013","69","6","o887","","10.1107/S1600536813012701","","","0.71073","MoKα","","0.0609","0.0449","","","0.1133","0.1223","","","","","","1.066","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238062","5.4251","0.0001","10.6894","0.0003","14.5865","0.0003","108.91","0.001","91.447","0.001","102.44","0.001","777.3","0.03","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Bis[μ-2,5-bis(pyridin-2-yl)-1,3,4-thiadiazole-κ^4^<i>N</i>^2^,<i>N</i>^3^:<i>N</i>^4^,<i>N</i>^5^]bis[(nitrato-κ<i>O</i>)silver(I)] tetrahydrate","","- C24 H24 Ag2 N10 O10 S2 -","- C24 H24 Ag2 N10 O10 S2 -","- C24 H24 Ag2 N10 O10 S2 -","1","0.5","TK5229","Laachir, Abdelhakim; Bentiss, Fouad; Guesmi, Salaheddine; Saadi, Mohamed; El Ammari, Lahcen","Bis[μ-2,5-bis(pyridin-2-yl)-1,3,4-thiadiazole-κ^4^<i>N</i>^2^,<i>N</i>^3^:<i>N</i>^4^,<i>N</i>^5^]bis[(nitrato-κ<i>O</i>)silver(I)] tetrahydrate","Acta Crystallographica Section E","2013","69","6","m351","m352","10.1107/S1600536813014578","","","0.71073","MoKα","","0.0549","0.0343","","","0.0795","0.0895","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238063","10.76","0.005","8.321","0.004","14.601","0.007","90","","98.997","0.009","90","","1291.2","1.1","113","2","113","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Methyl (3<i>R</i>,4<i>S</i>,5<i>R</i>)-3,5-bis[(<i>tert</i>-butyldimethylsilyl)oxy]-4-methoxycyclohex-1-enecarboxylate","","- C21 H42 O5 Si2 -","- C21 H42 O5 Si2 -","- C42 H84 O10 Si4 -","2","1","VM2187","Liu, Ri; Shi, Yu; Xu, Chun-Xiu; Li, Yi-Liang","(3<i>R</i>,4<i>S</i>,5<i>R</i>)-Methyl 3,5-bis[(<i>tert</i>-butyldimethylsilyl)oxy]-4-methoxycyclohex-1-enecarboxylate","Acta Crystallographica Section E","2013","69","5","o632","","10.1107/S1600536813007551","","","0.71073","MoKα","","0.0613","0.0482","","","0.0694","0.0733","","","","","","0.984","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238064","16.1451","0.0003","7.51303","0.00014","29.0107","0.0005","90","","98.547","0.001","90","","3479.88","0.11","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2,7-Dimethoxynaphthalen-1-yl)(naphthalen-1-yl)methanone","","- C23 H18 O3 -","- C23 H18 O3 -","- C184 H144 O24 -","8","2","VM2191","Tsumuki, Takehiro; Isogai, Atsumi; Kawano, Hiroyuki; Yonezawa, Noriyuki; Okamoto, Akiko","(2,7-Dimethoxynaphthalen-1-yl)(naphthalen-1-yl)methanone","Acta Crystallographica Section E","2013","69","5","o663","","10.1107/S1600536813008854","","","1.54187","CuKα","","0.0417","0.037","","","0.1008","0.1048","","","","","","1.07","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238065","18.377","0.016","6.519","0.006","30.82","0.03","90","","93.233","0.016","90","","3686","6","296","2","296","2","","","","","","","","4","C 1 2 1","C 2y","5","","(1<i>S</i>,3<i>R</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-10,10-Bibromo-2,2-dichloro-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","","- C17 H24 Br2 Cl2 -","- C17 H24 Br2 Cl2 -","- C136 H192 Br16 Cl16 -","8","2","VM2192","Oukhrib, Abdelouahd; Benharref, Ahmed; Saadi, Mohamed; Berraho, Moha; El Ammari, Lahcen","(1<i>S</i>,3<i>R</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-10,10-Dibromo-2,2-dichloro-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","Acta Crystallographica Section E","2013","69","5","o739","","10.1107/S1600536813010040","","","0.71073","MoKα","","0.0649","0.041","","","0.0949","0.1026","","","","","","1.039","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238066","24.486","0.005","9.986","0.005","10.71","0.005","90","","109.623","0.005","90","","2466.7","1.8","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(cinnamato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)","","- C30 H22 Cu N2 O4 -","- C30 H22 Cu N2 O4 -","- C120 H88 Cu4 N8 O16 -","4","0.5","VM2193","Benslimane, Meriem; Redjel, Yasmine Kheira; Merazig, Hocine; Daran, Jean-Claude","Bis(cinnamato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section E","2013","69","5","m277","","10.1107/S1600536813010350","","","0.71073","MoKα","","0.0576","0.0392","","","0.0926","0.1001","","","","","","1.075","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238067","16.531","0.017","7.975","0.008","13.047","0.013","90","","92.055","0.013","90","","1719","3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[μ-3-(Methylsulfanyl)benzene-1,2-dithiolato-1:2κ^4^<i>S</i>,<i>S</i>':<i>S</i>,<i>S</i>']bis[tricarbonyliron(I)]","","- C13 H6 Fe2 O6 S3 -","- C13 H6 Fe2 O6 S3 -","- C52 H24 Fe8 O24 S12 -","4","1","VN2067","Yang, Yong; Wang, Ning; Chen, Lin","[μ-3-(Methylsulfanyl)benzene-1,2-dithiolato-1:2κ^4^<i>S</i>,<i>S</i>':<i>S</i>,<i>S</i>']bis[tricarbonyliron(I)]","Acta Crystallographica Section E","2013","69","5","m269","m270","10.1107/S1600536813009860","","","0.71073","MoKα","","0.068","0.036","","","0.0767","0.0839","","","","","","0.969","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238068","11.2236","0.0002","13.4714","0.0004","16.5303","0.0004","90","","90","","90","","2499.34","0.11","200","2","200","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Bis(pyridin-2-ylmethyl)ammonium nitrate","","- C12 H14 N4 O3 -","- C12 H14 N4 O3 -","- C96 H112 N32 O24 -","8","1","VN2068","Abrahams, Abubak'r; van Brecht, Bernardus; Betz, Richard","Bis(pyridin-2-ylmethyl)ammonium nitrate","Acta Crystallographica Section E","2013","69","5","o661","","10.1107/S1600536813008593","","","0.71073","MoKα","","0.0502","0.0414","","","0.1145","0.1224","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238069","12.7651","0.0003","12.7651","0.0003","5.0844","0.0001","90","","90","","120","","717.49","0.03","296","2","296","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","Magnesium hydroxide hydrogenarsenate (6.75/3/4)","","- As4 H4.5 Mg6.75 O19 -","- As4 Mg6.75 O19 -","- As8 Mg13.5 O38 -","2","0.166667","VN2069","Weil, Matthias","Mg~6.75~(OH)~3~(H~0.166~AsO~4~)~3~(HAsO~4~), a member of the <i>M</i>~1-~<i>~x~M</i>'~6~(OH)~3~(H~2<i>x~/3</i>AsO~4~)~3~(HAsO~4~) family (<i>M</i>,<i>M</i>' = Co; Ni)","Acta Crystallographica Section E","2013","69","5","i29","","10.1107/S1600536813010714","","","0.71073","MoKα","","0.0329","0.0291","","","0.0568","0.0575","","","","","","1.205","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238070","8.0442","0.0008","11.9167","0.0009","12.6799","0.001","90","","90","","90","","1215.5","0.18","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Potassium tetrakis(dioxomolybdenum) arsenate trioxide","","- As K Mo4 O15 -","- As K Mo4 O15 -","- As4 K4 Mo16 O60 -","4","1","VN2070","Jouini, Raja; Zid, Mohamed Faouzi; Driss, Ahmed","K(MoO~2~)~4~O~3~(AsO~4~)","Acta Crystallographica Section E","2013","69","6","i37","","10.1107/S1600536813013664","","","0.71073","MoKα","","0.0181","0.0177","","","0.045","0.0452","","","","","","1.096","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238071","10.43723","0.00005","10.43723","0.00005","37.3379","0.0007","90","","90","","120","","3522.5","0.07","293","2","293","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Silver(I) decacalcium heptakis(orthophosphate)","","- Ag Ca10 O28 P7 -","- Ag Ca10 O28 P7 -","- Ag6 Ca60 O168 P42 -","6","0.333333","WM2726","Strutynska, Nataliya Yu.; Zatovsky, Igor V.; Ogorodnyk, Ivan V.; Slobodyanik, Nikolay S.","Rietveld refinement of AgCa~10~(PO~4~)~7~ from X-ray powder data","Acta Crystallographica Section E","2013","69","5","i23","","10.1107/S1600536813007848","powder diffraction","","1.54187","CuKα","","0.038","","","","","","","","2.97","","","","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238072","9.44783","0.00005","9.44783","0.00005","9.44783","0.00005","90","","90","","90","","843.327","0.008","298","","298","","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","Trisodium vanadium(III) nitridotriphosphate","","- N Na3 O9 P3 V -","- N Na3 O9 P3 V -","- N4 Na12 O36 P12 V4 -","4","0.333333","WM2731","Kim, Minwoong; Kim, Seung-Joo","Synchrotron powder study of Na~3~V(PO~3~)~3~N","Acta Crystallographica Section E","2013","69","6","i34","","10.1107/S1600536813012427","powder diffraction","","1.5474","synchrotron","","","","","","","","","","1.587","","","","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238073","6.1028","0.0002","10.4708","0.0003","6.0003","0.0002","90","","118.249","0.001","90","","337.76","0.019","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dilithium hexahydroxidostannate(IV) dihydrate","","- H10 Li2 O8 Sn -","- H10 Li2 O8 Sn -","- H20 Li4 O16 Sn2 -","2","0.5","WM2733","Kamaha, Shouassi; Reuter, Hans","Dilithium hexahydroxidostannate(IV) dihydrate, a second monoclinic modification with a layer structure","Acta Crystallographica Section E","2013","69","5","i25","","10.1107/S1600536813008416","","","0.71073","MoKα","","0.0134","0.013","","","0.0321","0.0323","","","","","","1.091","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238074","14.058","0.002","14.058","0.002","6.3103","0.0008","90","","90","","90","","1247.1","0.3","298","2","298","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","Heptasodium tetrachromium(III) tetrakis(diphosphate) orthophosphate","","- Cr4 Na7 O32 P9 -","- Cr4 Na7 O32 P9 -","- Cr8 Na14 O64 P18 -","2","0.25","WM2734","Bourguiba Fakhar, Noura; Zid, Mohamed Faouzi; Driss, Ahmed","Na~7~Cr~4~(P~2~O~7~)~4~PO~4~","Acta Crystallographica Section E","2013","69","5","i27","i28","10.1107/S1600536813008726","","","0.71073","MoKα","","0.0259","0.0226","","","0.0591","0.0603","","","","","","1.123","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238075","8.6462","0.0002","11.6709","0.0003","13.4339","0.0004","87.876","0.003","83.483","0.003","74.566","0.002","1298.24","0.06","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-4-formylbenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(4-formylbenzoato-κ^2^<i>O</i>,<i>O</i>')bis(isonicotinamide-κ<i>N</i>^1^)copper(II)]","","- C56 H44 Cu2 N8 O16 -","- C56 H44 Cu2 N8 O16 -","- C56 H44 Cu2 N8 O16 -","1","0.5","WM2735","Sertçelik, Mustafa; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","Bis(μ-4-formylbenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(4-formylbenzoato-κ^2^<i>O</i>,<i>O</i>')bis(isonicotinamide-κ<i>N</i>^1^)copper(II)]","Acta Crystallographica Section E","2013","69","5","m290","m291","10.1107/S1600536813010908","","","0.71073","MoKα","","0.1095","0.0776","","","0.1882","0.2042","","","","","","1.107","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238076","21.8891","0.0007","10.235","0.0003","21.9242","0.0007","90","","112.802","0.002","90","","4527.9","0.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","{2,2'-[<i>N</i>,<i>N</i>'-Bis(pyridin-2-ylmethyl)propane-1,3-diyldi(nitrilo)]diacetato}cobalt(III) hexafluoridophosphate acetonitrile 0.064-solvate","","- C19.13 H22.19 Co F6 N4.06 O4 P -","- C19.128 H22.192 Co F6 N4.064 O4 P -","- C153.024 H177.536 Co8 F48 N32.512 O32 P8 -","8","2","WM2736","McLauchlan, Craig C.; Kissel, Daniel S.; Arnold, William R.; Herlinger, Albert W.","{2,2'-[<i>N</i>,<i>N</i>'-Bis(pyridin-2-ylmethyl)propane-1,3-diyldi(nitrilo)]diacetato}cobalt(III) hexafluoridophosphate acetonitrile 0.064-solvate","Acta Crystallographica Section E","2013","69","5","m296","m297","10.1107/S1600536813011136","","","0.71073","MoKα","","0.0267","0.0245","","","0.073","0.0743","","","","","","1.283","","","","has coordinates,has Fobs","189124","2020-10-21","18:00:00",""
"2238077","5.6856","0.0011","12.621","0.003","14.402","0.003","95.53","0.03","100.88","0.03","93.13","0.03","1007.4","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Decalanthanum dodecatellurium triacontnonaoxide","","- La10 O39 Te12 -","- La10 O39 Te12 -","- La10 O39 Te12 -","1","0.5","WM2737","Wang, Peng Li; Mozharivskyj, Yurij","The low-symmetry lanthanum(III) oxotellurate(IV), La~10~Te~12~O~39~","Acta Crystallographica Section E","2013","69","6","i36","","10.1107/S1600536813012191","","","0.71073","MoKα","","0.1024","0.0416","","","0.0543","0.0639","","","","","","0.765","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238078","9.4238","0.0004","13.6544","0.0006","13.5679","0.0006","90","","104.349","0.001","90","","1691.4","0.13","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-Amino-5-bromopyridin-1-ium (2-amino-5-bromopyridine-κ<i>N</i>^1^)trichloridozincate","","- C10 H11 Br2 Cl3 N4 Zn -","- C10 H11 Br2 Cl3 N4 Zn -","- C40 H44 Br8 Cl12 N16 Zn4 -","4","1","WM2739","Fitriani; Hansongnern, Kanidtha; Leesakul, Nararak; Pakawatchai, Chaveng; Saithong, Saowanit","2-Amino-5-bromopyridin-1-ium (2-amino-5-bromopyridine-κ<i>N</i>^1^)trichloridozincate","Acta Crystallographica Section E","2013","69","6","m302","","10.1107/S1600536813011884","","","0.71073","MoKα","","0.0423","0.0334","","","0.0813","0.0861","","","","","","1.024","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238079","9.162","0.001","20.869","0.007","7.566","0.002","90","","90","","90","","1446.6","0.6","298","2","298","2","","","","","","","","6","P n n m","-P 2 2n","58","","Bis(1,4-diazoniabicyclo[2.2.2]octane) di-μ-chlorido-bis[tetrachloridoantimonate(III)] dihydrate","","- C12 H32 Cl10 N4 O2 Sb2 -","- C12 H28 Cl10 N4 O2 Sb2 -","- C24 H56 Cl20 N8 O4 Sb4 -","2","0.25","WM2740","Ben Rhaiem, Tarek; Boughzala, Habib; Driss, Ahmed","Bis(1,4-diazoniabicyclo[2.2.2]octane) di-μ-chlorido-bis[tetrachloridoantimonate(III)] dihydrate","Acta Crystallographica Section E","2013","69","6","m330","","10.1107/S160053681301307X","","","0.71073","MoKα","","0.0289","0.0227","","","0.0579","0.0608","","","","","","1.084","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238080","26.0501","0.0004","8.0057","0.0001","13.0743","0.0002","90","","103.899","0.0009","90","","2646.8","0.07","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{(<i>Z</i>)-[(<i>E</i>)-2-(pyridin-2-ylmethylidene)hydrazin-1-ylidene][(pyridin-2-yl)methylsulfanyl]methanethiolato}nickel(II)","","- C26 H22 N8 Ni S4 -","- C26 H22 N8 Ni S4 -","- C104 H88 N32 Ni4 S16 -","4","0.5","WM2742","Khoo, Teng-Jin; bin Break, Mohammed Khaled; Tahir, M. Ibrahim M.; Krouse, Karen A.; Cowley, Andrew R.; Watkin, David J.","Bis{(<i>Z</i>)-[(<i>E</i>)-2-(pyridin-2-ylmethylidene)hydrazin-1-ylidene][(pyridin-2-yl)methylsulfanyl]methanethiolato}nickel(II)","Acta Crystallographica Section E","2013","69","6","m323","m324","10.1107/S1600536813013032","","","0.71073","MoKα","","0.0712","0.0452","","0.1671","0.1214","0.1214","","","","","","1.0797","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238081","7.7521","0.0016","12.772","0.003","15.121","0.003","90","","100.26","0.03","90","","1473.2","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Butane-1,2,3,4-tetraol- κ^3^<i>O</i>^1^,<i>O</i>^2^,<i>O</i>^3^)(ethanol-κ<i>O</i>)tris(nitrato-κ^2^<i>O</i>,<i>O</i>')erbium(III)","","- C6 H16 Er N3 O14 -","- C6 H16 Er N3 O14 -","- C24 H64 Er4 N12 O56 -","4","1","XU5657","Hua, Xiao-Hui; Xue, Jun-Hui; Yang, Li-Min; Xu, Yi-Zhuang; Wu, Jin-Guang","(Butane-1,2,3,4-tetraol-κ^3^<i>O</i>^1^,<i>O</i>^2^,<i>O</i>^3^)(ethanol-κ<i>O</i>)tris(nitrato-κ^2^<i>O</i>,<i>O</i>')erbium(III)","Acta Crystallographica Section E","2013","69","5","m257","m258","10.1107/S1600536813008003","","","0.71073","MoKα","","0.0337","0.0305","","","0.0613","0.0625","","","","","","1.2","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238082","10.6222","0.0008","18.469","0.0014","24.5375","0.0018","90","","90","","90","","4813.8","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3,9,15,34-Tetra-<i>tert</i>-butyl-19,29-dioxa-24-thiahexacyclo[15.13.7.1^7,11^.1^32,36^.0^5,30^.0^13,18^]nonatriaconta-1(30),2,4,7,9,11(39),13,15,17,32,34,36(38)-dodecaene-38,39-diol","","- C52 H70 O4 S -","- C52 H70 O4 S -","- C208 H280 O16 S4 -","4","1","XU5679","Xie, De-Xun; An, De-Lie","5,11,17,23-Tetrakis(1,1-dimethylethyl)-26,28-dihydroxycalix[4]arene-25,27-monothiacrown-3","Acta Crystallographica Section E","2013","69","5","o690","","10.1107/S1600536813008684","","","0.71073","MoKα","","0.1008","0.066","","","0.1713","0.1914","","","","","","0.927","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238083","8.208","0.007","9.73","0.008","9.902","0.008","73.257","0.016","79.986","0.014","80.77","0.014","740.6","1.1","296","2","296","2","","","","","","","","3","P -1","-P 1","2","1,4-diacetateanthraquinone","9,10-Dioxo-9,10-dihydroanthracene-1,4-diyl diacetate","","- C18 H12 O6 -","- C18 H12 O6 -","- C36 H24 O12 -","2","1","XU5688","Zhang, Jing-Jing; Yin, Cai-Xia; Huo, Fang-Jun","9,10-Dioxo-9,10-dihydroanthracene-1,4-diyl diacetate","Acta Crystallographica Section E","2013","69","5","o788","","10.1107/S1600536813010635","","","0.71073","MoKα","","0.0872","0.0492","","","0.123","0.1515","","","","","","1.005","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238084","8.999","0.004","19.296","0.008","18.926","0.007","90","","110.59","0.018","90","","3076","2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[[diaqua(μ~4~-benzene-1,2,4,5-tetracarboxylato)tetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)dicopper(II)] <i>N</i>,<i>N</i>-dimethylformamide monosolvate]","","- C25 H29 Cu2 N9 O11 -","- C25 H29 Cu2 N9 O11 -","- C100 H116 Cu8 N36 O44 -","4","1","XU5689","Zhou, Xiao-Fei; Xiao, Hong-Ping; Zhao, Ya-Juan; Li, Xin-Hua","Poly[[diaqua(μ~4~-benzene-1,2,4,5-tetracarboxylato)tetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)dicopper(II)] <i>N</i>,<i>N</i>-dimethylformamide monosolvate]","Acta Crystallographica Section E","2013","69","5","m273","m274","10.1107/S1600536813010246","","","0.71073","MoKα","","0.0612","0.04","","","0.1195","0.1533","","","","","","1.107","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238085","8.64349","0.00007","24.821","0.0003","18.40861","0.00018","90","","90.5648","0.0008","90","","3949.19","0.07","100","0.1","100","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>N</i>,<i>N</i>'-[2,2'-(Phenylazanediyl)bis(ethane-2,1-diyl)]dipicolinamide","","- C22 H23 N5 O2 -","- C22 H23 N5 O2 -","- C176 H184 N40 O16 -","8","2","XU5691","Li, Gao-Nan; Niu, Zhi-Gang; Huang, Mei-Qi; Zou, Ying; Hu, Liang-Jiang","<i>N</i>,<i>N</i>'-[2,2'-(Phenylazanediyl)bis(ethane-2,1-diyl)]dipicolinamide","Acta Crystallographica Section E","2013","69","5","o677","","10.1107/S1600536813008696","","","1.5418","CuKα","","0.0525","0.0437","","","0.0937","0.0969","","","","","","1.138","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238086","9.94","0.007","16.639","0.009","7.876","0.004","90","","96.28","0.05","90","","1294.8","1.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[aqua{μ~4~-2-[(carboxymethyl)sulfanyl]nicotinato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>'''}copper(II)] trihydrate]","","- C8 H13 Cu N O8 S -","- C8 H13 Cu N O8 S -","- C32 H52 Cu4 N4 O32 S4 -","4","1","XU5692","Li, Wei-Qi","Poly[[aqua{μ~4~-2-[(carboxymethyl)sulfanyl]nicotinato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>'''}copper(II)] trihydrate]","Acta Crystallographica Section E","2013","69","5","m268","","10.1107/S1600536813009604","","","0.71073","MoKα","","0.0462","0.0315","","","0.0784","0.0848","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238087","8.234","0.003","10.199","0.003","11.927","0.004","90","","97.439","0.004","90","","993.2","0.6","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3,4-Dihydro-1<i>H</i>-benzo[<i>c</i>]chromene-1,6(2<i>H</i>)-dione","","- C13 H10 O3 -","- C13 H10 O3 -","- C52 H40 O12 -","4","1","XU5693","Cui, Liang-Yan; He, Yan; Fan, Xue-Sen","3,4-Dihydro-1<i>H</i>-benzo[<i>c</i>]chromene-1,6(2<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","5","o754","","10.1107/S1600536813010210","","","0.71073","MoKα","","0.086","0.077","","","0.2238","0.2293","","","","","","1.175","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238088","13.986","0.003","9.997","0.0018","11.859","0.002","90","","91.169","0.002","90","","1657.8","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[(1-Bromonaphthalen-2-yl)methoxy]-5,5-dimethylcyclohex-2-enone","","- C19 H19 Br O2 -","- C19 H19 Br O2 -","- C76 H76 Br4 O8 -","4","1","XU5694","Fang, Liang-Liang; Liu, Nan; Zhang, Xin-Ying","3-[(1-Bromonaphthalen-2-yl)methoxy]-5,5-dimethylcyclohex-2-enone","Acta Crystallographica Section E","2013","69","5","o758","","10.1107/S160053681301026X","","","0.71073","MoKα","","0.0979","0.0607","","","0.1782","0.1986","","","","","","1.072","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238089","8.7191","0.0005","8.8978","0.0004","16.706","0.001","90","","103.801","0.006","90","","1258.65","0.12","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-(4-Hydroxyphenyl)-3-methoxy-4<i>H</i>-chromen-4-one","","- C16 H12 O4 -","- C16 H12 O4 -","- C64 H48 O16 -","4","1","XU5696","Serdiuk, Illia E.; Wera, Michał; Roshal, Alexander D.; Błażejowski, Jerzy","2-(4-Hydroxyphenyl)-3-methoxy-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2013","69","6","o895","","10.1107/S1600536813010982","","","0.7107","MoKα","","0.054","0.0404","","","0.0987","0.1073","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238090","7.5039","0.0015","7.7458","0.0015","14.439","0.003","81.63","0.03","79.15","0.03","78.67","0.03","803","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ammonium 2-(3,4-dimethylbenzoyl)benzoate dihydrate","","- C16 H21 N O5 -","- C16 H21 N O5 -","- C32 H42 N2 O10 -","2","1","XU5697","Zhang, Ming-Hui; Yuan, Yue-Lin; Kou, Jun-Feng","Ammonium 2-(3,4-dimethylbenzoyl)benzoate dihydrate","Acta Crystallographica Section E","2013","69","6","o860","","10.1107/S1600536813012087","","","0.71073","MoKα","","0.0871","0.0395","","","0.0944","0.1142","","","","","","1.009","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238091","10.765","0.0007","14.0424","0.0008","15.7266","0.0009","90","","103.244","0.003","90","","2314.1","0.2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Pyridinium bis(pyridine-κ<i>N</i>)tetrakis(thiocyanato-κ<i>N</i>)ferrate(III)","","- C19 H16 Fe N7 S4 -","- C19 H16 Fe N7 S4 -","- C76 H64 Fe4 N28 S16 -","4","1","XU5698","Shylin, Sergii I.; Gural'skiy, Il'ya A.; Haukka, Matti; Kapshuk, Anatoliy A.; Prisyazhnaya, Elena V.","Pyridinium bis(pyridine-κ<i>N</i>)tetrakis(thiocyanato-κ<i>N</i>)ferrate(III)","Acta Crystallographica Section E","2013","69","6","m298","m299","10.1107/S1600536813011628","","","0.71073","MoKα","","0.0805","0.035","","","0.0561","0.0646","","","","","","0.917","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238092","8.7685","0.0006","9.8159","0.0007","10.3515","0.0006","113.03","0.006","101.231","0.006","102.378","0.006","761.45","0.11","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","2-Methoxy-4-(prop-2-en-1-yl)phenyl 4-methoxybenzoate","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","1","XU5699","Pichika, Mallikarjuna Rao; Yew, Beng Kang; Ng, Seik Weng","2-Methoxy-4-(prop-2-en-1-yl)phenyl 4-methoxybenzoate","Acta Crystallographica Section E","2013","69","6","o819","","10.1107/S1600536813011458","","","0.71073","MoKα","","0.0782","0.0502","","","0.1129","0.1316","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238093","12.6271","0.0006","9.3928","0.0005","16.6616","0.0008","90","","111.954","0.002","90","","1832.83","0.16","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Ethyl-2-phenyl-3-[2-(trimethylsilyl)ethynyl]-1<i>H</i>-indole","","- C21 H23 N Si -","- C21 H23 N Si -","- C84 H92 N4 Si4 -","4","1","XU5700","Baglai, Iaroslav; Maraval, Valérie; Duhayon, Carine; Chauvin, Remi","1-Ethyl-2-phenyl-3-[2-(trimethylsilyl)ethynyl]-1<i>H</i>-indole","Acta Crystallographica Section E","2013","69","6","o921","o922","10.1107/S1600536813012671","","","0.71073","MoKα","","0.0572","0.0379","","0.0681","0.0404","0.0388","","","","","","1.1157","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238094","21.7784","0.0005","7.8573","0.0003","25.1034","0.0005","90","","90","","90","","4295.7","0.2","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","4',4',6',6'-Tetrachloro-2-(6-methylpyridin-2-yl)-1<i>H</i>,2<i>H</i>-spiro[naphtho[1,2-<i>e</i>][1,3,2]oxazaphosphinine-3,2'-[1,3,5,2,4,6]triazatriphosphinine]","","- C17 H14 Cl4 N5 O P3 -","- C17 H14 Cl4 N5 O P3 -","- C136 H112 Cl32 N40 O8 P24 -","8","1","XU5701","Işıklan, Muhammet; Sonkaya, Ömer; Hökelek, Tuncer","4',4',6',6'-Tetrachloro-2-(6-methylpyridin-2-yl)-1<i>H</i>,2<i>H</i>-spiro[naphtho[1,2-<i>e</i>][1,3,2]oxazaphosphinine-3,2'-[1,3,5,2,4,6]triazatriphosphinine]","Acta Crystallographica Section E","2013","69","6","o861","o862","10.1107/S1600536813012348","","","0.71073","MoKα","","0.0935","0.0476","","","0.1051","0.1291","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238095","9.1042","0.0016","13.887","0.002","17.826","0.003","70.753","0.003","79.332","0.004","75.19","0.003","2044.5","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[(triphenylphosphane-κ<i>P</i>)silver(I)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'-[(triphenylphosphane-κ<i>P</i>)silver(I)]-di-μ-chlorido]","","- C46 H38 Ag2 Cl2 N2 P2 -","- C46 H38 Ag2 Cl2 N2 P2 -","- C92 H76 Ag4 Cl4 N4 P4 -","2","1","XU5704","Song, Xiao-Ming; Hu, Feng; Shi, Hua-Tian; Chen, Qun; Zhang, Qian-Feng","<i>catena</i>-Poly[[(triphenylphosphane-κ<i>P</i>)silver(I)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'-[(triphenylphosphane-κ<i>P</i>)silver(I)]-di-μ-chlorido]","Acta Crystallographica Section E","2013","69","6","m342","","10.1107/S160053681301413X","","","0.71073","MoKα","","0.0685","0.0388","","","0.0806","0.0923","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238096","7.5374","0.0003","9.7388","0.0003","10.7979","0.0004","106.902","0.002","90.605","0.002","110.598","0.002","704.24","0.05","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","5-Chloro-2-(4-fluorophenyl)-7-methyl-3-methylsulfinyl-1-benzofuran","","- C16 H12 Cl F O2 S -","- C16 H12 Cl F O2 S -","- C32 H24 Cl2 F2 O4 S2 -","2","1","XU5706","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Chloro-2-(4-fluorophenyl)-7-methyl-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2013","69","6","o920","","10.1107/S1600536813013172","","","0.71073","MoKα","","0.0391","0.0328","","","0.0887","0.093","","","","","","1.044","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238097","9.7918","0.0002","9.3938","0.0002","10.6998","0.0002","90","","112.176","0.002","90","","911.39","0.03","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","(1<i>R</i>,2<i>S</i>,5<i>R</i>)-(-)-Menthyl (<i>S</i>)-2-(methoxycarbonyl)benzenesulfinate","","- C18 H26 O4 S -","- C18 H26 O4 S -","- C36 H52 O8 S2 -","2","1","YK2089","Altamura, Maria; Guidi, Antonio; Jierry, Loic; Paoli, Paola; Rossi, Patrizia","(1<i>R</i>,2<i>S</i>,5<i>R</i>)-(‒)-Menthyl (<i>S</i>)-2-(methoxycarbonyl)benzenesulfinate","Acta Crystallographica Section E","2013","69","5","o731","","10.1107/S1600536813009112","","","1.5418","CuKα","","0.0355","0.0311","","","0.0753","0.0782","","","","","","1.065","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238098","7.951","0.0016","6.987","0.0014","30.395","0.006","90","","92.31","0.03","90","","1687.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate","","- C19 H17 N3 O4 -","- C19 H17 N3 O4 -","- C76 H68 N12 O16 -","4","1","YK2090","Shen, Hong; Bai, Shu-Yuan; Han, Xin-Yi; Li, Xiang-Zhi; Wang, Hai-Bo","8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate","Acta Crystallographica Section E","2013","69","5","o760","","10.1107/S1600536813010271","","","0.71073","MoKα","","0.0849","0.0547","","","0.1667","0.1949","","","","","","1.008","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238099","6.0969","0.001","10.9279","0.0016","11.2209","0.0016","78.167","0.01","83.72","0.01","79.722","0.011","717.92","0.19","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-(2-Fluorophenylsulfinyl)-2,5,7-trimethyl-1-benzofuran","","- C17 H15 F O2 S -","- C17 H15 F O2 S -","- C34 H30 F2 O4 S2 -","2","1","YK2091","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","3-(2-Fluorophenylsulfinyl)-2,5,7-trimethyl-1-benzofuran","Acta Crystallographica Section E","2013","69","6","o821","","10.1107/S1600536813011495","","","0.71073","MoKα","","0.0532","0.0387","","","0.09","0.0986","","","","","","1.054","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238100","6.6842","0.0004","9.6173","0.0006","25.4682","0.0015","95.78","0.003","95.669","0.003","90.028","0.003","1620.82","0.17","93","2","93","2","","","","","","","","4","P 1","P 1","1","","5-(Naphthalen-1-yl)isophthalic acid‒dimethyl sulfoxide‒water (2/1/2)","","- C19 H17 O5.5 S0.5 -","- C19 H17 O5.5 S0.5 -","- C76 H68 O22 S2 -","4","4","YK2092","Vetter, Antje; Seichter, Wilhelm; Weber, Edwin","5-(Naphthalen-1-yl)isophthalic acid‒dimethyl sulfoxide‒water (2/1/2)","Acta Crystallographica Section E","2013","69","6","o912","o913","10.1107/S1600536813012361","","","0.71073","MoKα","","0.0612","0.0452","","","0.0924","0.0995","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238101","4.6619","0.0002","17.3256","0.0007","11.149","0.0004","90","","103.204","0.002","90","","876.7","0.06","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-(2-methyl-4-nitro-1<i>H</i>-imidazol-1-yl)acetate","","- C7 H9 N3 O4 -","- C7 H9 N3 O4 -","- C28 H36 N12 O16 -","4","1","YK2093","Zama, Sana; Bouraiou, Abdelmalek; Bouacida, Sofiane; Roisnel, Thierry; Belfaitah, Ali","Methyl 2-(2-methyl-4-nitro-1<i>H</i>-imidazol-1-yl)acetate","Acta Crystallographica Section E","2013","69","6","o837","o838","10.1107/S1600536813011914","","","0.71073","MoKα","","0.0386","0.0336","","","0.0849","0.0882","","","","","","1.088","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238102","8.5896","0.0017","10.837","0.002","16.584","0.003","90","","99.44","0.03","90","","1522.8","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-bromo-4-cyano-5-[(2-ethoxy-2-oxoethyl)sulfanyl]thiophene-2-carboxylate","","- C12 H12 Br N O4 S2 -","- C12 H12 Br N O4 S2 -","- C48 H48 Br4 N4 O16 S8 -","4","1","ZJ2102","Li, Xiuping; Jia, Xiaochuan; Li, Jing","Ethyl 3-bromo-4-cyano-5-[(2-ethoxy-2-oxoethyl)sulfanyl]thiophene-2-carboxylate","Acta Crystallographica Section E","2013","69","6","o848","","10.1107/S1600536813010611","","","0.71073","MoKα","","0.0877","0.0515","","","0.138","0.1568","","","","","","0.997","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238103","11.4868","0.0017","8.7275","0.0013","21.105","0.003","90","","99.857","0.003","90","","2084.6","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-{1,2-Bis(pyridin-3-yl)-2-[(<i>E</i>)-(pyridin-3-yl)methylideneamino]ethyl}nicotinamide","","- C24 H20 N6 O -","- C24 H20 N6 O -","- C96 H80 N24 O4 -","4","1","ZL2533","Quiroa-Montalván, Claudia M.; Chávez, Daniel; Reyes-Martínez, Reyna; Morales-Morales, David; Parra-Hake, Miguel","<i>N</i>-{1,2-Bis(pyridin-3-yl)-2-[(<i>E</i>)-(pyridin-3-yl)methylideneamino]ethyl}nicotinamide","Acta Crystallographica Section E","2013","69","5","o691","o692","10.1107/S1600536813008544","","","0.71073","MoKα","","0.1121","0.071","","","0.1745","0.1983","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238104","12.0547","0.0006","12.1822","0.0004","13.2435","0.0007","65.156","0.004","83.108","0.004","68.444","0.004","1640.06","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[4-chloro-2-(quinolin-8-yliminomethyl)phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]cobalt(III) trichloridomethanolcobaltate(II)","","- C33 H24 Cl5 Co2 N4 O3 -","- C33 H24 Cl5 Co2 N4 O3 -","- C66 H48 Cl10 Co4 N8 O6 -","2","1","ZL2537","Luo, Xu-Jian; Zhang, Chuan-Hui; Zhou, Jie; Liu, Yan-Cheng","Bis[4-chloro-2-(quinolin-8-yliminomethyl)phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]cobalt(III) trichloridomethanolcobaltate(II)","Acta Crystallographica Section E","2013","69","5","m278","m279","10.1107/S1600536813010118","","","0.7107","MoKα","","0.0451","0.035","","","0.0829","0.0907","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238105","29.016","0.003","9.1763","0.0009","16.8294","0.0016","90","","121.086","0.002","90","","3837.5","0.7","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","10-(3,5-Dinitrophenyl)-5,5-difluoro-1,3,7,9-tetramethyl-5<i>H</i>-dipyrrolo[1,2-<i>c</i>:2',1'-<i>f</i>][1,3,2]diazaborinin-4-ium-5-uide","","- C19 H17 B F2 N4 O4 -","- C19 H17 B F2 N4 O4 -","- C152 H136 B8 F16 N32 O32 -","8","1","ZL2539","Cui, Ai-Jun; Wang, Yan; He, Jie; Li, Xiang; He, Ming-Yang","10-(3,5-Dinitrophenyl)-5,5-difluoro-1,3,7,9-tetramethyl-5<i>H</i>-dipyrrolo[1,2-<i>c</i>:2',1'-<i>f</i>][1,3,2]diazaborinin-4-ium-5-uide","Acta Crystallographica Section E","2013","69","5","o647","","10.1107/S1600536813008027","","","0.71073","MoKα","","0.0849","0.045","","","0.1034","0.1136","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238106","20.0898","0.0016","20.0898","0.0016","18.012","0.002","90","","90","","90","","7269.6","1.1","296","2","296","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","(<i>R</i>~C~,<i>S</i>~Fe~)-1-[3,5-Bis(trifluoromethyl)phenyl]-3-{1-[2-(diphenylphosphanyl)ferrocenyl]ethyl}thiourea (unknown solvate)","","- C33 H27 F6 Fe N2 P S -","- C33 H27 F6 Fe N2 P S -","- C264 H216 F48 Fe8 N16 P8 S8 -","8","1","ZL2541","Ma, Peng-Fei; Zhang, Xiao-Rui; Ma, Jiang-Wei; Chen, Hui; Jiang, Ru","(<i>R</i>~C~,<i>S</i>~Fe~)-1-[3,5-Bis(trifluoromethyl)phenyl]-3-{1-[2-(diphenylphosphanyl)ferrocenyl]ethyl}thiourea (unknown solvate)","Acta Crystallographica Section E","2013","69","5","m242","m243","10.1107/S1600536813008453","","","0.71073","MoKα","","0.1101","0.0536","","","0.1034","0.1194","","","","","","0.946","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238107","27.4484","0.0007","13.3116","0.0003","22.3609","0.0005","90","","91.165","0.002","90","","8168.6","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[2,4-dibromo-6-(<i>N</i>-{4-[(<i>E</i>)-1-(benzyloxyimino)ethyl]phenyl}carboximidoyl)phenolato]copper(II)","","- C44 H34 Br4 Cu N4 O4 -","- C44 H34 Br4 Cu N4 O4 -","- C352 H272 Br32 Cu8 N32 O32 -","8","1","ZL2543","Li, Xiao-Bing; Li, Xiao-Jun; Meng, Wei-Sheng; Zhang, Yu-Jie; Li, Gang","Bis[2,4-dibromo-6-(<i>N</i>-{4-[(<i>E</i>)-1-(benzyloxyimino)ethyl]phenyl}carboximidoyl)phenolato]copper(II)","Acta Crystallographica Section E","2013","69","5","m267","","10.1107/S1600536813009847","","","0.71073","MoKα","","0.0827","0.041","","","0.0647","0.0775","","","","","","1.014","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238108","9.4145","0.0013","15.7309","0.0017","20.59","0.002","90","","101.781","0.003","90","","2985.1","0.6","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-cyanido-tetracyanido(5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)[<i>N</i>-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) dihydrate","","- C60 H64.14 Fe2 N16 Ni O4.07 -","- C60 H64.136 Fe2 N16 Ni O4.068 -","- C120 H128.272 Fe4 N32 Ni2 O8.136 -","2","0.5","ZL2544","Yang, Yuqi; Zhou, Hongbo; Shen, Xiaoping","Di-μ-cyanido-tetracyanido(5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)[<i>N</i>-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) 2.07-hydrate","Acta Crystallographica Section E","2013","69","5","m271","m272","10.1107/S1600536813010234","","","0.71073","MoKα","","0.066","0.0573","","","0.1539","0.1564","","","","","","0.971","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238109","8.2249","0.0019","8.886","0.002","10.814","0.003","73.503","0.004","75.633","0.004","79.579","0.004","728.9","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","6,8-Dibromo-3-nitro-2-phenyl-2<i>H</i>-chromene","","- C15 H9 Br2 N O3 -","- C15 H9 Br2 N O3 -","- C30 H18 Br4 N2 O6 -","2","1","ZL2545","Yan, Lin-Jie; Zhang, Sheng-Yong","6,8-Dibromo-3-nitro-2-phenyl-2<i>H</i>-chromene","Acta Crystallographica Section E","2013","69","6","o877","","10.1107/S160053681301221X","","","0.71073","MoKα","","0.0629","0.0408","","","0.094","0.1049","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238110","9.0667","0.0002","10.3647","0.0002","10.6838","0.0002","105.395","0.001","93.418","0.001","110.839","0.001","891.33","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Cyclohexyl-3-(2-fluorophenylsulfinyl)-2-methyl-1-benzofuran","","- C21 H21 F O2 S -","- C21 H21 F O2 S -","- C42 H42 F2 O4 S2 -","2","1","ZL2547","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Cyclohexyl-3-(2-fluorophenylsulfinyl)-2-methyl-1-benzofuran","Acta Crystallographica Section E","2013","69","6","o894","","10.1107/S1600536813011902","","","0.71073","MoKα","","0.0587","0.0436","","","0.1083","0.1163","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238111","8.079","0.0006","14.187","0.0007","17.6553","0.0012","90","","102.645","0.008","90","","1974.5","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[diaquabis(selenocyanato-κ<i>N</i>)iron(II)]-μ-1,2-bis(pyridin-4-yl)ethane-κ^2^<i>N</i>:<i>N</i>'] 1,2-bis(pyridin-4-yl)ethane disolvate dihydrate]","","- C38 H44 Fe N8 O4 Se2 -","- C38 H44 Fe N8 O4 Se2 -","- C76 H88 Fe2 N16 O8 Se4 -","2","0.5","ZL2548","Wöhlert, Susanne; Jess, Inke; Näther, Christian","<i>catena</i>-Poly[[[diaquabis(selenocyanato-κ<i>N</i>)iron(II)]-μ-1,2-bis(pyridin-4-yl)ethane-κ^2^<i>N</i>:<i>N</i>'] 1,2-bis(pyridin-4-yl)ethane disolvate dihydrate]","Acta Crystallographica Section E","2013","69","6","m320","m321","10.1107/S1600536813012312","","","0.71073","MoKα","","0.0656","0.0449","","","0.1034","0.1194","","","","","","1.092","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238112","7.358","0.0006","17.2445","0.0011","12.1219","0.0009","90","","92.63","0.009","90","","1536.5","0.2","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[bis(methanol-κ<i>O</i>)bis(selenocyanato-κ<i>N</i>)manganese(II)]-μ-1,2-bis(pyridin-4-yl)ethene-κ^2^<i>N</i>:<i>N</i>'] 1,2-bis(pyridin-4-yl)ethene monosolvate]","","- C28 H28 Mn N6 O2 Se2 -","- C28 H28 Mn N6 O2 Se2 -","- C56 H56 Mn2 N12 O4 Se4 -","2","0.5","ZL2549","Wöhlert, Susanne; Jess, Inke; Näther, Christian","<i>catena</i>-Poly[[[bis(methanol-κ<i>O</i>)bis(selenocyanato-κ<i>N</i>)manganese(II)]-μ-1,2-bis(pyridin-4-yl)ethene-κ^2^<i>N</i>:<i>N</i>'] 1,2-bis(pyridin-4-yl)ethene monosolvate]","Acta Crystallographica Section E","2013","69","6","m319","","10.1107/S1600536813012609","","","0.71073","MoKα","","0.0545","0.0414","","","0.1046","0.1124","","","","","","0.985","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238113","17.1981","0.0003","17.3466","0.0003","17.8082","0.0004","90","","94.182","0.001","90","","5298.55","0.18","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","<i>N</i>-[3-(Benzyldimethylazaniumyl)propyl]-<i>N</i>',<i>N</i>',<i>N</i>'',<i>N</i>''-tetramethylguanidinium bis(tetraphenylborate)","","- C65 H72 B2 N4 -","- C65 H72 B2 N4 -","- C260 H288 B8 N16 -","4","1","ZL2550","Tiritiris, Ioannis","<i>N</i>-[3-(Benzyldimethylazaniumyl)propyl]-<i>N</i>',<i>N</i>',<i>N</i>'',<i>N</i>''-tetramethylguanidinium bis(tetraphenylborate)","Acta Crystallographica Section E","2013","69","6","o899","","10.1107/S1600536813012786","","","0.71073","MoKα","","0.0605","0.0425","","","0.0984","0.1103","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238114","4.2677","0.0001","14.9344","0.0004","16.7882","0.0004","90","","96.952","0.001","90","","1062.14","0.05","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-Diiodoazulene-2-carbonitrile","","- C11 H5 I2 N -","- C11 H5 I2 N -","- C44 H20 I8 N4 -","4","1","ZP2002","Förster, Sebastian; Seichter, Wilhelm; Weber, Edwin","1,3-Diiodoazulene-2-carbonitrile","Acta Crystallographica Section E","2013","69","5","o654","o655","10.1107/S1600536813008301","","","0.71073","MoKα","","0.0313","0.0237","","","0.0554","0.058","","","","","","1.047","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238115","9.681","0.002","11.399","0.003","9.694","0.002","90","","100.85","0.009","90","","1050.6","0.4","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Thiophene-2-carbaldehyde azine","(1<i>E</i>,2<i>E</i>)-Bis[(thiophen-2-yl)methylidene]hydrazine","","- C10 H8 N2 S2 -","- C10 H8 N2 S2 -","- C40 H32 N8 S8 -","4","1","ZP2003","Geiger, David K.; Geiger, H. Cristina; Szczesniak, Laura M.","Thiophene-2-carbaldehyde azine","Acta Crystallographica Section E","2013","69","6","o916","","10.1107/S1600536813013275","","","0.71073","MoKα","","0.086","0.0591","","","0.1377","0.1557","","","","","","0.991","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238116","10.237","0.0003","10.3671","0.0003","14.6501","0.0004","79.804","0.001","79.512","0.001","83.874","0.001","1500.2","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","1,3,5-Tris[(phthalimido)methyl]-2,4,6-trimethoxybenzene","2,2',2''-[(2,4,6-Trimethoxybenzene-1,3,5-triyl)tris(methylene)]tris(isoindole-1,3-dione)","","- C36 H27 N3 O9 -","- C36 H27 N3 O9 -","- C72 H54 N6 O18 -","2","1","ZQ2198","Rosien, Jan-Ruven; Seichter, Wilhelm; Mazik, Monika","2,2',2''-[(2,4,6-Trimethoxybenzene-1,3,5-triyl)tris(methylene)]tris(isoindole-1,3-dione)","Acta Crystallographica Section E","2013","69","5","o680","","10.1107/S1600536813008428","","","0.71073","MoKα","","0.0454","0.0394","","","0.0954","0.1","","","","","","0.956","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238117","9.45","0.0007","12.8824","0.0009","27.295","0.003","90","","90","","90","","3322.9","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Acetylamino-1,3,4,6-tetra-<i>O</i>-(trimethylsilyl)-2-deoxy-α-<i>D</i>-glucopyranose","","- C20 H47 N O6 Si4 -","- C20 H47 N O6 Si4 -","- C80 H188 N4 O24 Si16 -","4","1","ZQ2199","Cheng, Zhao-Dong; Cui, Yan-Li; Mao, Jian-Wei","2-Acetylamino-1,3,4,6-tetra-<i>O</i>-(trimethylsilyl)-2-deoxy-α-<small>D</small>-glucopyranose","Acta Crystallographica Section E","2013","69","6","o917","","10.1107/S160053681301266X","","","0.71073","MoKα","","0.1004","0.0551","","","0.1284","0.1494","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238118","10.4044","0.0002","10.4947","0.0002","13.7744","0.0003","90","","117.363","0.001","90","","1335.76","0.05","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-(Carbonothioyldisulfanediyl)bis(2-methylpropanoic acid)","","- C9 H14 O4 S3 -","- C9 H14 O4 S3 -","- C36 H56 O16 S12 -","4","1","ZQ2200","Moreno-Fuquen, Rodolfo; Grande, Carlos; Advincula, Rigoberto C.; Tenorio, Juan C.; Ellena, Javier","2,2'-(Carbonothioyldisulfanediyl)bis(2-methylpropanoic acid)","Acta Crystallographica Section E","2013","69","5","o774","","10.1107/S1600536813010179","","","0.71073","MoKα","","0.0421","0.0307","","","0.0792","0.0837","","","","","","1.047","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238119","10.664","0.002","6.6428","0.0013","23.754","0.005","90","","91.11","0.03","90","","1682.4","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","<i>rac</i>-7-Methyl-3-[(7-methyl-4-oxochroman-3-yl)methyl]-4<i>H</i>-chromen-4-one","","- C21 H18 O4 -","- C21 H18 O4 -","- C84 H72 O16 -","4","1","ZS2250","Somasundaram, M.; Rajendiran, A.; Balasubramanian, K.K.; Krishnasamy, K.; Kabilan, S.","<i>rac</i>-7-Methyl-3-[(7-methyl-4-oxochroman-3-yl)methyl]-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2013","69","5","o763","","10.1107/S1600536813009422","","","0.71073","MoKα","","0.1324","0.0586","","","0.1433","0.1798","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238120","9.7508","0.0005","15.0974","0.0007","16.55","0.0007","114.433","0.002","92.903","0.002","97.51","0.002","2184.29","0.18","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","1,3,5-Tris(bromomethyl)-2,4,6-trimethoxybenzene","","- C12 H15 Br3 O3 -","- C12 H15 Br3 O3 -","- C72 H90 Br18 O18 -","6","3","ZS2251","Koch, Niklas; Seichter, Wilhelm; Mazik, Monika","1,3,5-Tris(bromomethyl)-2,4,6-trimethoxybenzene","Acta Crystallographica Section E","2013","69","5","o679","","10.1107/S1600536813008441","","","0.71073","MoKα","","0.0439","0.03","","","0.0662","0.0698","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238121","9.292","0.005","9.448","0.005","17.547","0.005","84.097","0.005","84.04","0.005","83.315","0.005","1515.3","1.2","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","2,4-Dimethoxy-6-[(<i>E</i>)-2-(4-methoxyphenyl)ethenyl]benzaldehyde","","- C18 H18 O4 -","- C18 H18 O4 -","- C72 H72 O16 -","4","2","ZS2252","Ge, Xiao-Lin; Guan, Qiu-Xiang; Deng, Sheng-Song; Ruan, Ban-Feng","2,4-Dimethoxy-6-[(<i>E</i>)-2-(4-methoxyphenyl)ethenyl]benzaldehyde","Acta Crystallographica Section E","2013","69","5","o629","","10.1107/S1600536813007964","","","0.71069","MoKα","","0.0938","0.048","","","0.1251","0.1683","","","","","","0.787","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238122","10.779","0.004","10.815","0.003","12.158","0.004","96.091","0.004","110.71","0.004","101.244","0.004","1276.4","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","1-(4-Chlorophenyl)-2-(1,3-diazepan-2-ylidene)ethanone","","- C13 H15 Cl N2 O -","- C13 H15 Cl N2 O -","- C52 H60 Cl4 N8 O4 -","4","2","ZS2253","Zhang, Xiao-Wei; Xia, Jian-Hui; Xu, Zhao-Hui; Wang, Li-Ben; Yu, Chu-Yi","1-(4-Chlorophenyl)-2-(1,3-diazepan-2-ylidene)ethanone","Acta Crystallographica Section E","2013","69","6","o971","","10.1107/S1600536813013858","","","0.71073","MoKα","","0.0914","0.0753","","","0.1518","0.1618","","","","","","1.121","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238123","16.1886","0.0007","8.4863","0.0004","21.4316","0.001","90","","93.756","0.004","90","","2938","0.2","290.99","0.1","290.99","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-{[2-(Pyridin-4-yl)-1<i>H</i>-benzimidazol-1-yl]methyl}phenol","","- C19 H15 N3 O -","- C19 H15 N3 O -","- C152 H120 N24 O8 -","8","1","ZS2254","Omer, Mohammed A. S.; Liu, Jia-cheng; Xiao, Chao-hu","2-{[2-(Pyridin-4-yl)-1<i>H</i>-benzimidazol-1-yl]methyl}phenol","Acta Crystallographica Section E","2013","69","5","o700","","10.1107/S1600536813009458","","","0.7107","MoKα","","0.0594","0.0474","","","0.1105","0.1193","","","","","","1.062","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238124","5.775","0.005","25.55","0.002","7.64","0.001","90","","98.292","0.001","90","","1115.5","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-amino-5-bromo-1-benzofuran-2-carboxylate","","- C11 H10 Br N O3 -","- C11 H10 Br N O3 -","- C44 H40 Br4 N4 O12 -","4","1","ZS2255","Yamuna, A. J.; Karunakar, P.; Girija, C. R.; Vaidya, V. P.; Krishnamurthy, V.","Ethyl 3-amino-5-bromo-1-benzofuran-2-carboxylate","Acta Crystallographica Section E","2013","69","5","o775","","10.1107/S1600536813010209","","","0.71073","MoKα","","0.0424","0.0331","","","0.072","0.076","","","","","","1.076","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238125","9.4675","0.001","10.1411","0.001","13.7792","0.0012","90","","103.895","0.01","90","","1284.2","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Phenoxyethyl benzoate","","- C15 H14 O3 -","- C15 H14 O3 -","- C60 H56 O12 -","4","1","ZS2256","Al-Noaimi, Mousa; Warad, Ismail; Haddad, Salim F.; Husein, Ahmad; Shareiah, Rami","2-Phenoxyethyl benzoate","Acta Crystallographica Section E","2013","69","5","o789","","10.1107/S1600536813010878","","","0.71073","MoKα","","0.0741","0.0442","","","0.1056","0.13","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238126","12.362","0.004","8.946","0.003","23.261","0.008","90","","100.762","0.004","90","","2527.2","1.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(5-Nitro-1,3-thiazol-2-yl)-4-(trifluoromethyl)benzamide","","- C11 H6 F3 N3 O3 S -","- C11 H6 F3 N3 O3 S -","- C88 H48 F24 N24 O24 S8 -","8","2","ZS2257","Liu, Xi-Wang; Zhang, Han; Yang, Ya-Jun; Li, Jian-Yong; Zhang, Ji-Yu","<i>N</i>-(5-Nitro-1,3-thiazol-2-yl)-4-(trifluoromethyl)benzamide","Acta Crystallographica Section E","2013","69","6","o943","","10.1107/S1600536813011264","","","0.71073","MoKα","","0.1031","0.0691","","","0.1507","0.1751","","","","","","1.063","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238127","10.171","0.001","11.396","0.0011","15.5305","0.0015","90","","105.66","0.002","90","","1733.3","0.3","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(dicyanamido-κ<i>N</i>)[tris(3-aminopropyl)amine-κ^4^<i>N</i>]nickel(II)","","- C13 H24 N10 Ni -","- C13 H24 N10 Ni -","- C52 H96 N40 Ni4 -","4","1","BG2508","Luo, Jun; Zhang, Xin-Rong; Qiu, Li-Juan; Yang, Feng; Liu, Bao-Shu","Bis(dicyanamido-κ<i>N</i>)[tris(3-aminopropyl)amine-κ^4^<i>N</i>]nickel(II)","Acta Crystallographica Section E","2013","69","7","m385","m386","10.1107/S1600536813015651","","","0.71073","MoKα","","0.035","0.0269","","","0.0746","0.0789","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238128","22.256","0.008","7.449","0.007","9.929","0.009","90","","90","","90","","1646","2","298","","298","","","","","","","","","6","P n m a","-P 2ac 2n","62","","Pentaaqua(dimethylformamide)cobalt(II) sulfate dimethylformamide monosolvate","","- C6 H24 Co N2 O11 S -","- C6 H24 Co N2 O11 S -","- C24 H96 Co4 N8 O44 S4 -","4","0.5","BQ2385","Taş, Murat; Çamur, Seval; Topal, Sevim","Pentaaqua(dimethylformamide)cobalt(II) sulfate dimethylformamide monosolvate","Acta Crystallographica Section E","2013","69","7","m373","","10.1107/S1600536813012841","","","0.7107","MoKα","","0.0496","0.0413","","","0.0939","0.1002","","","","","","1.143","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238129","7.5835","0.0002","12.3652","0.0003","12.4893","0.0003","66.878","0.002","78.678","0.003","83.222","0.003","1055.01","0.05","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-nicotinamide-κ^2^<i>N</i>^1^:<i>O</i>;κ^2^<i>O</i>:<i>N</i>^1^-bis[aquabis(3-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')cadmium]","","- C40 H32 Cd2 Cl4 N4 O12 -","- C40 H32 Cd2 Cl4 N4 O12 -","- C40 H32 Cd2 Cl4 N4 O12 -","1","0.5","BQ2387","Bozkurt, Nihat; Dilek, Nefise; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","Di-μ-nicotinamide-κ^2^<i>N</i>^1^:<i>O</i>;κ^2^<i>O</i>:<i>N</i>^1^-bis[aquabis(3-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')cadmium]","Acta Crystallographica Section E","2013","69","7","m389","m390","10.1107/S1600536813015948","","","0.71073","MoKα","","0.0208","0.0198","","","0.0515","0.0519","","","","","","1.092","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238130","10.2327","0.0008","13.9389","0.0009","6.6567","0.0004","90","","90","","90","","949.46","0.11","296","2","296","2","","","","","","","","4","I m m a","-I 2b 2","74","","Lead(II) manganese(II/III) phosphate(V)","","- Mn3 O12 P3 Pb -","- Mn3 O12 P3 Pb -","- Mn12 O48 P12 Pb4 -","4","0.25","BR2227","Alhakmi, Ghaleb; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen","A new mixed-valence lead(II) manganese(II/III) phosphate(V): PbMn^II^~2~Mn^III^(PO~4~)~3~","Acta Crystallographica Section E","2013","69","7","i40","","10.1107/S1600536813016504","","","0.71073","MoKα","","0.0168","0.0162","","","0.0393","0.0395","","","","","","1.106","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238131","7.0288","0.0006","13.5001","0.0007","17.9271","0.0011","91.878","0.005","93.431","0.006","91.548","0.006","1696.4","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)- 1-(2,4-Dinitrobenzylidene)-2,2-diphenylhydrazine","","- C19 H14 N4 O4 -","- C19 H14 N4 O4 -","- C76 H56 N16 O16 -","4","2","BT6909","Meléndrez-Luévano, Ruth; Cabrera-Vivas, Blanca M.; Flores-Alamo, Marcos; Ramirez, Juan C.; Conde-Sánchez, Pedro","(<i>E</i>)-1-(2,4-Dinitrobenzylidene)-2,2-diphenylhydrazine","Acta Crystallographica Section E","2013","69","7","o1039","","10.1107/S1600536813014360","","","0.71073","MoKα","","0.0914","0.0396","","","0.0725","0.0794","","","","","","1.006","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238132","3.754","0.005","15.696","0.005","23.149","0.005","90","0.005","93.491","0.005","90","0.005","1361.5","1.9","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-{(<i>E</i>)-[(2-Methyl-3-nitrophenyl)imino]methyl}-4-nitrophenol","","- C14 H11 N3 O5 -","- C14 H11 N3 O5 -","- C56 H44 N12 O20 -","4","1","BT6911","Tanak, Hasan; Toğurman, Ferhat; Kalecik, Sedanur; Dege, Necmi; Yavuz, Metin","2-{(<i>E</i>)-[(2-Methyl-3-nitrophenyl)imino]methyl}-4-nitrophenol","Acta Crystallographica Section E","2013","69","7","o1085","","10.1107/S1600536813015407","","","0.71073","MoKα","","0.2258","0.095","","","0.1766","0.2287","","","","","","0.971","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238133","13.763","0.0004","6.0841","0.0002","17.5003","0.0006","90","","105.726","0.002","90","","1410.54","0.08","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[(<i>E</i>)-2-(4-Chlorophenyl)ethenyl]-5,5-dimethylcyclohex-2-en-1-one","","- C16 H17 Cl O -","- C16 H17 Cl O -","- C64 H68 Cl4 O4 -","4","1","BT6912","Fatima, Zeenat; Senthilkumar, Govindaraj; Vadivel, A.; Manikandan, Haridoss; Velmurugan, Devadasan","3-[(<i>E</i>)-2-(4-Chlorophenyl)ethenyl]-5,5-dimethylcyclohex-2-en-1-one","Acta Crystallographica Section E","2013","69","7","o1121","","10.1107/S1600536813016255","","","0.71073","MoKα","","0.0615","0.0441","","","0.1158","0.1298","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238134","7.8805","0.0008","8.4673","0.0012","12.3973","0.0014","104.166","0.011","94.502","0.009","104.145","0.01","769.29","0.17","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2-Methoxy-4-(prop-2-en-1-yl)phenyl 2,4-dichlorobenzoate","","- C17 H14 Cl2 O3 -","- C17 H14 Cl2 O3 -","- C34 H28 Cl4 O6 -","2","1","BT6913","Pichika, Mallikarjuna Rao; Kang, Yew Beng; Ng, Seik Weng","2-Methoxy-4-(prop-2-en-1-yl)phenyl 2,4-dichlorobenzoate","Acta Crystallographica Section E","2013","69","7","o1089","","10.1107/S1600536813015675","","","0.71073","MoKα","","0.1209","0.0819","","","0.2233","0.2693","","","","","","1.091","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238135","9.9334","0.0006","9.5124","0.0005","14.9463","0.0009","90","","103.405","0.006","90","","1373.81","0.14","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Methoxy-4-(prop-2-en-1-yl)phenyl benzoate","","- C17 H16 O3 -","- C17 H16 O3 -","- C68 H64 O12 -","4","1","BT6914","Pichika, Mallikarjuna Rao; Kang, Yew Beng; Ng, Seik Weng","2-Methoxy-4-(prop-2-en-1-yl)phenyl benzoate","Acta Crystallographica Section E","2013","69","7","o1088","","10.1107/S1600536813015791","","","0.71073","MoKα","","0.0799","0.0514","","","0.1149","0.1383","","","","","","1.053","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238136","21.367","0.005","4.6382","0.0011","13.003","0.003","90","","105.468","0.012","90","","1242","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","<i>N</i>'-Hydroxypyridine-2-carboximidamide","","- C6 H7 N3 O -","- C6 H7 N3 O -","- C48 H56 N24 O8 -","8","1","BT6916","Suchetan, P. A.; Sreenivasa, S.; Palakshamurthy, B. S.; Madhu Chakrapani Rao, T.; Vijithkumar","<i>N</i>'-Hydroxypyridine-2-carboximidamide","Acta Crystallographica Section E","2013","69","7","o1180","","10.1107/S1600536813017418","","","0.71073","MoKα","","0.0344","0.0306","","","0.078","0.081","","","","","","1.079","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238137","11.8815","0.0008","5.2219","0.0003","18.9588","0.0012","90","","102.876","0.002","90","","1146.7","0.13","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis{2-[(5-hydroxypentyl)iminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>^1^}copper(II)","","- C24 H32 Cu N2 O4 -","- C24 H32 Cu N2 O4 -","- C48 H64 Cu2 N4 O8 -","2","0.5","BV2221","Modak, Ritwik; Patra, Santu; Mandal, Senjuti; Sikdar, Yeasin; Goswami, Sanchita","Bis{2-[(5-hydroxypentyl)iminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>^1^}copper(II)","Acta Crystallographica Section E","2013","69","7","m412","m413","10.1107/S1600536813016802","","","0.71073","MoKα","","0.0355","0.0299","","","0.09","0.0957","","","","","","0.947","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238138","14.5432","0.0004","14.5432","0.0004","14.9445","0.001","90","","90","","120","","2737.4","0.2","185","2","185","2","","","","","","","","4","R -3 :H","-R 3","148","","Poly[hexaaqua(μ~9~-cyclohexane-1,2,3,4,5,6-hexacarboxylato)trimanganese(II)]","","- C12 H18 Mn3 O18 -","- C12 H18 Mn3 O18 -","- C72 H108 Mn18 O108 -","6","0.333333","BX2441","Sun, Weixuan; Zang, Hu; Quan, Chengshi","Poly[hexaaqua(μ~9~-cyclohexane-1,2,3,4,5,6-hexacarboxylato)trimanganese(II)]","Acta Crystallographica Section E","2013","69","7","m384","","10.1107/S1600536813015626","","","0.71073","MoKα","","0.0278","0.025","","","0.0628","0.064","","","","","","1.08","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238139","8.9147","0.0001","10.127","0.0002","10.5101","0.0002","90.376","0.001","110.407","0.001","97.439","0.001","880.44","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Cyclohexyl-3-(3-fluorophenylsulfinyl)-2-methyl-1-benzofuran","","- C21 H21 F O2 S -","- C21 H21 F O2 S -","- C42 H42 F2 O4 S2 -","2","1","BX2442","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Cyclohexyl-3-(3-fluorophenylsulfinyl)-2-methyl-1-benzofuran","Acta Crystallographica Section E","2013","69","7","o1026","","10.1107/S160053681301475X","","","0.71073","MoKα","","0.0468","0.0424","","","0.1198","0.1244","","","","","","1.043","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238140","10.36","0.003","10.823","0.004","11.123","0.004","90","","98.27","0.02","90","","1234.2","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,5-Diamino-3-[(<i>E</i>,<i>E</i>)-4-(4,5-diamino-4<i>H</i>-1,2,4-triazol-3-yl)buta-1,3-dienyl]-4<i>H</i>-1,2,4-triazol-1-ium chloride","","- C8 H13 Cl N10 -","- C8 H13 Cl N10 -","- C32 H52 Cl4 N40 -","4","0.5","BX2445","Centore, Roberto; Piccialli, Vincenzo","4,5-Diamino-3-[(<i>E</i>,<i>E</i>)-4-(4,5-diamino-4<i>H</i>-1,2,4-triazol-3-yl)buta-1,3-dienyl]-4<i>H</i>-1,2,4-triazol-1-ium chloride","Acta Crystallographica Section E","2013","69","7","o1131","o1132","10.1107/S1600536813016589","","","0.71073","MoKα","","0.0779","0.047","","","0.112","0.128","","","","","","1.054","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238141","11.2203","0.0007","13.5658","0.0007","24.1946","0.0013","90","","90","","90","","3682.7","0.4","296","2","296","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(<i>E</i>)-<i>N</i>-(3,3-Diphenylallylidene)naphthalen-1-amine","","- C25 H19 N -","- C25 H19 N -","- C200 H152 N8 -","8","1","CV5411","Lee, Jae Kyun; Nam, Kee Dal; Cha, Joo Hwan; Cho, Yong Seo; Lee, Joon Kyun","(<i>E</i>)-<i>N</i>-(3,3-Diphenylallylidene)naphthalen-1-amine","Acta Crystallographica Section E","2013","69","7","o1025","","10.1107/S1600536813014888","","","0.71075","MoKα","","0.1245","0.0611","","","0.1479","0.1968","","","","","","0.945","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238142","6.5174","0.0004","13.1221","0.0008","16.3066","0.0009","90","","100.194","0.001","90","","1372.56","0.14","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichloridobis(pyridine-2-selenolato-κ^2^<i>N</i>,<i>Se</i>)tin(IV)","","- C10 H8 Cl2 N2 Se2 Sn -","- C10 H8 Cl2 N2 Se2 Sn -","- C40 H32 Cl8 N8 Se8 Sn4 -","4","0.5","CV5413","Mammadova, Gunay Z.; Ismaylova, Sheyda R.; Matsulevich, Zhanna V.; Osmanov, Vladimir K.; Borisov, Alexander V.; Khrustalev, Victor N.","Dichloridobis(pyridine-2-selenolato-κ^2^<i>N</i>,<i>Se</i>)tin(IV)","Acta Crystallographica Section E","2013","69","7","m364","m365","10.1107/S1600536813014657","","","0.71073","MoKα","","0.0334","0.0259","","","0.0591","0.0626","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238143","7.7223","0.0015","10.232","0.002","12.648","0.003","85.938","0.003","80.796","0.003","79.55","0.003","969.2","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","1,5-Bis(2-methoxybenzylidene)thiocarbonohydrazide methanol monosolvate","","- C18 H22 N4 O3 S -","- C18 H22 N4 O3 S -","- C36 H44 N8 O6 S2 -","2","1","CV5415","Yu, Jianfeng; Tang, Shiming; Zeng, Jingbin; Yan, Zifeng","1,5-Bis(2-methoxybenzylidene)thiocarbonohydrazide methanol monosolvate","Acta Crystallographica Section E","2013","69","7","o1147","","10.1107/S1600536813016954","","","0.71073","MoKα","","0.0594","0.049","","","0.1475","0.171","","","","","","1.008","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238144","10.372","0.0017","11.138","0.0014","11.167","0.001","69.428","0.01","86.87","0.011","70.379","0.01","1134.7","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{4-Bromo-2-[(2-{(ethylsulfanyl)[(2-oxidobenzylidene-κ<i>O</i>)amino-κ<i>N</i>]methylidene}hydrazinylidene-κ<i>N</i>^1^)methyl]phenolato-κ<i>O</i>}(ethanol-κ<i>O</i>)dioxidouranium(VI)","","- C19 H20 Br N3 O5 S U -","- C18.9988 H19.998 Br N3 O5 S0.9996 U -","- C37.9976 H39.996 Br2 N6 O10 S1.9992 U2 -","2","1","CV5416","Centore, Roberto; Ahmadi, Mehdi; Peluso, Andrea","{4-Bromo-2-[(2-{(ethylsulfanyl)[(2-oxidobenzylidene-κ<i>O</i>)amino-κ<i>N</i>]methylidene}hydrazinylidene-κ<i>N</i>^1^)methyl]phenolato-κ<i>O</i>}(ethanol-κ<i>O</i>)dioxidouranium(VI)","Acta Crystallographica Section E","2013","69","7","m362","m363","10.1107/S1600536813014669","","","0.71073","MoKα","","0.0446","0.0286","","","0.0606","0.0679","","","","","","1.082","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238145","10.247","0.004","6.395","0.002","36.265","0.012","90","","104.511","0.012","90","","2300.6","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>'-Diphenyl-9,10-dioxo-9,10-dihydroanthracene-2,7-disulfonamide","","- C26 H18 N2 O6 S2 -","- C26 H18 N2 O6 S2 -","- C104 H72 N8 O24 S8 -","4","1","CV5417","Yuan, Wei-Guan; Zhang, Hong-Ling","<i>N</i>,<i>N</i>'-Diphenyl-9,10-dioxo-9,10-dihydroanthracene-2,7-disulfonamide","Acta Crystallographica Section E","2013","69","7","o1172","","10.1107/S1600536813017303","","","0.71073","MoKα","","0.1547","0.0594","","","0.1125","0.1464","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238146","8.0199","0.0001","9.4807","0.0001","10.4971","0.0002","108.339","0.001","94.91","0.001","90.535","0.001","754.268","0.019","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-(3-Methoxyphenyl)-4,5-dimethyl-2-phenyl-1<i>H</i>-imidazole","","- C18 H18 N2 O -","- C18 H18 N2 O -","- C36 H36 N4 O2 -","2","1","CV5418","Rizwana Begum, S.; Hema, R.; Srinivasan, N.; Anitha, A. G.","1-(3-Methoxyphenyl)-4,5-dimethyl-2-phenyl-1<i>H</i>-imidazole","Acta Crystallographica Section E","2013","69","7","o1154","","10.1107/S1600536813016966","","","0.71073","MoKα","","0.0574","0.0464","","","0.1329","0.1484","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238147","9.112","0.0018","9.938","0.0002","10.135","0.0002","81.1","0.03","80.71","0.03","86.7","0.03","894.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-[(5-Methylthiophen-2-yl)methylidene]malononitrile","","- C9 H6 N2 S -","- C9 H6 N2 S -","- C36 H24 N8 S4 -","4","2","DS2229","Liu, Xuewei; Chen, Zhengbang; Cao, Weiwei; Gan, Haifeng; Guo, Kai","2-[(5-Methylthiophen-2-yl)methylidene]malononitrile","Acta Crystallographica Section E","2013","69","7","o1003","","10.1107/S1600536813014487","","","0.71073","MoKα","","0.175","0.0697","","","0.084","0.1024","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238148","7.139","0.0013","9.6189","0.0013","10.4756","0.0015","93.767","0.011","101.546","0.014","90.644","0.013","703.05","0.19","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Boric acid‒1,10-phenanthroline (2/1)","","- C12 H14 B2 N2 O6 -","- C12 H14 B2 N2 O6 -","- C24 H28 B4 N4 O12 -","2","1","EZ2287","Mirjafari, Arsalan; Pham, Lam; Smith, Philip J.; Sykora, Richard E.; Davis, Jr, James H.","A co-crystal of 1,10-phenanthroline with boric acid: a novel aza-aromatic complex","Acta Crystallographica Section E","2013","69","7","o1067","o1068","10.1107/S1600536813015134","","","0.71073","MoKα","","0.0529","0.0362","","","0.0859","0.0962","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238149","9.5405","0.0002","10.943","0.0009","19.2901","0.0006","90","","90","","90","","2013.92","0.18","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Methyl-1,1-diphenyl-2-[(4<i>S</i>)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]propan-1-ol","","- C25 H25 N O2 -","- C25 H25 N O2 -","- C100 H100 N4 O8 -","4","1","FB2285","Jia, Wen-Xiao; Hu, Yu-Lai; Huang, Dang-Feng; Niu, Teng; Ma, Yan-Jun","2-Methyl-1,1-diphenyl-2-[(4<i>S</i>)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]propan-1-ol","Acta Crystallographica Section E","2013","69","7","o1022","","10.1107/S1600536813014670","","","0.71073","MoKα","","0.0551","0.0454","","","0.0957","0.1018","","","","","","1.083","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238150","7.8963","0.0019","9.164","0.002","9.244","0.002","73.028","0.004","76.547","0.004","77.824","0.004","614.8","0.2","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","1,4,10,13-Tetraoxa-7,16-diazoniacyclooctadecane bis(1<i>H</i>-pyrrole-2-carboxylate)","","- C22 H36 N4 O8 -","- C22 H36 N4 O8 -","- C22 H36 N4 O8 -","1","0.5","FF2108","Zeng, Fanglei; Yin, Zhenming","1,4,10,13-Tetraoxa-7,16-diazoniacyclooctadecane bis(1<i>H</i>-pyrrole-2-carboxylate)","Acta Crystallographica Section E","2013","69","7","o1108","","10.1107/S1600536813016176","","","0.71073","MoKα","","0.0683","0.0416","","","0.0987","0.1129","","","","","","1.028","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238151","13.918","0.0009","7.198","0.0005","11.6509","0.0012","90","","125.249","0.001","90","","953.2","0.13","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(1<i>H</i>-Imidazol-4-yl)methanol","","- C4 H6 N2 O -","- C4 H6 N2 O -","- C32 H48 N16 O8 -","8","1","FJ2622","Sanders, Marisa B.; Farrokh, John C.; Hardie, Joseph; Chan, Benny C.","(1<i>H</i>-Imidazol-4-yl)methanol","Acta Crystallographica Section E","2013","69","7","o1151","","10.1107/S160053681301636X","","","0.71073","MoKα","","0.0368","0.0349","","","0.0925","0.0945","","","","","","1.071","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238152","6.8487","0.0002","7.4436","0.0002","21.8378","0.0005","90","","91.833","0.001","90","","1112.7","0.05","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-(Naphthalen-1-yl)pyridine","","- C15 H11 N -","- C15 H11 N -","- C60 H44 N4 -","4","1","FJ2629","Vetter, Antje; Seichter, Wilhelm; Weber, Edwin","4-(Naphthalen-1-yl)pyridine","Acta Crystallographica Section E","2013","69","7","o1033","","10.1107/S1600536813014372","","","0.71073","MoKα","","0.0579","0.0468","","","0.1323","0.1469","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238153","5.1144","0.0001","17.8029","0.0004","16.5365","0.0005","90","","97.009","0.002","90","","1494.42","0.06","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Bromo-1,3-bis[(1,3-dioxolan-2-yl)methyl]-1<i>H</i>-imidazo[4,5-<i>b</i>]pyridin-2(3<i>H</i>)-one","","- C14 H16 Br N3 O5 -","- C14 H16 Br N3 O5 -","- C56 H64 Br4 N12 O20 -","4","1","FJ2631","Kandri Rodi, Youssef; Haoudi, Amal; Capet, Frédéric; Mazzah, Ahmed; Essassi, El Mokhtar; El Ammari, Lahcen","6-Bromo-1,3-bis[(1,3-dioxolan-2-yl)methyl]-1<i>H</i>-imidazo[4,5-<i>b</i>]pyridin-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","7","o1029","o1030","10.1107/S1600536813014591","","","0.71073","MoKα","","0.0508","0.0346","","","0.0825","0.0888","","","","","","1.019","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238154","10.964","0.002","9.155","0.001","14.74","0.002","90","","92.98","0.01","90","","1477.5","0.4","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3β,6α-Diacetoxy-5,9α-dihydroxy-5α-cholest-7-en-11-one","","- C31 H48 O7 -","- C31 H48 O7 -","- C62 H96 O14 -","2","1","FJ2632","Piccialli, Vincenzo; Tuzi, Angela; Oliviero, Giorgia; Borbone, Nicola; Centore, Roberto","3β,6α-Diacetoxy-5,9α-dihydroxy-5α-cholest-7-en-11-one","Acta Crystallographica Section E","2013","69","7","o1109","o1110","10.1107/S1600536813016206","","","0.71073","MoKα","","0.0909","0.047","","","0.087","0.1065","","","","","","1.072","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238155","9.4097","0.0005","9.2191","0.0005","18.7473","0.0009","90","","90","","90","","1626.31","0.15","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(2<i>S</i>*,5<i>R</i>*)-2,5-Dimethyl-1,4-bis(pyridin-2-ylmethyl)piperazine","","- C18 H24 N4 -","- C18 H24 N4 -","- C72 H96 N16 -","4","0.5","FJ2633","Goh, Christopher; Morris, Lilliana S.; Girouard, Michael P.; Chidanguro, Tamuka; Jasinski, Jerry P.","(2<i>S</i>*,5<i>R</i>*)-2,5-Dimethyl-1,4-bis(pyridin-2-ylmethyl)piperazine","Acta Crystallographica Section E","2013","69","7","o1101","","10.1107/S160053681301605X","","","1.5418","CuKα","","0.0477","0.0444","","","0.127","0.1311","","","","","","1.071","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238156","10.016","0.0008","22.661","0.002","10.2611","0.0011","90","","101.392","0.005","90","","2283.1","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>'-[(<i>E</i>)-4-Benzyloxy-2-hydroxybenzylidene]-4-nitrobenzohydrazide dimethylformamide monosolvate","","- C24 H24 N4 O6 -","- C24 H24 N4 O6 -","- C96 H96 N16 O24 -","4","1","FJ2634","Joseph, Bibitha; Sithambaresan, M.; Kurup, M. R. Prathapachandra","<i>N</i>'-[(<i>E</i>)-4-Benzyloxy-2-hydroxybenzylidene]-4-nitrobenzohydrazide dimethylformamide monosolvate","Acta Crystallographica Section E","2013","69","7","o1160","o1161","10.1107/S1600536813017091","","","0.71073","MoKα","","0.0987","0.0528","","","0.1368","0.1759","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238157","7.917","0.002","8.739","0.002","9.574","0.003","70.415","0.013","81.985","0.014","73.283","0.013","597","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3,3-Bis(methylsulfanyl)-1-(4-nitrophenyl)prop-2-en-1-one","","- C11 H11 N O3 S2 -","- C11 H11 N O3 S2 -","- C22 H22 N2 O6 S4 -","2","1","FY2092","Yu, Guan-Neng; Xia, Jian-Hui; Xu, Zhao-Hui; Wang, Li-Ben; Yu, Chu-Yi","3,3-Bis(methylsulfanyl)-1-(4-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","7","o1036","","10.1107/S1600536813014542","","","0.71073","MoKα","","0.0639","0.0551","","","0.1103","0.1145","","","","","","1.152","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238158","12.5736","0.0007","8.3815","0.0004","17.4945","0.0008","90","","112.151","0.002","90","","1707.59","0.15","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 4-(4-chlorophenyl)-2-methyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carboxylate","","- C19 H18 Cl N O3 -","- C19 H18 Cl N O3 -","- C76 H72 Cl4 N4 O12 -","4","1","FY2095","Wang, Ke; Wang, Weike; Wang, Yifeng; Xu, Danqian","Ethyl 4-(4-chlorophenyl)-2-methyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carboxylate","Acta Crystallographica Section E","2013","69","7","o1127","","10.1107/S1600536813016541","","","0.71073","MoKα","","0.0726","0.0498","","","0.1109","0.1275","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238159","9.5037","0.0006","12.4162","0.001","24.8982","0.0018","90","","90","","90","","2938","0.4","180","2","180","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3<i>R</i>*,6<i>R</i>*,4'<i>S</i>*,8'<i>R</i>*,3''<i>R</i>*,6''<i>R</i>*)-3,3''-Diisopropyl-6,6''-dimethyl-2',6'-diphenyldispiro[cyclohexane-1,4'-(3,7-dioxa-2,6-diazabicyclo[3.3.0]octane)-8',1''-cyclohexane]-2,2''-dione","","- C34 H44 N2 O4 -","- C34 H44 N2 O4 -","- C136 H176 N8 O16 -","4","1","FY2097","Ansari, Abdeslam; Majidi, Lhou; Fihi, Rachid; Daran, Jean-Claude; Azrour, Mohamed","(3<i>R</i>*,6<i>R</i>*,4'<i>S</i>*,8'<i>R</i>*,3''<i>R</i>*,6''<i>R</i>*)-3,3''-Diisopropyl-6,6''-dimethyl-2',6'-diphenyldispiro[cyclohexane-1,4'-(3,7-dioxa-2,6-diazabicyclo[3.3.0]octane)-8',1''-cyclohexane]-2,2''-dione","Acta Crystallographica Section E","2013","69","7","o1162","o1163","10.1107/S1600536813017054","","","0.71073","MoKα","","0.0862","0.0446","","","0.0714","0.0796","","","","","","0.865","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238160","7.2094","0.0003","14.8067","0.0006","18.1459","0.0007","109.797","0.002","99.921","0.003","92.056","0.003","1785.99","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4,7-Diphenyl-1,10-phenanthroline methanol hemisolvate","","- C24.5 H18 N2 O0.5 -","- C24.5 H18 N2 O0.5 -","- C98 H72 N8 O2 -","4","2","FY2098","Martins, João P.; Martín-Ramos, Pablo; Sobral, Abílio J. F. N.; Ramos Silva, Manuela","4,7-Diphenyl-1,10-phenanthroline methanol hemisolvate","Acta Crystallographica Section E","2013","69","7","o1018","","10.1107/S1600536813014682","","","0.71073","MoKα","","0.1221","0.057","","","0.1367","0.1701","","","","","","0.975","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238161","6.441","0.001","7.018","0.001","9.298","0.002","99.05","0.03","96.7","0.03","100.54","0.03","403.46","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl <i>N</i>-(dimethoxyphosphoryl)carbamate","","- C4 H10 N O5 P -","- C4 H10 N O5 P -","- C8 H20 N2 O10 P2 -","2","1","GG2115","Ovchynnikov, Vladimir","Methyl <i>N</i>-(dimethoxyphosphoryl)carbamate","Acta Crystallographica Section E","2013","69","7","o1188","o1189","10.1107/S1600536813017637","","","0.71069","MoKα","","0.0505","0.048","","","0.1319","0.1333","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238162","12.3698","0.0008","7.9967","0.0005","17.4195","0.001","90","","100.323","0.004","90","","1695.2","0.18","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Fluoro-2-(4-fluorophenyl)-7-methyl-3-phenylsulfinyl-1-benzofuran","","- C21 H14 F2 O2 S -","- C21 H14 F2 O2 S -","- C84 H56 F8 O8 S4 -","4","1","GG2118","Seo, Pil Ja; Choi, Hong Dae; Lee, Uk","5-Fluoro-2-(4-fluorophenyl)-7-methyl-3-phenylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2013","69","7","o1187","","10.1107/S1600536813017583","","","0.71073","MoKα","","0.0664","0.0442","","","0.1115","0.1229","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238163","10.0451","0.0002","15.0631","0.0005","12.2008","0.0004","90","","123.257","0.002","90","","1543.75","0.09","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(±)-3-(5-Amino-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-2-benzofuran-1(3<i>H</i>)-one","","","- C18 H15 N3 O2 -","- C18 H15 N3 O2 -","- C72 H60 N12 O8 -","4","1","GG2119","Moreno-Fuquen, Rodolfo; Castillo, Juan C.; Abonia, Rodrigo; Ellena, Javier; Tenorio, Juan C.","(±)-3-(5-Amino-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-2-benzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","7","o1181","o1182","10.1107/S1600536813017479","","","0.71073","MoKα","","0.0926","0.0564","","","0.1452","0.1733","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238164","40.5848","0.0004","5.32093","0.00005","13.071","0.0001","90","","90","","90","","2822.67","0.04","100.01","0.1","100.01","0.1","","","","","","","","4","P b c n","-P 2n 2ab","60","","Methyl 3-(10-bromoanthracen-9-yl)prop-2-enoate","","- C18 H13 Br O2 -","- C18 H13 Br O2 -","- C144 H104 Br8 O16 -","8","1","GK2574","Bugenhagen, Bernhard; Al Jasem, Yosef; al Hindawi, Bassam; Al Rawashdeh, Nathir; Thiemann, Thies","(<i>E</i>)-Methyl 3-(10-bromoanthracen-9-yl)acrylate","Acta Crystallographica Section E","2013","69","7","o1138","o1139","10.1107/S1600536813016905","","","1.5418","CuKα","","0.0274","0.0264","","","0.0656","0.0659","","","","","","1.117","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238165","7.8796","0.0006","22.5891","0.0015","9.4626","0.0007","90","","110.446","0.003","90","","1578.2","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","4-(4-Methylphenylsulfonyl)piperazin-1-ium trifluoroacetate","","- C13 H17 F3 N2 O4 S -","- C13 H17 F3 N2 O4 S -","- C52 H68 F12 N8 O16 S4 -","4","1","GK2578","Sreenivasa, S.; Mohan, N. R.; Madhu Chakrapani Rao, T.; Suchetan, P. A.; Palakshamurthy, B. S.; Vijithkumar","4-(4-Methylphenylsulfonyl)piperazin-1-ium trifluoroacetate","Acta Crystallographica Section E","2013","69","7","o1112","","10.1107/S1600536813015900","","","0.71073","MoKα","","0.044","0.0371","","","0.0893","0.094","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238166","5.8947","0.0009","7.6941","0.0012","14.029","0.002","83.273","0.007","80.086","0.007","72.44","0.006","596.13","0.16","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>'-[(<i>E</i>)-4-Bromobenzylidene]pyrazine-2-carbohydrazide","","- C12 H9 Br N4 O -","- C12 H9 Br N4 O -","- C24 H18 Br2 N8 O2 -","2","1","GK2580","Hameed, Shahid; Ahmad, Mushtaq; Tahir, M. Nawaz; Shah, Muhammad Abdullah; Shad, Hazoor Ahmad","<i>N</i>'-[(<i>E</i>)-4-Bromobenzylidene]pyrazine-2-carbohydrazide","Acta Crystallographica Section E","2013","69","7","o1141","","10.1107/S1600536813016917","","","0.71073","MoKα","","0.0981","0.0389","","","0.0713","0.0842","","","","","","0.943","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238167","21.3085","0.0006","18.6249","0.0004","7.48851","0.00019","90","","90","","90","","2971.96","0.13","291","2","291.15","","","","","","","","","4","P c c n","-P 2ab 2ac","56","piribedil","2-{4-[(1,3-Benzodioxol-5-yl)methyl]piperazin-1-yl}pyrimidine","","- C16 H18 N4 O2 -","- C16 H18 N4 O2 -","- C128 H144 N32 O16 -","8","1","GK2582","Wu, Chunli; Li, Jieming; Wei, Huijie; Hang, Ye; Jiang, Yueming","2-{4-[(1,3-Benzodioxol-5-yl)methyl]piperazin-1-yl}pyrimidine","Acta Crystallographica Section E","2013","69","7","o1140","","10.1107/S1600536813016851","","","1.5418","CuKα","","0.0486","0.0389","","","0.1049","0.1124","","","","","","1.029","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238168","20.5074","0.0007","15.4134","0.0005","9.8568","0.0003","90","","90","","90","","3115.62","0.17","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","<i>N</i>-[3-(Dimethylamino)propyl]-<i>N</i>,<i>N</i>',<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethylguanidinium tetraphenylborate","","- C35 H47 B N4 -","- C35 H47 B N4 -","- C140 H188 B4 N16 -","4","1","GO2091","Tiritiris, Ioannis","<i>N</i>-[3-(Dimethylamino)propyl]-<i>N</i>,<i>N</i>',<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethylguanidinium tetraphenylborate","Acta Crystallographica Section E","2013","69","7","o1040","","10.1107/S1600536813014906","","","0.71073","MoKα","","0.0826","0.0574","","","0.1264","0.1368","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238169","12.6447","0.0003","7.168","0.0002","19.2382","0.0005","90","","100.592","0.002","90","","1713.99","0.08","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Ethylsulfinyl-2-(3-fluorophenyl)-5-phenyl-1-benzofuran","","- C22 H17 F O2 S -","- C22 H17 F O2 S -","- C88 H68 F4 O8 S4 -","4","1","GO2092","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","3-Ethylsulfinyl-2-(3-fluorophenyl)-5-phenyl-1-benzofuran","Acta Crystallographica Section E","2013","69","7","o1093","","10.1107/S1600536813015924","","","0.71073","MoKα","","0.0594","0.0464","","","0.1194","0.1281","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238170","17.083","0.002","12.139","0.003","13.597","0.002","90","","90.76","0.01","90","","2819.4","0.9","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Naphthalene-1,8-diamine‒2-(pyrimidin-2-yl)-1<i>H</i>-perimidine (2/1)","","- C35 H30 N8 -","- C35 H30 N8 -","- C140 H120 N32 -","4","1","GO2093","Cucciolito, Maria Elena; Panunzi, Barbara; Ruffo, Francesco; Tuzi, Angela","Naphthalene-1,8-diamine‒2-(pyrimidin-2-yl)-1<i>H</i>-perimidine (2/1)","Acta Crystallographica Section E","2013","69","7","o1133","o1134","10.1107/S1600536813016796","","","0.71073","MoKα","","0.1434","0.0649","","","0.1168","0.1416","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238171","8.4925","0.0002","13.0302","0.0004","14.1381","0.0009","90","","90","","90","","1564.51","0.12","293.69","0.1","293.69","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","8β-Ethoxyeremophil-3,7(11)-diene-8α,12;6α,15-diolide","","- C17 H20 O5 -","- C17 H20 O5 -","- C68 H80 O20 -","4","1","HB7083","Fei, Dong-Qing; Dong, Le-Le; Li, Hui-Hong; Zhang, Zhan-Xin","8β-Ethoxyeremophil-3,7(11)-diene-8α,12;6α,15-diolide","Acta Crystallographica Section E","2013","69","7","o1087","","10.1107/S1600536813015729","","","1.5418","CuKα","","0.0383","0.0368","","","0.1004","0.1025","","","","","","1.03","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238172","21.324","0.004","9.148","0.0018","12.95","0.003","90","","116.36","0.03","90","","2263.5","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-Nitro-<i>N</i>^2^-(pyridin-4-ylmethylidene)benzene-1,2-diamine","","- C12 H10 N4 O2 -","- C12 H10 N4 O2 -","- C96 H80 N32 O16 -","8","1","HB7085","Liu, Guang-Lin; Sun, Jun; Zhang, Jing-Chao; Mei, Jie; Guo, Cheng","4-Nitro-<i>N</i>^2^-(pyridin-4-ylmethylidene)benzene-1,2-diamine","Acta Crystallographica Section E","2013","69","7","o1073","","10.1107/S1600536813015481","","","0.71073","MoKα","","0.1067","0.0575","","","0.1435","0.1747","","","","","","1.005","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238173","9.3438","0.0003","11.3626","0.0004","13.5713","0.0004","68.687","0.001","88.284","0.001","66.757","0.001","1222.49","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","6-(4-Methoxyphenyl)-6a-nitro-6,6a,6b,7,8,9,10,12a-octahydrospiro[chromeno[3,4-<i>a</i>]indolizine-12,3'-indolin]-2'-one","","- C29 H27 N3 O5 -","- C29 H27 N3 O5 -","- C58 H54 N6 O10 -","2","1","HB7087","Devi, Seenivasan Karthiga; Srinivasan, Thothadri; Rao, Jonnalagadda Naga Siva; Raghunathan, Raghavachary; Velmurugan, Devadasan","6-(4-Methoxyphenyl)-6a-nitro-6,6a,6b,7,8,9,10,12a-octahydrospiro[chromeno[3,4-<i>a</i>]indolizine-12,3'-indolin]-2'-one","Acta Crystallographica Section E","2013","69","7","o1047","","10.1107/S1600536813015341","","","0.71073","MoKα","","0.0503","0.0421","","","0.111","0.1191","","","","","","1.033","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238174","17.826","0.007","13.358","0.005","7.12","0.003","90","","90","","90","","1695.4","1.2","150","2","150","2","","","","","","","","6","P n a 21","P 2c -2n","33","","2,2'-(Disulfanediyl)dianilinium dichloride dihydrate","","- C12 H18 Cl2 N2 O2 S2 -","- C12 H18 Cl2 N2 O2 S2 -","- C48 H72 Cl8 N8 O8 S8 -","4","1","HB7089","Bouchareb, Hasna; Boudraa, Mhamed; Bouacida, Sofiane; Merazig, Hocin","2,2'-(Disulfanediyl)dianilinium dichloride dihydrate","Acta Crystallographica Section E","2013","69","7","o1078","o1079","10.1107/S1600536813015742","","","0.71073","MoKα","","0.1109","0.063","","","0.1183","0.1336","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238175","8.4047","0.0003","8.7285","0.0003","19.5086","0.0007","90","","94.113","0.002","90","","1427.47","0.09","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2<i>E</i>)-1-(Pyridin-2-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one","","- C17 H17 N O4 -","- C17 H17 N O4 -","- C68 H68 N4 O16 -","4","1","HB7090","Chantrapromma, Suchada; Suwunwong, Thitipone; Boonnak, Nawong; Fun, Hoong-Kun","(2<i>E</i>)-1-(Pyridin-2-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","7","o1076","o1077","10.1107/S1600536813015821","","","0.71073","MoKα","","0.1081","0.0665","","","0.1636","0.1884","","","","","","1.066","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238176","12.29","0.008","13.548","0.009","17.24","0.011","90","","90","","90","","2871","3","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","<i>N</i>-[(2-Chlorophenyl)sulfonyl]-3-nitrobenzamide","","- C13 H9 Cl N2 O5 S -","- C13 H9 Cl N2 O5 S -","- C104 H72 Cl8 N16 O40 S8 -","8","1","HB7091","Sreenivasa, S.; Darshan, D.; Lohith, T. N.; Mamatha, G. R.; Palakshamurthy, B. S.; Suchetan, P. A.","<i>N</i>-[(2-Chlorophenyl)sulfonyl]-3-nitrobenzamide","Acta Crystallographica Section E","2013","69","7","o1090","","10.1107/S1600536813015912","","","0.71073","MoKα","","0.0469","0.0391","","","0.0897","0.0948","","","","","","1.056","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238177","9.724","0.002","10.007","0.002","10.755","0.002","99.56","0.01","114.667","0.008","110.283","0.009","830.7","0.3","98","2","98","2","","","","","","","","4","P -1","-P 1","2","","4-Carboxypyridin-1-ium 2,4,5-tricarboxybenzoate monohydrate","","- C16 H13 N O11 -","- C16 H13 N O11 -","- C32 H26 N2 O22 -","2","1","HB7093","Arman, Hadi D.; Tiekink, Edward R. T.","4-Carboxypyridin-1-ium 2,4,5-tricarboxybenzoate monohydrate","Acta Crystallographica Section E","2013","69","7","o1122","o1123","10.1107/S1600536813016437","","","0.71073","MoKα","","0.0608","0.0561","","","0.1298","0.1329","","","","","","1.167","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238178","7.3643","0.0003","10.6795","0.0005","13.1038","0.0006","91.822","0.004","101.311","0.004","91.792","0.003","1009.31","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(2<i>E</i>)-1-(4-Bromophenyl)-3-[3-(4-methoxyphenyl)-1-phenyl-1<i>H</i>-pyrazol-4-yl]prop-2-en-1-one","","- C25 H19 Br N2 O2 -","- C25 H19 Br N2 O2 -","- C50 H38 Br2 N4 O4 -","2","1","HB7095","Prasath, R.; Bhavana, P.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-1-(4-Bromophenyl)-3-[3-(4-methoxyphenyl)-1-phenyl-1<i>H</i>-pyrazol-4-yl]prop-2-en-1-one","Acta Crystallographica Section E","2013","69","7","o1143","o1144","10.1107/S1600536813016838","","","0.71073","MoKα","","0.0559","0.0431","","","0.1028","0.1107","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238179","7.0399","0.0014","7.1795","0.0014","11.817","0.002","90","","102.72","0.03","90","","582.6","0.2","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Benzyl-5-ethyl-5-hydroxy-1<i>H</i>-pyrrol-2(5<i>H</i>)-one","","- C13 H15 N O2 -","- C13 H15 N O2 -","- C26 H30 N2 O4 -","2","1","HB7096","Gao, Yan-Jiao; Wang, Yu-Huang; Ye, Jian-Liang","1-Benzyl-5-ethyl-5-hydroxy-1<i>H</i>-pyrrol-2(5<i>H</i>)-one","Acta Crystallographica Section E","2013","69","7","o1136","","10.1107/S1600536813016887","","","0.71073","MoKα","","0.0519","0.044","","","","0.1451","","","","","","1.126","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238180","12.8221","0.0006","10.7281","0.0004","16.3785","0.0006","90","","90","","90","","2252.97","0.16","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-Acetyl-2,4-dimethylquinolin-1-ium chloride","","- C13 H14 Cl N O -","- C13 H14 Cl N O -","- C104 H112 Cl8 N8 O8 -","8","1","HB7097","Prasath, R.; Bhavana, P.; Ng, Seik Weng; Tiekink, Edward R. T.","3-Acetyl-2,4-dimethylquinolin-1-ium chloride","Acta Crystallographica Section E","2013","69","7","o1142","","10.1107/S160053681301684X","","","0.71073","MoKα","","0.043","0.0351","","","0.0911","0.0987","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238181","14.8804","0.001","17.3004","0.0011","12.1888","0.0008","90","","103.929","0.007","90","","3045.6","0.4","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","15,20,46,51,64,69,74,79-Octaoxatridecacyclo[32.28.8.8^3,28^.1^13,53^.1^22,44^.0^9,14^.0^21,26^.0^38,70^.0^40,45^.0^52,57^.0^59,63^.0^7,80^.0^32,73^]octaconta-1(63),3,5,7(80),9(14),10,12,21,23,25,28(73),29,31,34,36,38(70),40,42,44,52,54,56,59,61-tetracosaene benzene monosolvate","","- C78 H78 O8 -","- C78 H78 O8 -","- C156 H156 O16 -","2","0.5","HG5315","Hailu, Shimelis T.; Butcher, Ray J.; Hudrlik, Paul F.; Hudrlik, Anne M.","Calixarene-based molecular capsule from olefin metathesis","Acta Crystallographica Section E","2013","69","7","o1001","o1002","10.1107/S1600536813014438","","","1.54178","CuKα","","0.1252","0.0777","","","0.2183","0.2488","","","","","","0.998","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238182","14.7232","0.0005","16.2151","0.0005","20.9433","0.0008","90","","106.087","0.001","90","","4804.2","0.3","153.15","","153.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis{[2,2'-(5,8,11-trithia-2,14-diazapentadeca-1,14-diene-1,15-diyl)diphenolato]palladium(II)}{ acetonitrile hemisolvate","","- C46 H55 N5 O4 Pd2 S6 -","- C46 H55 N5 O4 Pd2 S6 -","- C184 H220 N20 O16 Pd8 S24 -","4","1","HG5318","Dawe, Louise Nicole; Adhikary, Bibhutosh; Collins, Julie L.; Lucas, C. Robert","Bis{[2,2'-(5,8,11-trithia-2,14-diazapentadeca-1,14-diene-1,15-diyl)diphenolato]palladium(II)} acetonitrile monosolvate","Acta Crystallographica Section E","2013","69","7","m360","m361","10.1107/S1600536813014712","","","0.7107","MoKα","","0.0423","0.0412","","","0.1031","0.1043","","","","","","1.072","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238183","8.0446","0.0004","8.9973","0.0005","9.1464","0.0004","117.805","0.006","90.939","0.004","109.64","0.005","539.46","0.06","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","2-Aminopyridin-1-ium triiodide","","- C5 H7 I3 N2 -","- C5 H7 I3 N2 -","- C10 H14 I6 N4 -","2","1","HG5319","Reiss, Guido J.; Leske, Peer B.","2-Aminopyridin-1-ium triiodide","Acta Crystallographica Section E","2013","69","7","o1060","o1061","10.1107/S1600536813015389","","","0.71073","MoKα","","0.0196","0.0182","","","0.0401","0.0407","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238184","4.014","0.004","6.833","0.007","33.85","0.03","90","","90.77","0.02","90","","928.3","1.6","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","3-(Prop-2-yn-1-yloxy)phthalonitrile","3-(Prop-2-yn-1-yloxy)benzene-1,2-dicarbonitrile","","- C11 H6 N2 O -","- C11 H6 N2 O -","- C44 H24 N8 O4 -","4","1","HG5321","Jan, Chin Yee; Shamsudin, Norzianah Binti Haji; Tan, Ai Ling; Young, David J.; Tiekink, Edward R. T.","3-(Prop-2-yn-1-yloxy)phthalonitrile","Acta Crystallographica Section E","2013","69","7","o1074","","10.1107/S1600536813015663","","","0.71073","MoKα","","0.1003","0.0858","","","0.2401","0.2502","","","","","","1.132","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238185","6.2198","0.0011","23.234","0.004","11.344","0.002","90","","94.733","0.012","90","","1633.7","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7-Bromo-2-(4-methylphenyl)-1-(methylsulfinyl)naphtho[2,1-<i>b</i>]furan","","- C20 H15 Br O2 S -","- C20 H15 Br O2 S -","- C80 H60 Br4 O8 S4 -","4","1","HG5324","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","7-Bromo-2-(4-methylphenyl)-1-(methylsulfinyl)naphtho[2,1-<i>b</i>]furan","Acta Crystallographica Section E","2013","69","7","o1148","","10.1107/S1600536813016978","","","0.71073","MoKα","","0.0611","0.0429","","","0.1084","0.1167","","","","","","1.043","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238186","13.987","0.0004","15.7103","0.0004","8.5532","0.0003","90","","90","","90","","1879.48","0.1","100","2","100","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","3-({[Bis(2-methylpropyl)carbamothioyl]amino}carbonyl)benzamide","","- C17 H25 N3 O2 S -","- C17 H25 N3 O2 S -","- C68 H100 N12 O8 S4 -","4","1","HG5326","Selvakumaran, N.; Karvembu, R.; Ng, Seik Weng; Tiekink, Edward R. T.","3-({[Bis(2-methylpropyl)carbamothioyl]amino}carbonyl)benzamide","Acta Crystallographica Section E","2013","69","7","o1183","","10.1107/S1600536813017455","","","0.71073","MoKα","","0.0439","0.0386","","","0.0934","0.0974","","","","","","0.999","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238187","11.3448","0.0005","18.61","0.0008","19.3282","0.0007","90","","97.297","0.004","90","","4047.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-{[(Dibenzylcarbamothioyl)amino]carbonyl}benzamide","","- C23 H21 N3 O2 S -","- C23 H21 N3 O2 S -","- C184 H168 N24 O16 S8 -","8","2","HG5327","Selvakumaran, N.; Karvembu, R.; Ng, Seik Weng; Tiekink, Edward R. T.","3-{[(Dibenzylcarbamothioyl)amino]carbonyl}benzamide","Acta Crystallographica Section E","2013","69","7","o1184","o1185","10.1107/S1600536813017467","","","0.71073","MoKα","","0.089","0.058","","","0.1125","0.1242","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238188","10.2347","0.0012","10.8608","0.0013","13.7452","0.0017","79.053","0.002","78.745","0.001","86.326","0.002","1470.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Poly[[tetraaquatetrakis[μ~3~-5-(pyridine-4-carboxamido)isophthalato]nickel(II)diterbium(III)] tetrahydrate]","","- C56 H48 N8 Ni O28 Tb2 -","- C56 H48 N8 Ni O28 Tb2 -","- C56 H48 N8 Ni O28 Tb2 -","1","0.5","HY2627","Deng, Yi-Fang; Chen, Man-Sheng; Zhang, Chun-Hua; Nie, Xue","Poly[[tetraaquatetrakis[μ~3~-5-(pyridine-4-carboxamido)isophthalato]nickel(II)diterbium(III)] tetrahydrate]","Acta Crystallographica Section E","2013","69","7","m358","m359","10.1107/S1600536813014876","","","0.71073","MoKα","","0.0369","0.0325","","","0.0725","0.0737","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238189","14.66","0.0003","5.4905","0.0002","9.7928","0.0003","90","","90","","90","","788.23","0.04","296","2","296","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","<i>catena</i>-Poly[(diaquacadmium)-μ-iminodiacetato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>'']","","- C4 H9 Cd N O6 -","- C4 H9 Cd N O6 -","- C16 H36 Cd4 N4 O24 -","4","1","HY2628","Pan, Gang-Hong; Tang, Jin-Niu; Huang, Zhong-Jing; Liao, Yi-Fan; Mo, Bo-Fa","<i>catena</i>-Poly[(diaquacadmium)-μ-iminodiacetato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>'']","Acta Crystallographica Section E","2013","69","7","m416","","10.1107/S1600536813017121","","","0.71073","MoKα","","0.0514","0.0468","","","0.1605","0.1643","","","","","","1.093","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238190","7.8896","0.0013","10.9493","0.0017","30.683","0.005","90","","90","","90","","2650.6","0.7","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 3-[(chloromethoxy)carbonyloxy]-7-hydroxycholan-24-oate","","- C27 H43 Cl O6 -","- C27 H43 Cl O6 -","- C108 H172 Cl4 O24 -","4","1","IM2434","Zhong, Jia-Liang; Sun, Wen-Xia; Zhang, Fu-Li; Liu, Li-Hong; Liu, He","Methyl 3-[(chloromethoxy)carbonyloxy]-7-hydroxycholan-24-oate","Acta Crystallographica Section E","2013","69","7","o1186","","10.1107/S160053681301725X","","","0.71073","MoKα","","0.1066","0.0504","","","0.0987","0.1181","","","","","","0.942","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238191","16.064","0.0015","7.6562","0.0007","20.1991","0.0019","90","","98.163","0.002","90","","2459.1","0.4","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-[5-(4-fluorophenyl)pyridine-3-yl]-1-[3-(2-oxopyrrolidin-1-yl)propyl] -1<i>H</i>-benzo[<i>d</i>]imidazole-5-carboxylate","","- C28 H29 F N4 O4 -","- C28 H29 F N4 O4 -","- C112 H116 F4 N16 O16 -","4","1","IS5275","Yeong, Keng Yoon; Ali, Mohamed Ashraf; Choon, Tan Soo; Rosli, Mohd Mustaqim; Razak, Ibrahim Abdul","Ethyl 2-[5-(4-fluorophenyl)pyridin-3-yl]-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1<i>H</i>-benzimidazole-5-carboxylate","Acta Crystallographica Section E","2013","69","7","o1013","o1014","10.1107/S1600536813014177","","","0.71073","MoKα","","0.0591","0.0417","","","0.1015","0.1131","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238192","7.0138","0.0005","16.09","0.001","16.49","0.002","90","","90","","90","","1860.9","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Vincanine ethanol monosolvate","(-)-Norfluorocurarine ethanol monosolvate","","- C21 H26 N2 O2 -","- C21 H26 N2 O2 -","- C84 H104 N8 O8 -","4","1","IS5277","Adizov, Shahobiddin M.; Ashurov, Jamshid; Karimov, Zokir; Yuldashev, Pattax Kh.; Tashkhodjaev, Bakhodir","({-})-Norfluorocurarine ethanol monosolvate","Acta Crystallographica Section E","2013","69","7","o1100","","10.1107/S1600536813015365","","","1.54184","CuKα","","0.07","0.0511","","","0.1298","0.1415","","","","","","0.99","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238193","11.916","0.005","10.876","0.005","21.153","0.005","90","","105.797","0.005","90","","2637.9","1.8","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 11,14,16-triphenyl-8,12-dioxa-14,15-diazatetracyclo[8.7.0.0^2,7^.0^13,17^]heptadeca-2(7),3,5,13(17),15-pentaene-10-carboxylate","","- C33 H26 N2 O4 -","- C33 H26 N2 O4 -","- C132 H104 N8 O16 -","4","1","IS5278","Kanchanadevi, J.; Anbalagan, G.; Kannan, D.; Gunasekaran, B.; Manivannan, V.; Bakthadoss, N.","Methyl 11,14,16-triphenyl-8,12-dioxa-14,15-diazatetracyclo[8.7.0.0^2,7^.0^13,17^]heptadeca-2(7),3,5,13(17),15-pentaene-10-carboxylate","Acta Crystallographica Section E","2013","69","7","o1035","","10.1107/S1600536813015213","","","0.71073","MoKα","","0.0624","0.0401","","","0.1117","0.1288","","","","","","1.014","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238194","10.047","0.005","19.317","0.005","8.135","0.005","90","","96.667","0.005","90","","1568.1","1.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3-Nitro-2-Ferrocene-2H-Chromene","2-Ferrocenyl-3-nitro-2<i>H</i>-chromene","","- C19 H15 Fe N O3 -","- C19 H15 Fe N O3 -","- C76 H60 Fe4 N4 O12 -","4","1","IS5279","Paramasivam, S.; Naga Siva Rao, Jonnalagadda; Seshadri, P. R.; Raghunathan, Raghavachary","2-Ferrocenyl-3-nitro-2<i>H</i>-chromene","Acta Crystallographica Section E","2013","69","7","m378","","10.1107/S1600536813015730","","","0.71073","MoKα","","0.0346","0.028","","","0.0721","0.0757","","","","","","1.009","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238195","7.3443","0.0004","16.4321","0.0009","10.8235","0.0005","90","","118.25","0.003","90","","1150.62","0.11","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-5-methylpyridinium 3-hydroxypyridine-2-carboxylate","","- C12 H13 N3 O3 -","- C12 H13 N3 O3 -","- C48 H52 N12 O12 -","4","1","IS5281","Farhadikoutenaei, Abbas; Thanigaimani, Kaliyaperumal; Arshad, Suhana; Razak, Ibrahim Abdul","2-Amino-5-methylpyridinium 3-hydroxypyridine-2-carboxylate","Acta Crystallographica Section E","2013","69","7","o1118","o1119","10.1107/S1600536813016322","","","0.71073","MoKα","","0.0415","0.0363","","","0.1087","0.1148","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238196","15.4435","0.0002","15.4435","0.0002","21.0395","0.0003","90","","90","","90","","5017.96","0.12","100","1","100","1","","","","","","","","4","I 41/a :2","-I 4ad","88","","2-Amino-4-methylpyridinium 3-hydroxybenzoate","","- C13 H14 N2 O3 -","- C13 H14 N2 O3 -","- C208 H224 N32 O48 -","16","1","IS5282","Khalib, Nuridayanti Che; Thanigaimani, Kaliyaperumal; Arshad, Suhana; Razak, Ibrahim Abdul","2-Amino-4-methylpyridinium 3-hydroxybenzoate","Acta Crystallographica Section E","2013","69","7","o1120","","10.1107/S1600536813016310","","","0.71073","MoKα","","0.0726","0.0596","","","0.1237","0.1298","","","","","","1.095","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238197","5.2934","0.0004","7.2817","0.0008","9.6196","0.0009","79.673","0.008","89.875","0.007","72.321","0.008","347.01","0.06","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","<i>trans</i>-Diaquabis(pyridazine-3-carboxylato-κ^2^<i>N</i>^2^,<i>O</i>)cobalt(II) dihydrate","","- C10 H14 Co N4 O8 -","- C10 H14 Co N4 O8 -","- C10 H14 Co N4 O8 -","1","0.5","IS5284","Artetxe, Beñat; Reinoso, Santiago; San Felices, Leire; Martín-Caballero, Jagoba; Gutiérrez-Zorrilla, Juan M.","<i>trans</i>-Diaquabis(pyridazine-3-carboxylato-κ^2^<i>N</i>^2^,<i>O</i>)cobalt(II) dihydrate","Acta Crystallographica Section E","2013","69","7","m420","m421","10.1107/S1600536813017340","","","0.71073","MoKα","","0.0284","0.0264","","","0.0555","0.0575","","","","","","1.084","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238198","12.4181","0.0008","17.0108","0.0011","20.6627","0.0013","102.166","0.004","96.726","0.004","107.496","0.004","3992.4","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","μ~3~-Acetato-μ~2~-acetato-(dimethylformamide)pentakis(μ-<i>N</i>,2-dioxidobenzene-1-carboximidato)pentakis(1-methyl-1<i>H</i>-imidazole)pentamanganese(III)manganese(II)‒diethyl ether‒dimethylformamide‒methanol‒water (1/1/1/1/0.49)","","- C69.61958 H85.3617 Mn6 N16.61958 O23.87106 -","- C69.62 H85.362 Mn6 N16.62 O23.871 -","- C139.24 H170.724 Mn12 N33.24 O47.742 -","2","1","JJ2164","Tigyer, Benjamin R.; Zeller, Matthias; Zaleski, Curtis M.","μ~3~-Acetato-μ~2~-acetato-(dimethylformamide)pentakis(μ-<i>N</i>,2-dioxidobenzene-1-carboximidato)pentakis(1-methyl-1<i>H</i>-imidazole)pentamanganese(III)manganese(II)‒diethyl ether‒dimethylformamide‒methanol‒water (1/1/1/1/0.49)","Acta Crystallographica Section E","2013","69","7","m393","m394","10.1107/S1600536813015857","","","0.71073","MoKα","","0.138","0.0868","","","0.194","0.2319","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2238199","18.052","0.002","19.846","0.002","5.0388","0.0006","90","","90","","90","","1805.2","0.3","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","{2,2'-[(1,2-Dicyanoethene-1,2-diyl)bis(nitrilomethanylylidyne)]diphenolato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}(methanol-κ<i>O</i>)zinc","","- C19 H14 N4 O3 Zn -","- C19 H14 N4 O3 Zn -","- C76 H56 N16 O12 Zn4 -","4","0.5","JJ2167","Wang, Zhi-Chun; Chu, Jing; Zhan, Shu-Zhong","{2,2'-[(1,2-Dicyanoethene-1,2-diyl)bis(nitrilomethanylylidyne)]diphenolato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}(methanol-κ<i>O</i>)zinc","Acta Crystallographica Section E","2013","69","7","m419","","10.1107/S1600536813016863","","","0.71073","MoKα","","0.0664","0.0362","","","0.0901","0.1039","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238200","8.63","0.006","14.495","0.004","17.072","0.003","90","","114.93","0.04","90","","1936.6","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[1-(2,3-dimethylphenyl)piperazine-1,4-diium] bis(oxonium) cyclohexaphosphate dihydrate","","- C24 H50 N4 O22 P6 -","- C24 H50 N4 O22 P6 -","- C48 H100 N8 O44 P12 -","2","0.5","JJ2168","Ameur, Iness; Abid, Sonia; Al-Deyab, Salem S; Rzaigui, Mohamed","Bis[1-(2,3-dimethylphenyl)piperazine-1,4-diium] bis(oxonium) cyclohexaphosphate dihydrate","Acta Crystallographica Section E","2013","69","7","o1145","o1146","10.1107/S1600536813016759","","","0.56085","AgKα","","0.1224","0.0549","","","0.126","0.1516","","","","","","0.993","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238201","3.7456","0.0002","14.9193","0.0009","21.6077","0.0017","90","","92.273","0.007","90","","1206.53","0.14","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Methyl-5-(4-nitrobenzylidene)-2-oxo-2,5-dihydro-1<i>H</i>-pyrrole-3-carbonitrile","","- C13 H9 N3 O3 -","- C13 H9 N3 O3 -","- C52 H36 N12 O12 -","4","1","JJ2169","Gainsford, Graeme J.; Bhuiyan, M. Delower. H.; Kay, Andrew J.","4-Methyl-5-(4-nitrobenzylidene)-2-oxo-2,5-dihydro-1<i>H</i>-pyrrole-3-carbonitrile","Acta Crystallographica Section E","2013","69","7","o1158","","10.1107/S1600536813017066","","","1.54184","CuKα","","0.0608","0.048","","","0.131","0.139","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238202","6.4838","0.0007","6.4978","0.0008","15.3633","0.0015","90","","102.168","0.011","90","","632.72","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Bis(ethyleneglycolato-O,O')tellurium(IV)","Bis(ethyleneglycolato-κ^2^<i>O</i>,<i>O</i>')tellurium(IV)","","- C4 H8 O4 Te -","- C4 H8 O4 Te -","- C16 H32 O16 Te4 -","4","1","KJ2224","Brooks, Neil R.; Wu, Minxian; Van Meervelt, Luc; Binnemans, Koen; Fransaer, Jan","Bis(ethyleneglycolato-κ^2^<i>O</i>,<i>O</i>')tellurium(IV)","Acta Crystallographica Section E","2013","69","7","o1080","","10.1107/S1600536813015687","","","0.71073","MoKα","","0.0395","0.0336","","","0.0736","0.0787","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238203","11.634","0.002","11.634","0.002","84.945","0.015","90","","90","","120","","9957","3","93","2","93","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","(4,7,13,16,21,24-Hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane)sodium iodide‒1,1,2,2,tetrafluoro-1,2-diiodoethane (2/3)","","- C21 H36 F6 I4 N2 Na O6 -","- C21 H36 F6 I4 N2 Na O6 -","- C252 H432 F72 I48 N24 Na12 O72 -","12","0.333333","KJ2225","Cavallo, Gabriella; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Ursini, Maurizio; Terraneo, Giancarlo","(4,7,13,16,21,24-Hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane)sodium iodide‒1,1,2,2,tetrafluoro-1,2-diiodoethane (2/3)","Acta Crystallographica Section E","2013","69","7","m387","m388","10.1107/S1600536813016085","","","0.71073","MoKα","","0.0377","0.0316","","","0.0744","0.0764","","","","","","1.066","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2238204","20.0988","0.0016","4.2645","0.0003","28.669","0.002","90","","90","","90","","2457.3","0.3","150","1","150","1","","","","","","","","4","P c a 21","P 2c -2ac","29","","5-Nitro-1,3-bis(prop-2-ynyl)-1<i>H</i>-1,3-benzimidazol-2(3<i>H</i>)-one","","- C13 H9 N3 O3 -","- C13 H9 N3 O3 -","- C104 H72 N24 O24 -","8","2","KJ2228","Kandri Rodi, Youssef; Misbahi, Khalid; El-Ghayoury, Abdelkrim; Zorina, Leokadiya; Essassi, El Mokhtar; El Ammari, Lahcen","5-Nitro-1,3-bis(prop-2-ynyl)-1<i>H</i>-1,3-benzimidazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","7","o1159","","10.1107/S1600536813016814","","","0.71073","MoKα","","0.0513","0.0468","","","0.1212","0.1262","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238205","7.1508","0.001","12.307","0.0018","21.431","0.003","90","","90","","90","","1886","0.5","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Methyl-1,2,4-triazolo[4,3-<i>a</i>]pyridin-2-ium tetrafluoroborate","","- C7 H8 B F4 N3 -","- C7 H8 B F4 N3 -","- C56 H64 B8 F32 N24 -","8","1","KQ2005","Wei, Siping; Wang, Li; Wang, Qin","2-Methyl-1,2,4-triazolo[4,3-<i>a</i>]pyridin-2-ium tetrafluoroborate","Acta Crystallographica Section E","2013","69","7","o1051","","10.1107/S1600536813015535","","","0.71073","MoKα","","0.0844","0.0772","","","0.2331","0.2449","","","","","","1.049","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238206","8.0285","0.0004","10.846","0.0005","18.2337","0.0009","90","","94.067","0.002","90","","1583.74","0.13","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>rac</i>-4-(4-Chlorophenyl)-2-methylamino-3-nitro-5,6,7,8-tetrahydro-4<i>H</i>-chromen-5-one","","- C16 H15 Cl N2 O4 -","- C16 H15 Cl N2 O4 -","- C64 H60 Cl4 N8 O16 -","4","1","LD2104","Narayanan, P.; Kamalraja, Jayabal; Perumal, Paramasivam T.; Sethusankar, K.","<i>rac</i>-4-(4-Chlorophenyl)-2-methylamino-3-nitro-5,6,7,8-tetrahydro-4<i>H</i>-chromen-5-one","Acta Crystallographica Section E","2013","69","7","o1053","o1054","10.1107/S1600536813014530","","","0.71073","MoKα","","0.0586","0.0424","","","0.1054","0.1189","","","","","","1.085","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238207","11.4138","0.0009","6.1241","0.0005","15.5812","0.0013","90","","104.561","0.009","90","","1054.13","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Nitrobenzyl)pyridine","","- C12 H10 N2 O2 -","- C12 H10 N2 O2 -","- C48 H40 N8 O8 -","4","1","LD2106","Taher, Deeb; Awwadi, Firas F.; Kailani, Mohammed H.","4-(4-Nitrobenzyl)pyridine","Acta Crystallographica Section E","2013","69","7","o1164","","10.1107/S1600536813017145","","","0.71073","MoKα","","0.0727","0.0467","","","0.0947","0.1062","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238208","8.875","0.0001","14.286","0.0002","16.65","0.0002","94.376","0.001","100.717","0.001","92.167","0.001","2065.24","0.05","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Bis{3-amino-1-carbamothioyl-5-[(2-{[(5-methyl-1<i>H</i>-imidazol-3-ium-4-yl)methyl]sulfanyl}ethyl)amino]-1<i>H</i>-1,2,4-triazol-4-ium} hexachloridobismuthate(III) nitrate dihydrate","","- C20 H40 Bi Cl6 N17 O5 S4 -","- C20 H40 Bi Cl6 N17 O5 S4 -","- C40 H80 Bi2 Cl12 N34 O10 S8 -","2","1","LH5614","Hossain, G. M. Golzar","Bis{3-amino-1-carbamothioyl-5-[(2-{[(5-methyl-1<i>H</i>-imidazol-3-ium-4-yl)methyl]sulfanyl}ethyl)amino]-1<i>H</i>-1,2,4-triazol-4-ium} hexachloridobismuthate(III) nitrate dihydrate","Acta Crystallographica Section E","2013","69","7","m402","m403","10.1107/S1600536813016449","","","0.71073","MoKα","","0.0465","0.0403","","","0.0988","0.1022","","","","","","1.049","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238209","22.6192","0.0003","5.5649","0.0001","19.0631","0.0003","90","","104.696","0.002","90","","2321.04","0.07","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","1-<i>O</i>-Benzyl-2,3-<i>O</i>-isopropylidene-6-<i>O</i>-tosyl-α-L-sorbofuranose","{(3a<i>S</i>,5<i>S</i>,6<i>R</i>,6a<i>S</i>)-3a-[(Benzyloxy)methyl]-6-hydroxy-2,2-dimethyltetrahydrofuro[2,3-<i>d</i>][1,3]dioxol-5-yl}methyl 4-methylbenzenesulfonate","","- C23 H28 O8 S -","- C23 H28 O8 S -","- C92 H112 O32 S4 -","4","1","LH5615","Reed, John H.; Turner, Peter; Kato, Atsushi; Houston, Todd A.; Simone, Michela I.","1-<i>O</i>-Benzyl-2,3-<i>O</i>-isopropylidene-6-<i>O</i>-tosyl-α-<small>L</small>-sorbofuranose","Acta Crystallographica Section E","2013","69","7","o1069","o1070","10.1107/S1600536813015638","","","1.5418","CuKα","","0.0447","0.0437","","","0.1248","0.1268","","","","","","1.16","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238210","10.0608","0.0002","17.9092","0.0005","10.8495","0.0003","90","","90","","90","","1954.87","0.09","100","1","100","1","","","","","","","","5","P n a 21","P 2c -2n","33","","<i>N</i>-[(3-Ethylphenyl)carbamothioyl]-2,2-diphenylacetamide","","- C23 H22 N2 O S -","- C23 H22 N2 O S -","- C92 H88 N8 O4 S4 -","4","1","LH5616","Yusof, Mohd Sukeri Mohd; Razali, Nur Rafikah; Arshad, Suhana; Rahman, Azhar Abdul; Razak, Ibrahim Abdul","<i>N</i>-[(3-Ethylphenyl)carbamothioyl]-2,2-diphenylacetamide","Acta Crystallographica Section E","2013","69","7","o1016","o1017","10.1107/S1600536813014268","","","0.71073","MoKα","","0.0957","0.0568","","","0.0863","0.0979","","","","","","0.989","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238211","11.1522","0.0011","9.0268","0.0008","14.3025","0.0014","90","","94.009","0.005","90","","1436.3","0.2","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Poly[[pentaaquabis(μ~3~-hydrogen squarato)barium] monohydrate]","","- C8 H14 Ba O14 -","- C8 H14 Ba O14 -","- C32 H56 Ba4 O56 -","4","1","LH5617","Trifa, Chahrazed; Bouhali, Amira; Bouacida, Sofiane; Boudaren, Chaouki; Merazig, Hocine","Poly[[pentaaquabis(μ~3~-hydrogen squarato)barium] monohydrate]","Acta Crystallographica Section E","2013","69","7","m366","m367","10.1107/S1600536813014736","","","0.71073","MoKα","","0.0132","0.0125","","","0.0329","0.0335","","","","","","1.057","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238212","9.051","0.005","13.142","0.007","15.321","0.008","69.803","0.005","84.566","0.005","76.909","0.006","1665.6","1.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","<i>N</i>,<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>',<i>N</i>'-Hexakis(2-hydroxyethyl)butane-1,4-diaminium bis(2-sulfanylidene-1,3-dithiole-4,5-dithiolato-κ^2^<i>S</i>^4^,<i>S</i>^5^)zincate","","- C22 H38 N2 O6 S10 Zn -","- C22 H38 N2 O6 S10 Zn -","- C44 H76 N4 O12 S20 Zn2 -","2","1","LH5618","Zhang, Xiulan; Xie, Bin; Zou, Like; Wang, Jun; Lin, Xiao","<i>N</i>,<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>',<i>N</i>'-Hexakis(2-hydroxyethyl)butane-1,4-diaminium bis(2-sulfanylidene-1,3-dithiole-4,5-dithiolato-κ^2^<i>S</i>^4^,<i>S</i>^5^)zincate","Acta Crystallographica Section E","2013","69","7","m368","m369","10.1107/S1600536813014992","","","0.71073","MoKα","","0.0427","0.0348","","","0.0933","0.0981","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238213","9.9645","0.0013","10.6001","0.0018","12.623","0.002","79.585","0.014","84.896","0.012","82.047","0.012","1295.9","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis[chloridobis(1,10-phenanthroline)copper(II)] pentacyanidonitrosoferrate(II) dimethylformamide monosolvate","","- C56 H39 Cl2 Cu2 Fe N15 O2 -","- C56 H39 Cl2 Cu2 Fe N15 O2 -","- C56 H39 Cl2 Cu2 Fe N15 O2 -","1","0.5","LH5620","Rusanova, Julia A.; Kozachuk, Olesia V.; Dyakonenko, Viktoriya V.","Bis[chloridobis(1,10-phenanthroline)copper(II)] pentacyanidonitrosoferrate(II) dimethylformamide monosolvate","Acta Crystallographica Section E","2013","69","7","m391","m392","10.1107/S1600536813015547","","","0.71073","MoKα","","0.1078","0.0612","","","0.1563","0.1818","","","","","","0.991","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238214","4.9146","0.0003","26.5065","0.0018","14.09","0.0009","90","","94.645","0.004","90","","1829.5","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 3-[(6-nitro-4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanoate","","- C18 H15 N3 O5 S -","- C18 H15 N3 O5 S -","- C72 H60 N12 O20 S4 -","4","1","LH5622","Al-Suwaidan, Ibrahim A.; Abdel-Aziz, Alaa A.-M.; El-Azab, Adel S.; Chidan Kumar, C. S.; Fun, Hoong-Kun","Methyl 3-[(6-nitro-4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanoate","Acta Crystallographica Section E","2013","69","7","o1111","","10.1107/S1600536813016127","","","1.54178","CuKα","","0.1142","0.0638","","","0.1608","0.191","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238215","27.9412","0.0009","8.8675","0.0003","19.6581","0.0006","90","","112.5","0.001","90","","4499.9","0.3","100","","100.04","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","3-(4-Bromophenyl)-1-butyl-5-[1-(2-chloro-6-methylphenyl)-1<i>H</i>-tetrazol-5-yl]imidazolidine-2,4-dione","","- C21 H20 Br Cl N6 O2 -","- C21 H20 Br Cl N6 O2 -","- C168 H160 Br8 Cl8 N48 O16 -","8","1","LH5623","Hall, Gabriel B.; Medda, Federico; Roberts, Sue A.; Hulme, Christopher","3-(4-Bromophenyl)-1-butyl-5-[1-(2-chloro-6-methylphenyl)-1<i>H</i>-tetrazol-5-yl]imidazolidine-2,4-dione","Acta Crystallographica Section E","2013","69","7","o1102","o1103","10.1107/S1600536813016000","","","0.71073","MoKα","","0.0549","0.0368","","","0.0899","0.1","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238216","28.9562","0.0006","13.261","0.0003","7.5284","0.0002","90","","90","","90","","2890.82","0.12","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","(2<i>Z</i>)-3-(2,4-Dichlorophenyl)-3-hydroxy-<i>N</i>-phenylprop-2-enethioamide","","- C15 H11 Cl2 N O S -","- C15 H11 Cl2 N O S -","- C120 H88 Cl16 N8 O8 S8 -","8","1","LH5625","Kour, Dalbir; Singh, Kuldeep; Aitawade, Mayur M.; Deshmukh, Madhukar B.; Anbhule, Prashant V.; Gupta, Vivek K.; Kant, Rajni","(2<i>Z</i>)-3-(2,4-Dichlorophenyl)-3-hydroxy-<i>N</i>-phenylprop-2-enethioamide","Acta Crystallographica Section E","2013","69","7","o1173","o1174","10.1107/S1600536813017339","","","0.71073","MoKα","","0.0595","0.0444","","","0.0854","0.0913","","","","","","1.105","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238217","7.457","0.0005","8.35","0.0005","25.368","0.0014","90","","97.626","0.003","90","","1565.59","0.17","290","2","290","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","4-{5-[(2-Bromobenzyl)sulfanyl]-1<i>H</i>-tetrazol-1-yl}benzoic acid","","- C15 H11 Br N4 O2 S -","- C15 H11 Br N4 O2 S -","- C60 H44 Br4 N16 O8 S4 -","4","1","LR2105","Mafud, Ana C.; Mascarenhas, Yvonne P.; Nascimento, Alessandro S.","4-{5-[(2-Bromobenzyl)sulfanyl]-1<i>H</i>-tetrazol-1-yl}benzoic acid","Acta Crystallographica Section E","2013","69","7","o1083","o1084","10.1107/S1600536813014840","","","0.71073","MoKα","","0.0517","0.0411","","","0.1076","0.1141","","","","","","1.06","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238218","5.1829","0.0006","26.328","0.004","10.2279","0.0013","90","","97.892","0.007","90","","1382.4","0.3","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[bis(μ~3~-2-phenylacetato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>)bis(μ~2~-2-phenylacetato-κ^2^<i>O</i>:<i>O</i>')dicopper(II)(<i>Cu</i>—<i>Cu</i>)]","","- C32 H28 Cu2 O8 -","- C32 H28 Cu2 O8 -","- C64 H56 Cu4 O16 -","2","0.5","LR2106","Benslimane, Meriem; Redjel, Yasmine Kheira; Merazig, Hocine; Daran, Jean-Claude","<i>catena</i>-Poly[bis(μ~3~-2-phenylacetato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>)bis(μ~2~-2-phenylacetato-κ^2^<i>O</i>:<i>O</i>')dicopper(II)(<i>Cu</i>—<i>Cu</i>)]","Acta Crystallographica Section E","2013","69","7","m397","","10.1107/S160053681301581X","","","0.71073","MoKα","","0.0929","0.0818","","","0.2497","0.2543","","","","","","1.198","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238219","10.59","0.002","7.697","0.0015","23.75","0.005","90","","94.7","0.03","90","","1929.4","0.7","98","2","98","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>cis</i>-(1,4,8,11-Tetraazacyclotetradecane-κ<i>N</i>^4^)bis(thiocyanato-κ<i>N</i>)chromium(III) thiocyanate","","- C13 H24 Cr N7 S3 -","- C13 H24 Cr N7 S3 -","- C52 H96 Cr4 N28 S12 -","4","1","LR2107","Moon, Dohyun; Choi, Jong-Ha; Ryoo, Keon Sang; Hong, Yong Pyo","<i>cis</i>-(1,4,8,11-Tetraazacyclotetradecane-κ<i>N</i>^4^)bis(thiocyanato-κ<i>N</i>)chromium(III) thiocyanate","Acta Crystallographica Section E","2013","69","7","m376","m377","10.1107/S1600536813015456","","","0.74","synchrotron","","0.0376","0.0303","","","0.0814","0.0845","","","","","","1.068","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238220","13.6452","0.0004","7.47005","0.00019","18.7286","0.0006","90","","105.772","0.003","90","","1837.14","0.1","292","2","292","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{2-[(1,3-Benzothiazol-2-yl)methoxy]-5-chlorophenyl}(4-chlorophenyl)methanone","","- C21 H13 Cl2 N O2 S -","- C21 H13 Cl2 N O2 S -","- C84 H52 Cl8 N4 O8 S4 -","4","1","LX2286","Venugopala, K. N.; Nayak, Susanta K.; Odhav, B.","{2-[(1,3-Benzothiazol-2-yl)methoxy]-5-chlorophenyl}(4-chlorophenyl)methanone","Acta Crystallographica Section E","2013","69","7","o1124","","10.1107/S1600536813016243","","","0.7107","MoKα","","0.0717","0.0427","","","0.0946","0.1085","","","","","","1.077","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238221","8.5174","0.0005","12.3094","0.0007","15.2597","0.0009","90","","90","","90","","1599.89","0.16","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","m-Xylylene dichloride","1,3-Bis(chloromethyl)benzene","","- C8 H8 Cl2 -","- C8 H8 Cl2 -","- C64 H64 Cl16 -","8","1","MW2106","Sanders, Marisa B.; Leon, David; Ndichie, Eddy I.; Chan, Benny C.","1,3-Bis(chloromethyl)benzene","Acta Crystallographica Section E","2013","69","7","o1150","","10.1107/S1600536813016383","","","0.71073","MoKα","","0.0265","0.0232","","","0.0623","0.0644","","","","","","1.043","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238222","18.4237","0.0004","15.7594","0.0006","20.9299","0.0007","90","","113.28","0.002","90","","5582.2","0.3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","4-(5-{2-[5-(4-Cyanophenyl)-3-methylthiophen-2-yl]-3,3,4,4,5,5-hexafluorocyclopent-1-en-1-yl}-4-methylthiophen-2-yl)benzonitrile chloroform hemisolvate","","- C29.5 H16.5 Cl1.5 F6 N2 S2 -","- C29.5 H16.5 Cl1.5 F6 N2 S2 -","- C236 H132 Cl12 F48 N16 S16 -","8","1","MW2111","El-Hiti, Gamal A.; Smith, Keith; Masmali, Ali; Balakit, Asim A.; Kariuki, Benson M.","4-(5-{2-[5-(4-Cyanophenyl)-3-methylthiophen-2-yl]-3,3,4,4,5,5-hexafluorocyclopent-1-en-1-yl}-4-methylthiophen-2-yl)benzonitrile chloroform hemisolvate","Acta Crystallographica Section E","2013","69","7","o1041","","10.1107/S1600536813014852","","","0.71073","MoKα","","0.1083","0.0687","","","0.1509","0.1744","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2238223","11.9292","0.0003","15.2505","0.0005","18.1222","0.0005","90","","90","","90","","3296.9","0.16","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Theobrominium perchlorate dibenzo-18-crown-6 3.25-hydrate","3,7-Dimethyl-2,6-dioxo-1<i>H</i>-purin-9-ium perchlorate dibenzo-18-crown-6 3.25-hydrate","","- C27 H40 Cl N4 O15.25 -","- C27 H39.5 Cl N4 O15.25 -","- C108 H158 Cl4 N16 O61 -","4","1","NC2312","Kulikov, Vladislav; Meyer, Gerd","Theobrominium perchlorate dibenzo-18-crown-6 3.25-hydrate","Acta Crystallographica Section E","2013","69","7","o1027","","10.1107/S1600536813014463","","","0.71073","MoKα","","0.0658","0.0491","","","0.1387","0.1563","","","","","","1.042","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2238224","7.8516","0.0006","8.8285","0.0006","12.1356","0.0008","87.285","0.006","82.516","0.006","65.396","0.005","758.3","0.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-bromido-bis[(diethyl ether-κ<i>O</i>)(2,4,6-trimethylphenyl)magnesium]","","- C26 H42 Br2 Mg2 O2 -","- C26 H42 Br2 Mg2 O2 -","- C26 H42 Br2 Mg2 O2 -","1","0.5","NG5334","Seven, Ömer; Bolte, Michael; Lerner, Hans-Wolfram","Di-μ-bromido-bis[(diethyl ether-κ<i>O</i>)(2,4,6-trimethylphenyl)magnesium]: the mesityl Grignard reagent","Acta Crystallographica Section E","2013","69","7","m424","","10.1107/S1600536813017108","","","0.71073","MoKα","","0.0409","0.0356","","","0.0928","0.0957","","","","","","1.057","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238225","7.5154","0.0003","9.1393","0.0004","11.6498","0.0005","69.612","0.003","80.5","0.005","72.482","0.004","713.64","0.06","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Benzamidinium 2-methoxybenzoate","","- C15 H16 N2 O3 -","- C15 H16 N2 O3 -","- C30 H32 N4 O6 -","2","1","NK2209","Portalone, Gustavo","Benzamidinium 2-methoxybenzoate","Acta Crystallographica Section E","2013","69","7","o1114","o1115","10.1107/S1600536813016395","","","0.71069","MoKα","","0.0892","0.0616","","","0.1482","0.1613","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238226","7.3725","0.0002","10.0967","0.0003","20.8173","0.0007","98.086","0.001","99.547","0.002","106.547","0.001","1435.62","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Chloro-2-methyl-3-(4-methylphenylsulfonyl)-1-benzofuran","","- C16 H13 Cl O3 S -","- C16 H13 Cl O3 S -","- C64 H52 Cl4 O12 S4 -","4","2","PK2485","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Chloro-2-methyl-3-(4-methylphenylsulfonyl)-1-benzofuran","Acta Crystallographica Section E","2013","69","7","o1050","","10.1107/S1600536813015468","","","0.71073","MoKα","","0.0446","0.036","","","0.0926","0.0979","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238227","3.8466","0.0003","7.4052","0.0007","30.577","0.003","90","","90","","90","","870.98","0.14","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4-Formyltetrathiafulvalene","2-(1,3-Dithiol-2-ylidene)-1,3-dithiole-4-carbaldehyde","","- C7 H4 O S4 -","- C7 H4 O S4 -","- C28 H16 O4 S16 -","4","1","PK2488","Zeller, Matthias; Azov, Vladimir A.","2-(1,3-Dithiol-2-ylidene)-1,3-dithiole-4-carbaldehyde","Acta Crystallographica Section E","2013","69","7","o1157","","10.1107/S160053681301711X","","","0.71073","MoKα","","0.0245","0.0237","","","0.0565","0.0573","","","","","","1.127","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238228","7.043","0.0014","7.58","0.0015","29.114","0.006","90","","95.33","0.03","90","","1547.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","8-[(3-Phenyl-1,2,4-oxadiazol-5-yl)methoxy]quinoline monohydrate","","- C18 H15 N3 O3 -","- C18 H15 N3 O3 -","- C72 H60 N12 O12 -","4","1","PV2633","Bai, Shu-Yuan; Shen, Hong; Han, Xin-Yi; Lv, Ling-Jie; Wang, Hai-Bo","8-[(3-Phenyl-1,2,4-oxadiazol-5-yl)methoxy]quinoline monohydrate","Acta Crystallographica Section E","2013","69","7","o1034","","10.1107/S1600536813014529","","","0.71073","MoKα","","0.1069","0.0521","","","0.1219","0.1438","","","","","","0.954","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238229","6.972","0.0014","9.929","0.002","15.084","0.003","90","","100.25","0.03","90","","1027.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(1-Methyl-2-oxoindolin-3-ylidene)malononitrile","","- C12 H7 N3 O -","- C12 H7 N3 O -","- C48 H28 N12 O4 -","4","1","PV2634","Wang, De-Cai; Tang, Wei; Su, Peng; Ou-Yang, Ping-Kai","2-(1-Methyl-2-oxoindolin-3-ylidene)malononitrile","Acta Crystallographica Section E","2013","69","7","o1095","","10.1107/S1600536813016012","","","0.71073","MoKα","","0.0889","0.057","","","0.1517","0.1758","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238230","9.344","0.0019","11.352","0.002","25.719","0.005","90","","90","","90","","2728.1","0.9","291","2","291","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-Methyl-2-(3,3,3-trichloro-2-hydroxypropyl)quinazolin-4(3<i>H</i>)-one","","- C12 H11 Cl3 N2 O2 -","- C12 H11 Cl3 N2 O2 -","- C96 H88 Cl24 N16 O16 -","8","1","PV2636","Utayeva, Fotima Rabbimovna; Okmanov, Rasul Yangiberdievich; Mukarramov, Nuridin Isomidinovich; Shakhidoyatov, Khusnutdin Muhitovich; Tashkhodjaev, Bakhodir","3-Methyl-2-(3,3,3-trichloro-2-hydroxypropyl)quinazolin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","7","o1094","","10.1107/S1600536813016073","","","1.54184","CuKα","","0.0504","0.0402","","","0.1112","0.1162","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238231","7.0659","0.0003","7.8206","0.0003","10.4595","0.0003","79.667","0.002","80.471","0.002","81.579","0.002","556.69","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","3,7-Dimethyl-3-oxohexahydro-4,7-methano-2-benzofuran-4(1<i>H</i>)-carboxamide","2,6-Dimethyl-4-oxo-3-oxatricyclo[5.2.1.0^2,6^]decane-1-carboxamide","","- C12 H17 N O3 -","- C12 H17 N O3 -","- C24 H34 N2 O6 -","2","1","QM2095","Grytsai, Oleksandr; Gorichko, Marian","2,6-Dimethyl-4-oxo-3-oxatricyclo[5.2.1.0^2,6^]decane-1-carboxamide","Acta Crystallographica Section E","2013","69","7","o1168","","10.1107/S1600536813017248","","","0.71073","MoKα","","0.0652","0.044","","","0.1223","0.1412","","","","","","0.918","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238232","23.673","0.005","8.3124","0.0017","25.546","0.005","90","","113.25","0.03","90","","4618.7","1.9","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(μ-6-methoxy-2-{[(3-oxidopropyl)imino]methyl}phenolato)nickel(II) methanol monosolvate","","- C23 H30 N2 Ni2 O7 -","- C23 H30 N2 Ni2 O7 -","- C184 H240 N16 Ni16 O56 -","8","1","QM2096","Meng, Fan-Kun; Zhang, Xin; Yi, Hua; Zhang, De-Hui; Jia, Jun-Ying","Bis(μ-6-methoxy-2-{[(3-oxidopropyl)imino]methyl}phenolato)nickel(II) methanol monosolvate","Acta Crystallographica Section E","2013","69","7","m425","","10.1107/S1600536813017224","","","0.71073","MoKα","","0.0596","0.0467","","","0.0762","0.0799","","","","","","1.011","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238233","7.953","0.006","8.548","0.006","10.951","0.008","96.602","0.008","92.282","0.008","100.279","0.007","726.3","0.9","295","2","295","2","","","","","","","","3","P -1","-P 1","2","5,6-Dihydroxy-7,8-dimethoxyflavone","5,6-dihydroxy-7,8-dimethoxy-2-phenylchromen-4-one","","- C17 H14 O6 -","- C17 H14 O6 -","- C34 H28 O12 -","2","1","RK2401","Jing, Lin-Lin; Fan, Xiao-Fei; Fan, Peng-Cheng; He, Lei; Jia, Zheng-Ping","5,6-Dihydroxy-7,8-dimethoxyflavone","Acta Crystallographica Section E","2013","69","7","o1096","","10.1107/S1600536813014451","","","0.71073","MoKα","","0.1273","0.0697","","","0.1934","0.2358","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238234","12.1713","0.0006","13.6144","0.0007","10.9602","0.0006","90","","114.813","0.002","90","","1648.5","0.15","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 4-anilino-2',5-dioxo-1',2'-dihydro-5<i>H</i>-spiro[furan-2,3'-indole]-3-carboxylate","","- C19 H14 N2 O5 -","- C19 H14 N2 O5 -","- C76 H56 N8 O20 -","4","1","RK2403","Gangadharan, Rajeswari; Sethusankar, K.; Kiruthika, Selvarangam E.; Perumal, P. T.","Methyl 4-anilino-2',5-dioxo-1',2'-dihydro-5<i>H</i>-spiro[furan-2,3'-indole]-3-carboxylate","Acta Crystallographica Section E","2013","69","7","o1055","","10.1107/S1600536813014967","","","0.71073","MoKα","","0.0717","0.0441","","","0.1151","0.1324","","","","","","0.999","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238235","9.6614","0.0002","12.5429","0.0003","12.8728","0.0003","61.598","0.002","87.386","0.003","77.115","0.003","1334.3","0.06","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Bis(3-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')bis(nicotinamide-κ<i>N</i>)copper(II)","","- C26 H20 Cl2 Cu N4 O6 -","- C26 H20 Cl2 Cu N4 O6 -","- C52 H40 Cl4 Cu2 N8 O12 -","2","1","RK2404","Bozkurt, Nihat; Dilek, Nefise; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","Bis(3-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')bis(nicotinamide-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2013","69","7","m356","m357","10.1107/S1600536813014694","","","0.71073","MoKα","","0.0332","0.0299","","","0.0806","0.0831","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238236","11.6594","0.0004","19.3088","0.0006","15.8522","0.0005","90","","108.887","0.001","90","","3376.64","0.19","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(1<i>R</i>*,21<i>S</i>*,22<i>R</i>*,24<i>S</i>*)-Methyl ethyl 2-[23-hydroxy-22,24-diphenyl-8,11,14-trioxa-25-azatetracyclo[19.3.1.0^2,7^.0^15,20^]pentacosa-2,4,6,15(20),16,18-hexaen-25-yl]but-2-enedioate","","- C40 H41 N O8 -","- C40 H41 N O8 -","- C160 H164 N4 O32 -","4","1","RK2405","Hieu, Truong Hong; Anh, Le Tuan; Soldatenkov, Anatoly T.; Gorchakova, Olga S.; Khrustalev, Victor N.","(1<i>R</i>*,21<i>S</i>*,22<i>R</i>*,24<i>S</i>*)-Methyl ethyl 2-[23-hydroxy-22,24-diphenyl-8,11,14-trioxa-25-azatetracyclo[19.3.1.0^2,7^.0^15,20^]pentacosa-2,4,6,15(20),16,18-hexaen-25-yl]but-2-enedioate","Acta Crystallographica Section E","2013","69","7","o1023","o1024","10.1107/S1600536813014748","","","0.71073","MoKα","","0.0779","0.0482","","","0.1238","0.1355","","","","","","1","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238237","31.603","0.005","6.1828","0.001","14.89","0.002","90","","102.594","0.015","90","","2839.4","0.8","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","2,4-Dibromo-6-{[(5-chloro-2-methylphenyl)imino]methyl}phenol","","- C14 H10 Br2 Cl N O -","- C14 H10 Br2 Cl N O -","- C112 H80 Br16 Cl8 N8 O8 -","8","1","RK2407","Zheng, Yunfa","2,4-Dibromo-6-{[(5-chloro-2-methylphenyl)imino]methyl}phenol","Acta Crystallographica Section E","2013","69","7","o1190","","10.1107/S1600536813017558","","","0.71073","MoKα","","0.0653","0.0383","","","0.0727","0.0819","","","","","","0.997","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238238","13.4418","0.0002","8.3088","0.0001","15.1538","0.0002","90","","110.61","0.02","90","","1584.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>cis</i>-Bromido(methylamine)bis(propane-1,3-diamine)cobalt(III) dibromide","","- C7 H25 Br3 Co N5 -","- C7 H25 Br3 Co N5 -","- C28 H100 Br12 Co4 N20 -","4","1","RN2115","Kannan, P. S.; Ganeshraja, A. S.; Anbalagan, K.; Govindan, E.; SubbiahPandi, A.","<i>cis</i>-Bromido(methylamine)bis(propane-1,3-diamine)cobalt(III) dibromide","Acta Crystallographica Section E","2013","69","7","m374","m375","10.1107/S160053681301516X","","","0.71073","MoKα","","0.1178","0.0726","","","0.2171","0.2377","","","","","","1.068","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238239","6.6634","0.0002","8.5514","0.0003","11.8716","0.0005","90","","105.067","0.003","90","","653.21","0.04","295","2","295","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","Cythioate","<i>O</i>,<i>O</i>-Dimethyl <i>O</i>-(4-sulfamoylphenyl) phosphorothioate","","- C8 H12 N O5 P S2 -","- C8 H12 N O5 P S2 -","- C16 H24 N2 O10 P2 S4 -","2","0.5","RZ5064","Zhao, Puhan; Baughman, Russell G.","<i>O</i>,<i>O</i>-Dimethyl <i>O</i>-(4-sulfamoylphenyl) phosphorothioate (cythioate)","Acta Crystallographica Section E","2013","69","7","o1042","","10.1107/S1600536813014724","","","0.71073","MoKα","","0.0478","0.0414","","","0.109","0.1121","","","","","","1.207","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238240","24.9335","0.0004","5.0278","0.0001","18.6813","0.0003","90","","111.151","0.001","90","","2184.13","0.07","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(<i>E</i>)-1-(2-Aminophenyl)-3-(thiophen-2-yl)prop-2-en-1-one","(<i>E</i>)-1-(2-Aminophenyl)-3-(thiophen-2-yl)prop-2-en-1-one","","- C13 H11 N O S -","- C13 H11 N O S -","- C104 H88 N8 O8 S8 -","8","1","RZ5065","Chantrapromma, Suchada; Ruanwas, Pumsak; Boonnak, Nawong; Fun, Hoong-Kun","(<i>E</i>)-1-(2-Aminophenyl)-3-(thiophen-2-yl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","7","o1004","o1005","10.1107/S1600536813014189","","","0.71073","MoKα","","0.0905","0.0512","","","0.1087","0.1265","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238241","12.288","0.003","13.349","0.003","14.244","0.003","90","","113.39","0.03","90","","2144.5","1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[bis{μ-<i>N</i>'-[(pyridin-4-yl)methylidene]benzohydrazidato}copper(II)]","","- C26 H20 Cu N6 O2 -","- C26 H20 Cu N6 O2 -","- C104 H80 Cu4 N24 O8 -","4","0.5","RZ5068","Wu, Qiong; Chen, Da-Chi; Wu, Chu-Yi; Yan, Chang-Xiu; Liao, Jian-Zhen","Poly[bis{μ-<i>N</i>'-[(pyridin-4-yl)methylidene]benzohydrazidato}copper(II)]","Acta Crystallographica Section E","2013","69","7","m383","","10.1107/S1600536813015882","","","0.71073","MoKα","","0.0433","0.0327","","","0.0758","0.0799","","","","","","1.053","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238242","15.265","0.001","11.4817","0.0008","6.7552","0.0005","90","","101.617","0.007","90","","1159.72","0.14","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Potassium <i>N</i>-bromo-4-chloro-2-methylbenzenesulfonamidate monohydrate","","- C7 H8 Br Cl K N O3 S -","- C7 H8 Br Cl K N O3 S -","- C28 H32 Br4 Cl4 K4 N4 O12 S4 -","4","1","RZ5069","Spandana, H. S.; Foro, Sabine; Gowda, B. Thimme","Potassium <i>N</i>-bromo-4-chloro-2-methylbenzenesulfonamidate monohydrate","Acta Crystallographica Section E","2013","69","7","m370","","10.1107/S1600536813014979","","","0.71073","MoKα","","0.0527","0.0429","","","0.1231","0.1289","","","","","","1.099","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238243","8.8056","0.0013","15.648","0.003","12.139","0.0016","90","","91.769","0.01","90","","1671.8","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1<i>S</i>,2<i>R</i>,7<i>R</i>,8<i>S</i>,10<i>R</i>)-9,9-Dibromo-2,6,6,10-tetramethyl-1α,2α-epoxytricyclo[5.5.0.0^8,10^]dodecane","","- C16 H24 Br2 O -","- C16 H24 Br2 O -","- C64 H96 Br8 O4 -","4","2","RZ5070","Benharref, Ahmed; El Karroumi, Jamal; El Ammari, Lahcen; Saadi, Mohamed; Berraho, Moha","(1<i>S</i>,2<i>R</i>,7<i>R</i>,8<i>S</i>,10<i>R</i>)-9,9-Dibromo-2,6,6,10-tetramethyl-1α,2α-epoxytricyclo[5.5.0.0^8,10^]dodecane","Acta Crystallographica Section E","2013","69","7","o1037","o1038","10.1107/S160053681301502X","","","0.71073","MoKα","","0.0579","0.0454","","","0.1047","0.1079","","","","","","0.958","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238244","7.9443","0.0006","9.5038","0.0007","11.8706","0.0009","66.759","0.002","89.754","0.002","66.785","0.002","744.6","0.1","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 4-acetyl-5-anilino-3-methylthiophene-2-carboxylate","","- C16 H17 N O3 S -","- C16 H17 N O3 S -","- C32 H34 N2 O6 S2 -","2","1","RZ5071","Mabkhot, Yahia Nasser; Alatibi, Fatima; Barakat, Assem; Choudhary, M. Iqbal; Yousuf, Sammer","Ethyl 4-acetyl-5-anilino-3-methylthiophene-2-carboxylate","Acta Crystallographica Section E","2013","69","7","o1049","","10.1107/S160053681301547X","","","0.71073","MoKα","","0.0646","0.048","","","0.1143","0.1255","","","","","","1.049","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238245","6.874","0.003","10.189","0.005","8.099","0.004","90","","106.58","0.02","90","","543.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","<i>N</i>,<i>N</i>'-Dihydroxybenzene-1,2:4,5-tetracarboximide dihydrate","2,6-Dihydroxy-1<i>H</i>,2<i>H</i>,3<i>H</i>,5<i>H</i>,6<i>H</i>,7<i>H</i>-pyrrolo[3,4-<i>f</i>]isoindole-1,3,5,7-tetrone dihydrate","","- C10 H8 N2 O8 -","- C10 H8 N2 O8 -","- C20 H16 N4 O16 -","2","0.5","RZ5073","Centore, Roberto; Carella, Antonio","<i>N</i>,<i>N</i>'-Dihydroxybenzene-1,2:4,5-tetracarboximide dihydrate","Acta Crystallographica Section E","2013","69","7","o1152","o1153","10.1107/S1600536813016991","","","0.71073","MoKα","","0.041","0.0361","","","0.0943","0.1001","","","","","","1.094","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238246","8.774","0.0002","8.774","0.0002","10.0282","0.0003","90","","90","","90","","772","0.03","140","2","140","1","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","(4<i>S</i>,5<i>S</i>)-2,2-Dimethyl-1,3-dioxolane-4,5-dicarbonitrile","","- C7 H8 N2 O2 -","- C7 H8 N2 O2 -","- C28 H32 N8 O8 -","4","0.5","SJ5320","Haines, Alan H.; Hughes, David L.","(4<i>S</i>,5<i>S</i>)-2,2-Dimethyl-1,3-dioxolane-4,5-dicarbonitrile","Acta Crystallographica Section E","2013","69","7","o1104","","10.1107/S1600536813015973","","","0.71073","Mo-Kα","","0.0325","0.0303","","","0.0752","0.0763","","","","","","1.087","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238247","6.4135","0.0003","11.4099","0.0006","27.8249","0.0014","90","","90","","90","","2036.15","0.18","120","0.1","120","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","<i>meso</i>-4,4'-Dimethoxy-2,2'-{[(3a<i>R</i>,7a<i>S</i>)-2,3,3a,4,5,6,7,7a-octahydro-1<i>H</i>-benzimidazole-1,3-diyl]bis(methylene)}diphenol","","- C23 H30 N2 O4 -","- C23 H30 N2 O4 -","- C92 H120 N8 O16 -","4","1","SJ5324","Rivera, Augusto; Quiroga, Diego; Ríos-Motta, Jaime; Kučeraková, Monika; Dušek, Michal","<i>meso</i>-4,4'-Dimethoxy-2,2'-{[(3a<i>R</i>,7a<i>S</i>)-2,3,3a,4,5,6,7,7a-octahydro-1<i>H</i>-benzimidazole-1,3-diyl]bis(methylene)}diphenol","Acta Crystallographica Section E","2013","69","7","o1057","o1058","10.1107/S1600536813015092","","","1.5418","CuKα","","0.0358","0.0306","","","0.075","0.0796","","","","","","1.13","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238248","9.279","0.0005","10.7696","0.0005","14.5758","0.0009","95.274","0.002","97.875","0.002","104.788","0.005","1382.75","0.14","298","","298","","","","","","","","","3","P -1","-P 1","2","4-hydroxycoumarin 4-methylbenzoate ester","2-Oxo-2<i>H</i>-chromen-4-yl 4-methylbenzoate","","- C17 H12 O4 -","- C17 H12 O4 -","- C68 H48 O16 -","4","2","SJ5325","Abou, Akoun; Djandé, Abdoulaye; Kakou-Yao, Rita; Saba, Adama; Tenon, Abodou Jules","2-Oxo-2<i>H</i>-chromen-4-yl 4-methylbenzoate","Acta Crystallographica Section E","2013","69","7","o1081","o1082","10.1107/S1600536813015717","","","0.71073","MoKα","","0.1311","0.0705","","","0.1572","0.1934","","","","","","1.021","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238249","18.5417","0.0009","6.0597","0.0004","8.9415","0.0005","90","","90","","90","","1004.64","0.1","173","2","173","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","4,4'-Dimethyl-2,2'-{[2,3,3a,4,5,6,7,7a-octahydro-1<i>H</i>-benzimidazole-1,3-diyl]bis(methylene)}diphenol","","- C23 H30 N2 O2 -","- C23 H30 N2 O2 -","- C46 H60 N4 O4 -","2","0.5","SJ5327","Rivera, Augusto; Osorio, Héctor Jairo; Maldonado, Mauricio; Ríos-Motta, Jaime; Bolte, Michael","4,4'-Dimethyl-2,2'-{[2,3,3a,4,5,6,7,7a-octahydro-1<i>H</i>-benzimidazole-1,3-diyl]bis(methylene)}diphenol","Acta Crystallographica Section E","2013","69","7","o1059","","10.1107/S1600536813015237","","","0.71073","MoKα","","0.0364","0.0344","","","0.0886","0.0899","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238250","10.1341","0.00014","21.9219","0.0003","19.3747","0.0003","90","","90","","90","","4304.26","0.11","173","3","173","2","","","","","","","","4","P b c 21","P 2c -2b","29","","3,3-dimethyl-1<i>H</i>,4<i>H</i>-cyclopenta[<i>b</i>]indol-2(3<i>H</i>)-one","","- C13 H13 N O -","- C13 H13 N O -","- C208 H208 N16 O16 -","16","4","SJ5328","Lopchuk, Justin M.; Gribble, Gordon W.; Jasinski, Jerry P.","Bruceolline D: 3,3-dimethyl-1<i>H</i>,4<i>H</i>-cyclopenta[<i>b</i>]indol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","7","o1043","","10.1107/S1600536813014955","","","1.5418","CuKα","","0.0714","0.0681","","","0.1688","0.1744","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238251","6.668","0.0002","36.0404","0.0008","7.6093","0.0002","90","","99.728","0.002","90","","1802.35","0.08","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(3,4-Difluorobenzyl)-4-(4-methylphenylsulfonyl)piperazine","","- C18 H20 F2 N2 O2 S -","- C18 H20 F2 N2 O2 S -","- C72 H80 F8 N8 O8 S4 -","4","1","SJ5330","Sreenivasa, S.; Anitha, H. C.; Suchetan, P. A.; Palakshamurthy, B. S.; Savanur, J.; Tonannavar, J.","1-(3,4-Difluorobenzyl)-4-(4-methylphenylsulfonyl)piperazine","Acta Crystallographica Section E","2013","69","7","o1179","","10.1107/S1600536813016462","","","0.71073","MoKα","","0.059","0.0446","","","0.1061","0.1135","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238252","14.0965","0.001","10.4007","0.0007","20.6593","0.0015","90","","102.994","0.001","90","","2951.4","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[silver(I)-μ-<i>N</i>-(pyridin-3-ylmethyl)pyridine-2-amine-κ^2^<i>N</i>:<i>N</i>'] trifluoromethanesulfonate]","","- C12 H11 Ag F3 N3 O3 S -","- C12 H11 Ag F3 N3 O3 S -","- C96 H88 Ag8 F24 N24 O24 S8 -","8","2","SJ5332","Moon, Suk-Hee; Park, Ki-Min","<i>catena</i>-Poly[[silver(I)-μ-<i>N</i>-(pyridin-3-ylmethyl)pyridine-2-amine-κ^2^<i>N</i>:<i>N</i>'] trifluoromethanesulfonate]","Acta Crystallographica Section E","2013","69","7","m414","m415","10.1107/S1600536813016309","","","0.71073","MoKα","","0.1111","0.0881","","","0.2239","0.238","","","","","","1.09","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238253","9.865","0.003","11.659","0.004","13.561","0.005","91.91","0.03","98.85","0.03","105.2","0.04","1482.8","0.9","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","(3-Acetyl-4-methyl-1<i>H</i>-pyrazol-1-ide-5-carboxylato)bis(1,10-phenanthroline)nickel(II) 3.5-hydrate","","- C31 H29 N6 Ni O6.5 -","- C31 H29 N6 Ni O6.5 -","- C62 H58 N12 Ni2 O13 -","2","1","SJ5334","Malinkin, Sergey; Kapshuk, Anatoliy A.; Gumienna-Kontecka, Elzbieta; Prisyazhnaya, Elena V.; Iskenderov, Turganbay S.","(3-Acetyl-4-methyl-1<i>H</i>-pyrazol-1-ide-5-carboxylato)bis(1,10-phenanthroline)nickel(II) 3.5-hydrate","Acta Crystallographica Section E","2013","69","7","m417","m418","10.1107/S1600536813017194","","","0.71073","MoKα","","0.1554","0.0616","","","0.1297","0.1531","","","","","","0.85","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238254","7.6534","0.0006","16.3503","0.0011","11.4887","0.0006","90","","96.889","0.002","90","","1427.26","0.17","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-<i>N</i>'-(4-Methoxybenzylidene)pyridine-3-carbohydrazide dihydrate","","- C14 H17 N3 O4 -","- C14 H17 N3 O4 -","- C56 H68 N12 O16 -","4","1","SJ5336","Novina, J. Josephine; Vasuki, G.; Suresh, M.; Padusha, M. Syed Ali","(<i>E</i>)-<i>N</i>'-(4-Methoxybenzylidene)pyridine-3-carbohydrazide dihydrate","Acta Crystallographica Section E","2013","69","7","o1177","o1178","10.1107/S1600536813017406","","","0.71073","MoKα","","0.0844","0.0464","","","0.1278","0.1552","","","","","","0.931","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238255","21.0879","0.0016","6.211","0.0004","17.9086","0.0016","90","","109.168","0.006","90","","2215.6","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-Di-<i>tert</i>-butyl-2,2'-[imidazolidine-1,3-diylbis(methylene)]diphenol","","- C25 H36 N2 O2 -","- C25 H36 N2 O2 -","- C100 H144 N8 O8 -","4","1","SJ5337","Rivera, Augusto; Nerio, Luz Stella; Bolte, Michael","4,4'-Di-<i>tert</i>-butyl-2,2'-[imidazolidine-1,3-diylbis(methylene)]diphenol","Acta Crystallographica Section E","2013","69","7","o1166","","10.1107/S1600536813017157","","","0.71073","MoKα","","0.1333","0.1193","","","0.3179","0.3239","","","","","","1.129","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238256","3.9971","0.0004","12.4705","0.0012","22.462","0.002","90","","92.442","0.001","90","","1118.62","0.18","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,6-Dibromo-2-naphthol","1,6-Dibromonaphthalen-2-ol methanol monosolvate","","- C11 H10 Br2 O2 -","- C11 H10 Br2 O2 -","- C44 H40 Br8 O8 -","4","1","SU2599","Sanders, Marisa B.; Furkan, Tania; Leonard, Emily; Chan, Benny C.","1,6-Dibromonaphthalen-2-ol methanol monosolvate","Acta Crystallographica Section E","2013","69","7","o1149","","10.1107/S1600536813016371","","","0.71073","MoKα","","0.0567","0.0356","","","0.0679","0.0742","","","","","","1.018","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238257","8.9341","0.0009","11.7697","0.0012","13.3828","0.0014","72.776","0.005","89.574","0.005","74.995","0.005","1294.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 8''-chloro-1'-methyl-2,12''-dioxo-12''<i>H</i>-dispiro[indoline-3,2'-pyrrolidine-3',6''-indolo[2,1-<i>b</i>]quinazoline]-4'-carboxylate","","- C29 H23 Cl N4 O4 -","- C29 H23 Cl N4 O4 -","- C58 H46 Cl2 N8 O8 -","2","1","SU2600","Kannan, Piskala Subburaman; Lanka, Srinu; Thennarasu, Sathiah; Govindan, E.; SubbiahPandi, Arunachalathevar","Ethyl 8''-chloro-1'-methyl-2,12''-dioxo-12''<i>H</i>-dispiro[indoline-3,2'-pyrrolidine- 3',6''-indolo[2,1-<i>b</i>]quinazoline]-4'-carboxylate","Acta Crystallographica Section E","2013","69","7","o1062","o1063","10.1107/S1600536813015146","","","0.71073","MoKα","","0.0673","0.0529","","","0.1487","0.1609","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238258","13.298","0.003","13.608","0.004","14.356","0.003","90","","90","","90","","2597.9","1.1","194","2","194","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-[(1<i>R</i>,2<i>R</i>,4<i>R</i>)-2-Methoxy-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl]-1<i>H</i>-tetrazole","","- C12 H20 N4 O -","- C12 H20 N4 O -","- C96 H160 N32 O8 -","8","2","SU2603","Bats, Jan W.; Schell, Peter; Engels, Joachim W.","5-[(1<i>R</i>,2<i>R</i>,4<i>R</i>)-2-Methoxy-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl]-1<i>H</i>-tetrazole","Acta Crystallographica Section E","2013","69","7","o1028","","10.1107/S1600536813014700","","","0.71073","MoKα","","0.1135","0.069","","","0.124","0.138","","","","","","1.075","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238259","15.965","0.005","5.807","0.005","30.185","0.005","90","","90","","90","","2798","3","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1-(3-Acetylphenyl)-2-(2-oxidonaphthalen-1-yl)diazen-1-ium","","- C18 H14 N2 O2 -","- C18 H14 N2 O2 -","- C144 H112 N16 O16 -","8","2","SU2604","Bougueria, Hassiba; Benosmane, Ali; Benaouida, Mohamed Amine; Bouchoul, Abd El Kader; Bouaoud, Salah Eddine","1-(3-Acetylphenyl)-2-(2-oxidonaphthalen-1-yl)diazen-1-ium","Acta Crystallographica Section E","2013","69","7","o1052","","10.1107/S1600536813014918","","","0.71073","MoKα","","0.0479","0.0432","","","0.1168","0.1203","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238260","6.1879","0.0002","19.9274","0.0007","6.9846","0.0002","90","","91.199","0.001","90","","861.07","0.05","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Nitrophenol‒piperazine (2/1)","","- C16 H20 N4 O6 -","- C16 H20 N4 O6 -","- C32 H40 N8 O12 -","2","0.5","SU2605","Nagapandiselvi, Perumal; Muralidharan, Srinivasan; Srinivasan, Thothadri; Goplalakrishnan, Rengaswamy; Velmurugan, Devadasan","4-Nitrophenol‒piperazine (2/1)","Acta Crystallographica Section E","2013","69","7","o1044","","10.1107/S1600536813015328","","","0.71073","MoKα","","0.0447","0.0368","","","0.1035","0.1107","","","","","","1.037","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2238261","9.4359","0.0006","16.5086","0.0011","15.1964","0.001","90","","96.363","0.004","90","","2352.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Methyl-4-(naphthalen-2-yl)-3a-nitro-3,3a,4,9b-tetrahydro-2<i>H</i>-spiro[chromeno[3,4-<i>c</i>]pyrrole-1,3'-indolin]-2'-one","","- C29 H23 N3 O4 -","- C29 H23 N3 O4 -","- C116 H92 N12 O16 -","4","1","SU2607","Devi, Seenivasan Karthiga; Srinivasan, Thothadri; Rao, Jonnalagadda Naga Siva; Raghunathan, Raghavachary; Velmurugan, Devadasan","2-Methyl-4-(naphthalen-2-yl)-3a-nitro-3,3a,4,9b-tetrahydro-2<i>H</i>-spiro[chromeno[3,4-<i>c</i>]pyrrole-1,3'-indolin]-2'-one","Acta Crystallographica Section E","2013","69","7","o1045","o1046","10.1107/S160053681301533X","","","0.71073","MoKα","","0.0799","0.0476","","","0.1219","0.1413","","","","","","1.029","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238262","15.1863","0.001","15.5795","0.0011","16.9774","0.0012","75.473","0.002","85.686","0.002","84.762","0.002","3866.4","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5,11,17,23-Tetra-<i>tert</i>-butyl-25,26,27,28-tetrakis(4-methylsulfanylbenzyloxy)-2,8,14,20-tetrathiacalix[4]arene","","- C72 H80 O4 S8 -","- C72 H80 O4 S8 -","- C144 H160 O8 S16 -","2","1","SU2608","Gao, Qingsong; Xie, Dexun; An, Delie","1,3-Alternate conformer 5,11,17,23-tetra-<i>tert</i>-butyl-25,26,27,28-tetrakis(4-methylsulfanylbenzyloxy)-2,8,14,20-tetrathiacalix[4]arene","Acta Crystallographica Section E","2013","69","7","o1009","o1010","10.1107/S1600536813014827","","","0.71073","MoKα","","0.0917","0.0594","","","0.1568","0.1718","","","","","","0.961","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238263","22.0243","0.0005","16.1559","0.0004","4.8055","0.0001","90","","90","","90","","1709.9","0.07","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Ethyl 2-[(2-hydroxybenzylidene)amino]-6-methyl-4,5,6,7-tetrahydrothieno[2,3-<i>c</i>]pyridine-3-carboxylate","","- C18 H20 N2 O3 S -","- C18 H20 N2 O3 S -","- C72 H80 N8 O12 S4 -","4","1","SU2610","Çolak, Naki; Köse, Dursun Ali; Marım, Nazmiye; Çelik, Ömer; Hökelek, Tuncer","Ethyl 2-[(2-hydroxybenzylidene)amino]-6-methyl-4,5,6,7-tetrahydrothieno[2,3-<i>c</i>]pyridine-3-carboxylate","Acta Crystallographica Section E","2013","69","7","o1116","o1117","10.1107/S1600536813016474","","","0.71073","MoKα","","0.0671","0.0431","","","0.0927","0.1042","","","","","","1.016","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238264","9.8506","0.0003","10.0936","0.0003","12.1096","0.0004","90","","110.409","0.002","90","","1128.45","0.06","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-[(5-Chloro-2-hydroxybenzylidene)amino]-2-sulfanylidene-1,3-thiazolidin-4-one","","- C10 H7 Cl N2 O2 S2 -","- C10 H7 Cl N2 O2 S2 -","- C40 H28 Cl4 N8 O8 S8 -","4","1","SU2611","Dal, Hakan","3-[(5-Chloro-2-hydroxybenzylidene)amino]-2-sulfanylidene-1,3-thiazolidin-4-one","Acta Crystallographica Section E","2013","69","7","o1128","","10.1107/S1600536813016577","","","0.71073","MoKα","","0.0363","0.0282","","","0.0704","0.0805","","","","","","1.085","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238265","9.1349","0.0009","7.9451","0.0005","15.6121","0.0013","90","","90","","90","","1133.09","0.16","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","<i>trans</i>-Diamminedichloridobis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II)","","- C6 H14 Cl2 N6 Ni -","- C6 H14 Cl2 N6 Ni -","- C24 H56 Cl8 N24 Ni4 -","4","0.5","SU2612","Kannan, Piskala Subburaman; Ganeshraja, Ayyakannu Sundaram; Rajkumar, Kanniah; Anbalagan, Krishnamoorthy; SubbiahPandi, Arunachalatheva","<i>trans</i>-Diamminedichloridobis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II)","Acta Crystallographica Section E","2013","69","7","m410","","10.1107/S1600536813016747","","","0.71073","MoKα","","0.051","0.0445","","","0.1238","0.1286","","","","","","1.109","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238266","10.2218","0.0004","7.8348","0.0003","17.5678","0.0006","90","","111.941","0.002","90","","1305.03","0.09","273","","273","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis{1-[(<i>E</i>)-(2-chlorophenyl)diazenyl]naphthalen-2-olato}copper(II)","","- C32 H20 Cl2 Cu N4 O2 -","- C32 H20 Cl2 Cu N4 O2 -","- C64 H40 Cl4 Cu2 N8 O4 -","2","0.5","SU2613","Benaouida, Mohamed Amine; Benosmane, Ali; Bouguerria, Hassiba; Bouaoud, Salah Eddine; Merazig, Hocine","Bis{1-[(<i>E</i>)-(2-chlorophenyl)diazenyl]naphthalen-2-olato}copper(II)","Acta Crystallographica Section E","2013","69","7","m405","","10.1107/S1600536813016681","","","0.71073","MoKα","","0.0421","0.0336","","","0.0788","0.0822","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238267","13.1495","0.0001","12.7439","0.0001","24.0386","0.0002","90","","97.186","0.001","90","","3996.65","0.06","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Pallidol hexaacetate ethyl acetate monosolvate","(±)-(4b<i>R</i>,5<i>R</i>,9b<i>R</i>,10<i>R</i>)-5,10-Bis[4-(acetyloxy)phenyl]-4b,5,9b,10-tetrahydroindeno[2,1-<i>a</i>]indene-1,3,6,8-tetrayl tetraacetate ethyl acetate monosolvate","","- C44 H42 O14 -","- C40 H34 O12 -","- C160 H136 O48 -","4","0.5","SU2614","Mao, Qinyong; Taylor, Dennis K.; Ng, Seik Weng; Tiekink, Edward R. T.","Pallidol hexaacetate ethyl acetate monosolvate","Acta Crystallographica Section E","2013","69","7","o1155","o1156","10.1107/S160053681301708X","","","1.54184","CuKα","","0.0378","0.0355","","","0.0935","0.095","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238268","7.1296","0.0003","12.9532","0.0007","15.6181","0.0008","111.562","0.002","90.536","0.002","100.779","0.002","1312.92","0.11","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)-1-[2-(2-Cyanophenyl)diazen-2-ium-1-yl]naphthalen-2-olate","","- C17 H11 N3 O -","- C17 H11 N3 O -","- C68 H44 N12 O4 -","4","2","SU2616","Bougueria, Hassiba; Benaouida, Mohamed Amine; Bouacida, Sofiane; el kader Bouchoul, Abd","(<i>E</i>)-1-[2-(2-Cyanophenyl)diazen-2-ium-1-yl]naphthalen-2-olate","Acta Crystallographica Section E","2013","69","7","o1175","o1176","10.1107/S1600536813017261","","","0.71073","MoKα","","0.0867","0.046","","","0.1016","0.1198","","","","","","1.06","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238269","19.2409","0.0015","6.8457","0.0006","15.6393","0.0013","90","","98.255","0.002","90","","2038.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3<i>E</i>,5<i>E</i>)-1-Allyl-3,5-bis(4-methoxybenzylidene)piperidin-4-one","","- C24 H25 N O3 -","- C24 H25 N O3 -","- C96 H100 N4 O12 -","4","1","TK5227","Almansour, Abdulrahman I.; Kumar, Raju Suresh; Arumugam, Natarajan; Vishnupriya, R.; Suresh, J.","(3<i>E</i>,5<i>E</i>)-1-Allyl-3,5-bis(4-methoxybenzylidene)piperidin-4-one","Acta Crystallographica Section E","2013","69","7","o1071","","10.1107/S1600536813015195","","","0.71073","MoKα","","0.0869","0.0496","","","0.1415","0.1691","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238270","11.4896","0.0015","7.9311","0.0011","13.4853","0.0017","90","","111.619","0.012","90","","1142.4","0.3","200","2","200","2","","","","","","","","5","P 1 21 1","P 2yb","4","","<i>N</i>,<i>N</i>,<i>N</i>-Trimethyl-<i>N</i>-(methyl 5-deoxy-2,3-<i>O</i>-isopropylidene-β-D-ribofuranosid-5-yl)ammonium 4-methylbenzenesulfonate sesquihydrate","","- C19 H34 N O8.5 S -","- C19 H31 N O7 S -","- C38 H62 N2 O14 S2 -","2","1","TK5228","Dmochowska, Barbara; Sikora, Karol; Chojnacki, Jaroslaw; Wojnowski, Wieslaw; Wiśniewski, Andrzej","<i>N</i>,<i>N</i>,<i>N</i>-Trimethyl-<i>N</i>-(methyl 5-deoxy-2,3-<i>O</i>-isopropylidene-β-<small>D</small>-ribofuranosid-5-yl)ammonium 4-methylbenzenesulfonate sesquihydrate","Acta Crystallographica Section E","2013","69","7","o1019","o1020","10.1107/S1600536813014797","","","0.71073","MoKα","","0.0536","0.0514","","","0.1356","0.1392","","","","","","1.073","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238271","8.0978","0.0016","9.7244","0.0019","11.694","0.002","89.26","0.03","89.12","0.03","89.64","0.03","920.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Poly[dimethylammonium [(μ~2~-benzene-1,2-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^)[μ~2~-3-(pyridin-4-yl)-1<i>H</i>-pyrazol-1-ido-κ^2^<i>N</i>^1^:<i>N</i>^3^]cuprate(II)]]","","- C18 H18 Cu N4 O4 -","- C16 H10 Cu N3 O4 -","- C32 H20 Cu2 N6 O8 -","2","1","TK5232","Na, Liu","Poly[dimethylammonium [(μ~2~-benzene-1,2-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^)[μ~2~-3-(pyridin-4-yl)-1<i>H</i>-pyrazol-1-ido-κ^2^<i>N</i>^1^:<i>N</i>^3^]cuprate(II)]]","Acta Crystallographica Section E","2013","69","7","m400","m401","10.1107/S1600536813016334","","","0.71073","MoKα","","0.0641","0.0458","","","0.1172","0.1237","","","","","","1.064","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238272","10.517","0.0005","11.241","0.0006","12.515","0.0007","110.364","0.002","102.049","0.002","107.409","0.001","1239.95","0.12","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H27 Br F N O4 -","- C27 H27 Br F N O4 -","- C54 H54 Br2 F2 N2 O8 -","2","1","VM2194","Xu, Bing-Rong; He, Xing-Rui; Cheng, Jing-Li; Zhao, Jin-Hao","3-(2,5-Dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl 3-(2-bromo-4-fluorophenyl)acrylate","Acta Crystallographica Section E","2013","69","7","o1064","o1065","10.1107/S160053681301430X","","","0.71073","MoKα","","0.0723","0.0413","","","0.0929","0.1336","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238273","7.7468","0.0002","8.4036","0.0002","15.4765","0.0004","79.732","0.002","89.983","0.002","67.889","0.002","916.02","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-(Dimethylamino)pyridinium trichlorido[4-(dimethylamino)pyridine-κ<i>N</i>]cobaltate(II)","","- C14 H21 Cl3 Co N4 -","- C14 H21 Cl3 Co N4 -","- C28 H42 Cl6 Co2 N8 -","2","1","VM2195","Guenifa, Fatiha; Hadjadj, Nasreddine; Zeghouan, Ouahida; Bendjeddou, Lamia; Merazig, Hocine","4-(Dimethylamino)pyridinium trichlorido[4-(dimethylamino)pyridine-κ<i>N</i>]cobaltate(II)","Acta Crystallographica Section E","2013","69","7","m379","m380","10.1107/S1600536813015602","","","0.71073","MoKα","","0.0229","0.0205","","","0.0526","0.0541","","","","","","1.044","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238274","9.7857","0.0003","13.7658","0.0005","17.0297","0.0006","66.581","0.004","78.689","0.003","72.601","0.003","2000.9","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Tris(<i>N</i>,<i>N</i>-dimethylanilinium) tri-μ-bromido-bis[tribromidoantimonate(III)]","","- C24 H36 Br9 N3 Sb2 -","- C24 H36 Br9 N3 Sb2 -","- C48 H72 Br18 N6 Sb4 -","2","1","VN2071","Kharrat, Houda; Kamoun, Slaheddine; Michaud, François","Tris(<i>N</i>,<i>N</i>-dimethylanilinium) tri-μ-bromido-bis[tribromidoantimonate(III)]","Acta Crystallographica Section E","2013","69","7","m353","","10.1107/S1600536813014335","","","0.71073","MoKα","","0.1036","0.0422","","","0.0843","0.0956","","","","","","0.875","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238275","10.3138","0.0006","19.8865","0.0012","13.7584","0.0009","90","","92.984","0.001","90","","2818.1","0.3","291","2","291","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Chlorido{1-[(dimethylamino)methyl]ferrocenyl-κ^2^<i>C</i>^1^,<i>N</i>}(triphenylstibine-κ<i>Sb</i>)palladium(II)","","- C31 H31 Cl Fe N Pd Sb -","- C31 H31 Cl Fe N Pd Sb -","- C124 H124 Cl4 Fe4 N4 Pd4 Sb4 -","4","1","VN2072","Pérez, Diego; Sharma, Pankaj; Sharma, Manju; Hernández, Simón","Chlorido{1-[(dimethylamino)methyl]ferrocenyl-κ^2^<i>C</i>^2^,<i>N</i>}(triphenylstibine-κ<i>Sb</i>)palladium(II)","Acta Crystallographica Section E","2013","69","7","m372","","10.1107/S1600536813015109","","","0.71073","MoKα","","0.0434","0.0321","","","0.0602","0.0625","","","","","","0.934","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238276","7.4251","0.0002","9.8341","0.0002","13.3035","0.0003","78.803","0.001","83.305","0.002","86.344","0.002","945.58","0.04","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Chlorido[2,2'-[1,2-phenylenebis(nitrilomethanylylidyne)]diphenolato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']manganese(III) methanol monosolvate","","- C21 H18 Cl Mn N2 O3 -","- C21 H18 Cl Mn N2 O3 -","- C42 H36 Cl2 Mn2 N4 O6 -","2","1","VN2073","Lin, Hui; Wang, Jian-Gang; Shi, Hua-Tian; Chen, Qun; Zhang, Qian-Feng","Chlorido[2,2'-[1,2-phenylenebis(nitrilomethanylylidyne)]diphenolato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']manganese(III) methanol monosolvate","Acta Crystallographica Section E","2013","69","7","m404","","10.1107/S1600536813016450","","","0.71073","MoKα","","0.054","0.0345","","","0.0773","0.0858","","","","","","1.016","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238277","10.7285","0.0003","18.547","0.0004","38.0785","0.0009","90","","90","","90","","7576.9","0.3","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","<i>cis</i>-Bis(<i>O</i>-methyldithiocarbonato-κ^2^<i>S</i>,<i>S</i>')bis(triphenylphosphane-κ<i>P</i>)ruthenium(II)","","- C40 H36 O2 P2 Ru S4 -","- C40 H36 O2 P2 Ru S4 -","- C320 H288 O16 P16 Ru8 S32 -","8","1","VN2074","Valerio-Cárdenas, Cintya; Hernández-Ortega, Simón; Reyes-Martínez, Reyna; Morales-Morales, David","<i>cis</i>-Bis(<i>O</i>-methyldithiocarbonato-κ^2^<i>S</i>,<i>S</i>')bis(triphenylphosphane-κ<i>P</i>)ruthenium(II)","Acta Crystallographica Section E","2013","69","7","m408","m409","10.1107/S1600536813016735","","","0.71073","MoKα","","0.0637","0.039","","","0.0843","0.0967","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238278","7.852","0.0006","6.7922","0.0005","17.5394","0.0009","90","","95.44","0.003","90","","931.2","0.11","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Tetrammine-Carbonatocobalt(III) Nitrate","Tetraammine(carbonato-κ^2^<i>O</i>,<i>O</i>')cobalt(III)","","- C H12 Co N5 O6 -","- C H12 Co N5 O6 -","- C4 H48 Co4 N20 O24 -","4","1","VN2075","Le Bail, Armel","Tetraammine(carbonato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) nitrate: a powder X-ray diffraction study","Acta Crystallographica Section E","2013","69","7","i42","i43","10.1107/S1600536813017522","powder diffraction","","1.5418","CuKα","","2.64","","","","","","","","2.85","","","","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238279","10.2211","0.0001","17.1355","0.0002","16.4142","0.0002","90","","125.484","0.001","90","","2340.92","0.05","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[diaquatris(μ~2~-4,4'-bipyridine)bis[μ~2~-2-(carboxylatomethylsulfanyl)nicotinato]dicobalt(II)] 1.3-hydrate]","","- C46 H40.6 Co2 N8 O11.3 S2 -","- C46 H38 Co2 N8 O11.3 S2 -","- C92 H76 Co4 N16 O22.6 S4 -","2","0.5","WM2744","Li, Rui-Qin; Wang, Xiao-Juan; Feng, Yun-Long","Poly[[diaquatris(μ~2~-4,4'-bipyridine)bis[μ~2~-2-(carboxylatomethylsulfanyl)nicotinato]dicobalt(II)] 1.3-hydrate]","Acta Crystallographica Section E","2013","69","7","m371","","10.1107/S1600536813015262","","","0.71073","MoKα","","","0.0325","","","0.0883","0.0932","","","","","","1.048","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238280","7.492","0.0002","22.1442","0.0006","11.6045","0.0003","90","","90","","90","","1925.24","0.09","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Diaqua{2,2'-dimethoxy-6,6'-[(1<i>E</i>,1'<i>E</i>)-propane-1,3-diylbis(azanylylidene)bis(methanylylidene)]diphenolato}nickel(II)","","- C19 H24 N2 Ni O6 -","- C19 H24 N2 Ni O6 -","- C76 H96 N8 Ni4 O24 -","4","0.5","WM2747","Datta, Amitabha; Machura, Barbara; Huang, Jui-Hsien; Sheu, Shiann-Cherng","Diaqua{2,2'-dimethoxy-6,6'-[(1<i>E</i>,1'<i>E</i>)-propane-1,3-diylbis(azanylylidene)bis(methanylylidene)]diphenolato}nickel(II)","Acta Crystallographica Section E","2013","69","7","m399","","10.1107/S1600536813016188","","","0.71073","MoKα","","0.029","0.0253","","","0.0706","0.0729","","","","","","1.056","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238281","9.4521","0.0002","11.0048","0.0003","12.9761","0.0002","100.501","0.002","109.007","0.001","98.427","0.001","1223.62","0.05","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","<i>cis</i>-Dichloridotetrakis(dimethyl sulfoxide-κ<i>O</i>)chromium(III) chloride dimethyl sulfoxide monosolvate","","- C10 H30 Cl3 Cr O5 S5 -","- C10 H30 Cl3 Cr O5 S5 -","- C20 H60 Cl6 Cr2 O10 S10 -","2","1","WM2748","Al-Najjar, Nada A.; Al-Sudani, Abdul-Razak H.; Shanshal, Muthana A.; Mousa, Falih H.; Kariuki, Benson M.","<i>cis</i>-Dichloridotetrakis(dimethyl sulfoxide-κ<i>O</i>)chromium(III) chloride dimethyl sulfoxide monosolvate","Acta Crystallographica Section E","2013","69","7","m395","m396","10.1107/S160053681301622X","","","0.71073","MoKα","","0.0711","0.0514","","","0.1203","0.1383","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238282","16.9093","0.001","9.7287","0.0005","20.9019","0.0012","90","","112.396","0.003","90","","3179.1","0.3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","katayamalite","Potassium trilithium heptacalcium dititanium dodecasilicate dihydroxide","","- Ca7 H2 K Li3 O38 Si12 Ti2 -","- Ca7 H2 K Li3 O38 Si12 Ti2 -","- Ca28 H8 K4 Li12 O152 Si48 Ti8 -","4","0.5","WM2749","Andrade, Marcelo B.; Doell, Donald; Downs, Robert T.; Yang, Hexiong","Redetermination of katayamalite, KLi~3~Ca~7~Ti~2~(SiO~3~)~12~(OH)~2~","Acta Crystallographica Section E","2013","69","7","i41","","10.1107/S1600536813016620","","","0.71073","MoKα","","0.0591","0.0348","","","0.0742","0.0825","","","","","","1.01","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238283","27.2051","0.0006","20.4336","0.0005","11.437","0.0002","90","","90","","90","","6357.8","0.2","175","","175","","","","","","","","","7","A b a 2","A 2 -2ab","41","","Poly[tetrabutylammonium [chloridohexamethyl-μ~3~-sulfato-distannate(IV)]]","","- C22 H54 Cl N O4 S Sn2 -","- C22 H54 Cl N O4 S Sn2 -","- C176 H432 Cl8 N8 O32 S8 Sn16 -","8","","WM2750","Diop, Tidiane; van der Lee, Arie; Sidibé, Mamadou","Poly[tetrabutylammonium [chloridohexamethyl-μ~3~-sulfato-distannate(IV)]]","Acta Crystallographica Section E","2013","69","7","m406","m407","10.1107/S1600536813016723","","","0.71073","MoKα","","0.0612","0.0528","","0.0586","0.053","0.0529","","","","","","1.0688","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238284","30.164","0.002","8.0739","0.0004","10.2696","0.0005","90","","98.752","0.002","90","","2471.9","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[μ~2~-aqua-μ~4~-[1-(4-chlorophenyl)-4,4,4-trifluorobutane-1,3-dionato]-potassium]","","- C10 H7 Cl F3 K O3 -","- C10 H7 Cl F3 K O3 -","- C80 H56 Cl8 F24 K8 O24 -","8","1","WM2752","Martins, João P.; Arranja, Cláudia C.; Sobral, Abílio J. F. N.; Ramos Silva, Manuela","Poly[μ~2~-aqua-μ~4~-[1-(4-chlorophenyl)-4,4,4-trifluorobutane-1,3-dionato]-potassium]","Acta Crystallographica Section E","2013","69","7","m422","m423","10.1107/S1600536813017388","","","0.71073","MoKα","","0.0593","0.0374","","","0.0858","0.097","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238285","13.3975","0.0014","18.7124","0.0018","6.5721","0.0008","90","","97.897","0.01","90","","1632","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[(6-Chloropyridin-3-yl)methyl]-10-nitro-1,2,3,5,6,7,8,9-octahydro-5,9-methanoimidazo[1,2-<i>a</i>]azocin-5-ol","","- C16 H19 Cl N4 O3 -","- C16 H19 Cl N4 O3 -","- C64 H76 Cl4 N16 O12 -","4","1","XU5695","Cui, Shu-Xia; Zhang, Guang-You; Tian, Zhong-Zhen","1-[(6-Chloropyridin-3-yl)methyl]-10-nitro-1,2,3,5,6,7,8,9-octahydro-5,9-methanoimidazo[1,2-<i>a</i>]azocin-5-ol","Acta Crystallographica Section E","2013","69","7","o1015","","10.1107/S1600536813014402","","","0.71073","MoKα","","0.1241","0.071","","","0.1902","0.2171","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238286","3.71","0.0005","13.4195","0.0019","18.033","0.003","90","","94.143","0.003","90","","895.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Carbamoyl(diaminomethylidene)azanium 3-nitro-5-oxo-4,5-dihydro-1<i>H</i>-1,2,4-triazol-4-ide","","- C4 H8 N8 O4 -","- C4 H8 N8 O4 -","- C16 H32 N32 O16 -","4","1","XU5702","Huang, Xin-Ping; Wang, Bo-Zhou; Li, Dong-Ping; Ng, Seik Weng","Carbamoyl(diaminomethylidene)azanium 3-nitro-5-oxo-4,5-dihydro-1<i>H</i>-1,2,4-triazol-4-ide","Acta Crystallographica Section E","2013","69","7","o1086","","10.1107/S1600536813015699","","","0.71073","MoKα","","0.0796","0.0435","","","0.0979","0.1164","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238287","19.728","0.0006","7.4755","0.0003","24.4847","0.0007","90","","90","","90","","3610.9","0.2","292","2","292","2","","","","","","","","7","P n a 21","P 2c -2n","33","","{2-[(1,3-Benzothiazol-2-yl)methoxy]-5-fluorophenyl}(4-chlorophenyl)methanone","","- C21 H13 Cl F N O2 S -","- C21 H13 Cl F N O2 S -","- C168 H104 Cl8 F8 N8 O16 S8 -","8","2","XU5707","Venugopala, K. N.; Nayak, Susanta K.; Govender, Thavendran; Kruger, Hendrik G.; Maguire, Glenn E. M.","{2-[(1,3-Benzothiazol-2-yl)methoxy]-5-fluorophenyl}(4-chlorophenyl)methanone","Acta Crystallographica Section E","2013","69","7","o1007","o1008","10.1107/S1600536813014621","","","0.7107","MoKα","","0.1125","0.0531","","","0.0942","0.1181","","","","","","0.994","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238288","16.34","0.002","5.7665","0.0004","15.632","0.002","90","","113.604","0.004","90","","1349.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-1-(3-Chlorophenyl)-2-(2-oxidonaphthalen-1-yl)diazen-1-ium","","- C16 H11 Cl N2 O -","- C16 H11 Cl N2 O -","- C64 H44 Cl4 N8 O4 -","4","1","XU5708","Benosmane, Ali; Mili, Assia; Bouguerria, Hassiba; Bouchoul, Abdelkader","(<i>E</i>)-1-(3-Chlorophenyl)-2-(2-oxidonaphthalen-1-yl)diazen-1-ium","Acta Crystallographica Section E","2013","69","7","o1021","","10.1107/S1600536813014931","","","0.71073","MoKα","","0.1204","0.0588","","","0.146","0.1851","","","","","","1.008","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238289","17.1956","0.0002","17.0918","0.0002","17.3903","0.0002","90","","106.416","0.001","90","","4902.72","0.1","173","0.14","173","0.14","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)cadmium‒18-crown-6 (1/1)","","- C56 H54 Cd N4 O7 -","- C56 H54 Cd N4 O7 -","- C224 H216 Cd4 N16 O28 -","4","1","XU5709","Toumi, Hamza; Belghith, Yassine; Daran, Jean-Claude; Nasri, Habib","Aqua(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)cadmium(II)‒18-crown-6 (1/1)","Acta Crystallographica Section E","2013","69","7","m354","m355","10.1107/S160053681301489X","","","0.71073","MoKα","","0.0379","0.0282","","","0.0671","0.0735","","","","","","1.043","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238290","31.8553","0.0008","6.1786","0.0002","7.5117","0.0003","90","","96.554","0.002","90","","1468.8","0.08","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[aquabis(μ-3-chlorobenzoato-κ^2^<i>O</i>:<i>O</i>')zinc]","","- C14 H10 Cl2 O5 Zn -","- C14 H10 Cl2 O5 Zn -","- C56 H40 Cl8 O20 Zn4 -","4","0.5","XU5711","Bozkurt, Nihat; Dilek, Nefise; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","<i>catena</i>-Poly[aquabis(μ-3-chlorobenzoato-κ^2^<i>O</i>:<i>O</i>')zinc]","Acta Crystallographica Section E","2013","69","7","m381","m382","10.1107/S160053681301564X","","","0.71073","MoKα","","0.0276","0.0256","","","0.0671","0.0686","","","","","","1.115","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238291","13.9469","0.0006","9.3616","0.0004","27.7941","0.0012","90","","96.584","0.001","90","","3605","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ-(Acetic acid)-di-μ-chlorido-bis[triphenyltellurium(IV)] monohydrate","","- C38 H36 Cl2 O3 Te2 -","- C38 H36 Cl2 O3 Te2 -","- C152 H144 Cl8 O12 Te8 -","4","1","XU5713","Hu, Feng; Xu, Chao; Shi, Hua-Tian; Chen, Qun; Zhang, Qian-Feng","μ-(Acetic acid)-di-μ-chlorido-bis[triphenyltellurium(IV)] monohydrate","Acta Crystallographica Section E","2013","69","7","o1171","","10.1107/S160053681301739X","","","0.71073","MoKα","","0.0462","0.0315","","","0.0726","0.0779","","","","","","1.076","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238292","7.9961","0.0002","10.6641","0.0002","11.1695","0.0002","71.98","0.001","74.694","0.001","79.964","0.001","869.13","0.03","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","5-Bromo-2-(4-fluorophenyl)-7-methyl-3-phenylsulfinyl-1-benzofuran","","- C21 H14 Br F O2 S -","- C21 H14 Br F O2 S -","- C42 H28 Br2 F2 O4 S2 -","2","1","XU5714","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Bromo-2-(4-fluorophenyl)-7-methyl-3-phenylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2013","69","7","o1135","","10.1107/S1600536813016760","","","0.71073","MoKα","","0.0348","0.0287","","","0.0722","0.0754","","","","","","1.048","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238293","8.4","0.0017","11.008","0.002","12.304","0.003","74.33","0.03","75.38","0.03","86.18","0.03","1060","0.4","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 4-(2-ethoxy-2-oxoethyl)-3-oxo-4,13-diazapentacyclo[11.8.0.0^2,11^.0^5,10^.0^14,19^]henicosa-1,5(10),6,8,11,14(19),15,17,20-nonaene-12-carboxylate","","- C26 H22 N2 O5 -","- C26 H22 N2 O5 -","- C52 H44 N4 O10 -","2","1","YK2094","Meng, Qing-Hua; Wu, Ya-Nan; Jiang, Ke; Liu, Yun","Ethyl 4-(2-ethoxy-2-oxoethyl)-3-oxo-4,13-diazapentacyclo[11.8.0.0^2,11^.0^5,10^.0^14,19^]henicosa-1,5(10),6,8,11,14(19),15,17,20-nonaene-12-carboxylate","Acta Crystallographica Section E","2013","69","7","o1130","","10.1107/S1600536813015833","","","0.71073","MoKα","","0.0754","0.0546","","","0.1399","0.1534","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238294","9.4741","0.0002","15.95","0.0006","17.9102","0.0008","90","","90","","90","","2706.44","0.17","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-[4-(Carbazol-9-yl)phenyl]-1,3-diethyl-1,3-diphenylguanidine","","- C35 H32 N4 -","- C35 H32 N4 -","- C140 H128 N16 -","4","1","ZL2551","Tiritiris, Ioannis; Kantlehner, Willi","2-[4-(Carbazol-9-yl)phenyl]-1,3-diethyl-1,3-diphenylguanidine","Acta Crystallographica Section E","2013","69","7","o1066","","10.1107/S1600536813014517","","","0.71073","MoKα","","0.0504","0.0384","","","0.0809","0.0857","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238295","9.5222","0.0006","9.5799","0.0006","10.2195","0.0006","67.777","0.001","88.063","0.001","72.464","0.001","819.49","0.09","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","5,15-Bis(4-pentyloxyphenyl)porphyrin","","- C42 H42 N4 O2 -","- C42 H42 N4 O2 -","- C42 H42 N4 O2 -","1","0.5","ZL2552","Senge, Mathias O.","5,15-Bis(4-pentyloxyphenyl)porphyrin","Acta Crystallographica Section E","2013","69","7","o1048","","10.1107/S160053681301550X","","","0.71073","MoKα","","0.0766","0.0453","","","0.0955","0.1088","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238296","13.0939","0.0007","8.9752","0.0005","14.2986","0.0011","90","","90","","90","","1680.38","0.18","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Poly[(acetonitrile-κ<i>N</i>)-μ~3~-thiocyanato-κ^3^<i>N</i>:<i>S</i>:<i>S</i>-μ~2~-thiocyanato-κ^2^<i>N</i>:<i>S</i>-cadmium]","","- C4 H3 Cd N3 S2 -","- C4 H3 Cd N3 S2 -","- C32 H24 Cd8 N24 S16 -","8","1","ZL2553","Reinert, Thorben; Jess, Inke; Näther, Christian","Poly[(acetonitrile-κ<i>N</i>)-μ~3~-thiocyanato-κ^3^<i>N</i>:<i>S</i>:<i>S</i>-μ~2~-thiocyanato-κ^2^<i>N</i>:<i>S</i>-cadmium]","Acta Crystallographica Section E","2013","69","7","m398","","10.1107/S1600536813015870","","","0.71073","MoKα","","0.0343","0.0334","","","0.089","0.0897","","","","","","1.166","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238297","18.8842","0.0011","9.5339","0.0004","19.114","0.0009","90","","90","","90","","3441.3","0.3","296","2","296","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","5-Phenyl-3,5-dihydro-<i>o</i>-benzenonaphtho[1,2-<i>c</i>]thiophene","8-Phenyl-16-thiapentacyclo[6.6.5.0^1,18^.0^2,7^.0^9,14^]nonadeca-2,4,6,9,11,13,18-heptaene","","- C24 H18 S -","- C24 H18 S -","- C192 H144 S8 -","8","1","ZL2554","Mathew, Eason M.; Sithambaresan, M.; Unnikrishnan, P. A.; Kurup, M. R. Prathapachandra","8-Phenyl-16-thiapentacyclo[6.6.5.0^1,18^.0^2,7^.0^9,14^]nonadeca-2,4,6,9,11,13,18-heptaene","Acta Crystallographica Section E","2013","69","7","o1165","","10.1107/S1600536813017285","","","0.71073","MoKα","","0.0649","0.0421","","","0.1148","0.138","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238298","6.8988","0.0015","9.14","0.002","11.95","0.003","80.937","0.009","75.365","0.008","79.614","0.008","712.1","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","8-Chloromethyl-5-(2,5-dioxooxolan-3-yl)-3,3a,4,5-tetrahydro-1<i>H</i>-naphtho[1,2-<i>c</i>]furan-1,3-dione","","- C17 H13 Cl O6 -","- C17 H13 Cl O6 -","- C34 H26 Cl2 O12 -","2","1","ZP2004","Guo, Y. Z.; Song, Y. Z.; Liu, J. G.; Yang, S. Y.","8-Chloromethyl-5-(2,5-dioxooxolan-3-yl)-3,3a,4,5-tetrahydro-1<i>H</i>-naphtho[1,2-<i>c</i>]furan-1,3-dione","Acta Crystallographica Section E","2013","69","7","o1031","o1032","10.1107/S1600536813014943","","","0.71073","MoKα","","0.0456","0.0423","","","0.1057","0.1081","","","","","","1.102","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238299","8.5699","0.0007","7.52","0.0006","16.6101","0.0018","90","","102.682","0.007","90","","1044.33","0.17","291","2","291","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-2-Methoxy-9-(2-methoxy-9<i>H</i>-xanthen-9-ylidene)-9<i>H</i>-xanthene","","- C28 H20 O4 -","- C28 H20 O4 -","- C56 H40 O8 -","2","0.5","ZQ2201","Tian, Xiang-Yu; Song, Qin-Hua","(<i>E</i>)-2-Methoxy-9-(2-methoxy-9<i>H</i>-xanthen-9-ylidene)-9<i>H</i>-xanthene","Acta Crystallographica Section E","2013","69","7","o1167","","10.1107/S1600536813017297","","","0.71073","MoKα","","0.0745","0.0374","","","0.0568","0.0603","","","","","","0.997","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238300","9.2834","0.0003","6.7081","0.0002","16.8068","0.0006","90","","90","","90","","1046.63","0.06","298","","298","","","","","","","","","3","P n m a","-P 2ac 2n","62","","2-Oxo-2<i>H</i>-chromen-4-yl propionic acid","","- C12 H10 O4 -","- C12 H10 O4 -","- C48 H40 O16 -","4","0.5","ZQ2203","Bibila Mayaya Bisseyou, Yvon; Abou, Akoun; Djandé, Abdoulaye; Danger, Grégoire; Kakou-Yao, Rita","2-Oxo-2<i>H</i>-chromen-4-yl propionate","Acta Crystallographica Section E","2013","69","7","o1125","o1126","10.1107/S1600536813016358","","","0.71073","MoKα","","0.0718","0.0561","","","0.1333","0.1459","","","","","","1.056","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238301","7.889","0.0016","8.662","0.0017","16.629","0.003","90","","102.24","0.03","90","","1110.5","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","17-Cyclopropylmethyl-14-hydroxy-6-oxo-4,5-epoxymorphinan-6-yl benzoate","","- C27 H27 N O5 -","- C27 H27 N O5 -","- C54 H54 N2 O10 -","2","1","ZS2258","Yang, Rui; Wang, Guo-Hai; Liu, Xia-Li; Wang, Dong; Li, Xiang","<i>O</i>-Benzoylnaltrexone","Acta Crystallographica Section E","2013","69","7","o1107","","10.1107/S1600536813016036","","","0.71073","MoKα","","0.1122","0.0672","","","0.1543","0.1804","","","","","","1.001","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238302","5.257","0.0002","17.0254","0.0007","14.6879","0.0005","90","","97.806","0.002","90","","1302.42","0.09","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","<i>rac</i>-3-(4-Hydroxybenzyl)chroman-4-one","","- C16 H14 O3 -","- C16 H14 O3 -","- C64 H56 O12 -","4","1","ZS2259","Shalini, S.; Girija, C. R.; Simon, Lalitha; Srinivasan, K. K.; Venkatesha, T. V.","<i>rac</i>-3-(4-Hydroxybenzyl)chroman-4-one","Acta Crystallographica Section E","2013","69","7","o1011","o1012","10.1107/S1600536813014645","","","0.71073","MoKα","","0.0685","0.0411","","","0.0942","0.1097","","","","","","1.108","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238303","5.9029","0.0005","19.5613","0.0013","16.1662","0.0011","90","","93.493","0.007","90","","1863.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>rac</i>-(<i>E</i>,<i>E</i>)-<i>N</i>,<i>N</i>'-Bis(2-chlorobenzylidene)cyclohexane-1,2-diamine","","- C20 H20 Cl2 N2 -","- C20 H20 Cl2 N2 -","- C80 H80 Cl8 N8 -","4","1","ZS2261","Warad, Ismail; Al-Noaimi, Mousa; Haddad, Salim F.; Al-Demeri, Yasmin; Hammouti, Belkheir","<i>rac</i>-(<i>E</i>,<i>E</i>)-<i>N</i>,<i>N</i>'-Bis(2-chlorobenzylidene)cyclohexane-1,2-diamine","Acta Crystallographica Section E","2013","69","7","o1075","","10.1107/S1600536813014554","","","0.71073","MoKα","","0.0735","0.0458","","","0.0921","0.1055","","","","","","1.024","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238304","15.2489","0.0015","13.9888","0.0013","7.7198","0.0007","90","","109.809","0.001","90","","1549.3","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[di-μ~3~-bromido-bis[(1-ethyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)disilver(I)]","","- C10 H16 Ag2 Br2 N4 -","- C10 H16 Ag2 Br2 N4 -","- C40 H64 Ag8 Br8 N16 -","4","0.5","ZS2262","Wang, Zhiguo; Bian, Qingquan; Guo, Ying","<i>catena</i>-Poly[di-μ~3~-bromido-bis[(1-ethyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)disilver(I)]]","Acta Crystallographica Section E","2013","69","7","m411","","10.1107/S1600536813016875","","","0.71073","MoKα","","0.0196","0.0188","","","0.0474","0.0478","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238305","8.892","0.0015","10.748","0.0017","12.923","0.0018","110.258","0.009","90.952","0.006","108.408","0.007","1088.3","0.3","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","10-{4-[(2-Hydroxybenzylidene)amino]phenyl}-5,5-difluoro-1,3,7,9-tetramethyl-5<i>H</i>-dipyrrolo[1,2-<i>c</i>:2',1'-<i>f</i>][1,3,2]diazaborinin-4-ium-5-uide","","- C26 H24 B F2 N3 O -","- C26 H24 B F2 N3 O -","- C52 H48 B2 F4 N6 O2 -","2","1","ZS2263","Li, Zhensheng","10-{4-[(2-Hydroxybenzylidene)amino]phenyl}-5,5-difluoro-1,3,7,9-tetramethyl-5<i>H</i>-dipyrrolo[1,2-<i>c</i>:2',1'-<i>f</i>][1,3,2]diazaborinin-4-ium-5-uide","Acta Crystallographica Section E","2013","69","7","o1072","","10.1107/S1600536813015523","","","0.71075","MoKα","","0.1","0.0709","","","0.2093","0.2173","","","","","","1.092","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238306","10.484","0.002","7.924","0.0016","21.396","0.004","90","","95.16","0.03","90","","1770.3","0.6","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-Bromo-4-(3,5-dibromo-2-hydroxyphenyl)-2-(piperidin-1-yl)-1,3-dithiol-2-ylium bromide","","- C14 H13 Br4 N O S2 -","- C14 H13 Br4 N O S2 -","- C56 H52 Br16 N4 O4 S8 -","4","1","ZS2264","Chirita, Paul; Hrib, Cristian G.; Birsa, Lucian M.","5-Bromo-4-(3,5-dibromo-2-hydroxyphenyl)-2-(piperidin-1-yl)-1,3-dithiol-2-ylium bromide","Acta Crystallographica Section E","2013","69","7","o1097","","10.1107/S1600536813016048","","","0.71073","MoKα","","0.085","0.0613","","","0.1281","0.1372","","","","","","1.079","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238307","11.182","0.002","19.66","0.004","7.4593","0.0015","90","","105.44","0.03","90","","1580.7","0.6","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>rac</i>-1-(5-Bromo-2-hydroxyphenyl)-1-oxopropan-2-yl morpholine-4-carbodithioate","","- C14 H16 Br N O3 S2 -","- C14 H16 Br N O3 S2 -","- C56 H64 Br4 N4 O12 S8 -","4","1","ZS2265","Sarbu, Laura G.; Hrib, Cristian G.; Birsa, Lucian M.","<i>rac</i>-1-(5-Bromo-2-hydroxyphenyl)-1-oxopropan-2-yl morpholine-4-carbodithioate","Acta Crystallographica Section E","2013","69","7","o1169","","10.1107/S1600536813017509","","","0.71073","MoKα","","0.0521","0.0452","","","0.0993","0.1023","","","","","","1.163","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238308","12.026","0.002","8.3448","0.0017","14.279","0.003","90","","91.98","0.03","90","","1432.1","0.5","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-Bromo-2-[5-methyl-2-(morpholin-4-yl)-1,3-thiazol-4-yl]phenol","","- C14 H15 Br N2 O2 S -","- C14 H15 Br N2 O2 S -","- C56 H60 Br4 N8 O8 S4 -","4","1","ZS2266","Bahrin, Lucian G.; Hrib, Cristian G.; Birsa, Lucian M.","4-Bromo-2-[5-methyl-2-(morpholin-4-yl)-1,3-thiazol-4-yl]phenol","Acta Crystallographica Section E","2013","69","7","o1170","","10.1107/S1600536813017510","","","0.71073","MoKα","","0.0497","0.0382","","","0.0836","0.0876","","","","","","1.107","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238309","10.5625","0.0005","13.6374","0.0008","14.4927","0.0008","90","","90","","90","","2087.6","0.2","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(Naphthalen-1-yl){2-[(5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]phenyl}methanone","","- C28 H22 O2 -","- C28 H22 O2 -","- C112 H88 O8 -","4","1","BG2509","Kanchanadevi, J.; Anbalagan, G.; Sivasakthikumaran, R.; Mohanakrishnan, A. K.; Gunasekaran, B.; Manivannan, V.","(Naphthalen-1-yl){2-[(5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]phenyl}methanone","Acta Crystallographica Section E","2013","69","8","o1201","","10.1107/S1600536813018035","","","0.71073","MoKα","","0.0714","0.0422","","","0.0876","0.0998","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238310","6.6471","0.0008","14.1216","0.0018","17.285","0.002","90","","90","","90","","1622.5","0.3","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-(2,6-Diisopropylphenyl)-1<i>H</i>-benzimidazole","","- C19 H22 N2 -","- C19 H22 N2 -","- C76 H88 N8 -","4","1","BG2510","Lai, Sha; Chen, Yong; Li, Yan; Shen, Yonggang; Wu, Hongwei","1-(2,6-Diisopropylphenyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2013","69","8","o1330","","10.1107/S1600536813020473","","","0.71073","MoKα","","0.0422","0.0349","","","0.0835","0.0879","","","","","","1.084","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238311","9.2474","0.0007","9.666","0.0006","9.8764","0.0008","70.268","0.006","64.052","0.008","86.231","0.005","743.69","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-(3-Methoxybenzoyl)-4-methylbenzenesulfonamide","","- C15 H15 N O4 S -","- C15 H15 N O4 S -","- C30 H30 N2 O8 S2 -","2","1","BG2511","Sreenivasa, S.; Palakshamurthy, B. S.; Lohith, T. N.; Mohan, N. R.; Kumar, Vijith; Suchetan, P. A.","<i>N</i>-(3-Methoxybenzoyl)-4-methylbenzenesulfonamide","Acta Crystallographica Section E","2013","69","8","o1263","","10.1107/S1600536813019107","","","0.71073","MoKα","","0.0461","0.0394","","","0.1049","0.1121","","","","","","1.057","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238312","24.3035","0.0015","13.831","0.0008","16.4507","0.0016","90","","107.345","0.008","90","","5278.3","0.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","4-Chlorobutyl 7-chloro-1-cyclopropyl-4-(1,3-diethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)-6-fluoro-1,4-dihydroquinoline-3-carboxylate","","- C25 H26 Cl2 F N3 O4 S -","- C25 H26 Cl2 F N3 O4 S -","- C200 H208 Cl16 F8 N24 O32 S8 -","8","1","BH2478","Sweidan, Kamal; Haddad, Salim F.; AlDamen, Murad A.; Al-Sheikhb, Ahmed","4-Chlorobutyl 7-chloro-1-cyclopropyl-4-(1,3-diethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)-6-fluoro-1,4-dihydroquinoline-3-carboxylate","Acta Crystallographica Section E","2013","69","8","o1191","","10.1107/S1600536813016024","","","0.7107","MoKα","","0.1461","0.0776","","","0.1847","0.2303","","","","","","1.022","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238313","18.4489","0.0015","16.9049","0.0013","3.8564","0.0003","90","","90","","90","","1202.72","0.16","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2,4-Dibromo-1,3-dihydroxy-9<i>H</i>-xanthen-9-one","","- C13 H6 Br2 O4 -","- C13 H6 Br2 O4 -","- C52 H24 Br8 O16 -","4","1","BH2480","Huang, Shi-Wen; Yang, Zheng-Min; Huang, Fu-Ping; Qin, Jiang-Ke","2,4-Dibromo-1,3-dihydroxy-9<i>H</i>-xanthen-9-one","Acta Crystallographica Section E","2013","69","8","o1361","","10.1107/S1600536813019296","","","0.71073","MoKα","","0.0435","0.0344","","","0.0675","0.0696","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238314","8.054","0.001","9.906","0.003","9.14","0.001","90","","115.47","0.01","90","","658.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Rubidium copper iron bis(phosphate)","","- Cu Fe O8 P2 Rb -","- Cu Fe O8 P2 Rb -","- Cu4 Fe4 O32 P8 Rb4 -","4","1","BR2226","Badri, Abdessalem; Hidouri, Mourad; Ben Amara, Mongi","RbCuFe(PO~4~)~2~","Acta Crystallographica Section E","2013","69","8","i52","","10.1107/S1600536813019569","","","0.71073","MoKα","","0.0556","0.0461","","","0.1188","0.1263","","","","","","1.083","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238315","10.5672","0.0009","6.6323","0.0008","6.9621","0.0008","90","","90","","90","","487.94","0.09","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Potassium sodium dioxidomolybdenum(VI) arsenate","","- As K0.78 Mo Na0.22 O6 -","- As K0.78 Mo Na0.22 O6 -","- As4 K3.12 Mo4 Na0.88 O24 -","4","0.5","BR2228","Jouini, Raja; Bouzidi, Chahira; Zid, Mohamed Faouzi; Driss, Ahmed","K~0.78~Na~0.22~MoO~2~AsO~4~","Acta Crystallographica Section E","2013","69","8","i47","","10.1107/S1600536813018540","","","0.71073","MoKα","","0.0254","0.0246","","","0.0667","0.067","","","","","","1.17","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238316","6.1467","0.0003","6.3742","0.0004","10.7048","0.0006","75.919","0.004","81.603","0.003","71.134","0.003","383.92","0.04","296","","296","","","","","","","","","4","P -1","-P 1","2","","Magnesium chromate(VI) pentahydrate","","- Cr H10 Mg O9 -","- Cr H10 Mg O9 -","- Cr2 H20 Mg2 O18 -","2","1","BR2229","Weil, Matthias","Redetermination of MgCrO~4~·5H~2~O","Acta Crystallographica Section E","2013","69","8","i48","i49","10.1107/S1600536813018588","","","0.71073","MoKα","","0.0428","0.031","","","0.0645","0.0686","","","","","","1.018","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238317","9.2283","0.0007","14.0584","0.001","16.4457","0.0013","94.869","0.002","102.547","0.002","105.27","0.002","1986.1","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","14-Methoxy-4,6-dimethyl-9-phenyl-8,12-dioxa-4,6-diazatetracyclo[8.8.0.0^2,7^.0^13,18^]octadeca-2(7),13,15,17-tetraene-3,5,11-trione","","- C23 H20 N2 O6 -","- C23 H20 N2 O6 -","- C92 H80 N8 O24 -","4","2","BT6915","Jagadeesan, G.; Jayashree, S.; Kannan, D.; Bakthadoss, M.; Aravindhan, S.","14-Methoxy-4,6-dimethyl-9-phenyl-8,12-dioxa-4,6-diazatetracyclo[8.8.0.0^2,7^.0^13,18^]octadeca-2(7),13,15,17-tetraene-3,5,11-trione","Acta Crystallographica Section E","2013","69","8","o1199","o1200","10.1107/S1600536813017789","","","0.71073","MoKα","","0.0659","0.047","","","0.1299","0.141","","","","","","1.063","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238318","7.264","0.005","10.056","0.007","11.935","0.009","97.748","0.017","98.1","0.017","103.72","0.02","825.6","1","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","1-(2-Chlorophenyl)-3-(2-ethylhexanoyl)thiourea","","- C15 H21 Cl N2 O S -","- C15 H21 Cl N2 O S -","- C30 H42 Cl2 N4 O2 S2 -","2","1","BT6917","Santhakumari, R.; Selvanayagam, S.; Ramamurthi, K.; Radha, N.; Yamin, Bohari M.","1-(2-Chlorophenyl)-3-(2-ethylhexanoyl)thiourea","Acta Crystallographica Section E","2013","69","8","o1220","","10.1107/S160053681301828X","","","0.71073","MoKα","","0.1277","0.0759","","","0.191","0.2301","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238319","18.4336","0.0014","9.4516","0.0007","11.7077","0.0009","90","","90","","90","","2039.8","0.3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-Dichloroacetyl-<i>t</i>-3-isopropyl-<i>r</i>-2,<i>c</i>-6-diphenylpiperidin-4-one","","- C22 H23 Cl2 N O2 -","- C22 H23 Cl2 N O2 -","- C88 H92 Cl8 N4 O8 -","4","1","BT6918","Sugumar, P.; Kayalvizhi, R.; Mini, R.; Ponnuswamy, S.; Ponnuswamy, M. N.","1-Dichloroacetyl-<i>t</i>-3-isopropyl-<i>r</i>-2,<i>c</i>-6-diphenylpiperidin-4-one","Acta Crystallographica Section E","2013","69","8","o1348","","10.1107/S1600536813019582","","","0.71073","MoKα","","0.0551","0.0476","","","0.1294","0.1362","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238320","22.1681","0.0018","6.6134","0.0005","10.7358","0.0008","90","","108.277","0.003","90","","1494.5","0.2","296","2","296","2","","","","","","","","4","C 1 2 1","C 2y","5","","1,10,10-Trimethyl-5-phenyl-3-oxa-4-azatricyclo[5.2.1.0^2,6^]dec-4-en-2-ol","","- C17 H21 N O2 -","- C17 H21 N O2 -","- C68 H84 N4 O8 -","4","1","BT6921","Boualy, Brahim; Harrad, Mohamed Anouar; Oudahmane, Abdelghani; Benharref, Ahmed; Berraho, Moha","1,10,10-Trimethyl-5-phenyl-3-oxa-4-azatricyclo[5.2.1.0^2,6^]dec-4-en-2-ol","Acta Crystallographica Section E","2013","69","8","o1314","","10.1107/S160053681302000X","","","0.71073","MoKα","","0.0483","0.0422","","","0.0976","0.1059","","","","","","1.076","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238321","8.2951","0.0003","12.307","0.0004","10.734","0.0004","90","","97.207","0.003","90","","1087.15","0.07","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Bruceolline J","2-Hydroxy-3,3-dimethyl-2,3-dihydrocyclopenta[<i>b</i>]indol-1(4<i>H</i>)-one","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C52 H52 N4 O8 -","4","1","BT6922","Lopchuk, Justin M.; Gribble, Gordon W.; Millikan, Sean P.; Jasinski, Jerry P.","Bruceolline J: 2-hydroxy-3,3-dimethyl-2,3-dihydrocyclopenta[<i>b</i>]indol-1(4<i>H</i>)-one","Acta Crystallographica Section E","2013","69","8","o1351","o1352","10.1107/S1600536813020527","","","0.7107","MoKα","","0.066","0.0476","","","0.1195","0.1335","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238322","5.8796","0.0002","12.7822","0.0004","19.1496","0.0007","90","","90","","90","","1439.17","0.08","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1<i>S</i>,3<i>S</i>,8<i>R</i>,10<i>R</i>,11<i>R</i>)-3,7,7,10-Tetramethyltricyclo[6.4.0.0^1,3^]dodecan-11-ol","","- C16 H28 O -","- C16 H28 O -","- C64 H112 O4 -","4","1","BT6923","Benharref, Ahmed; El karroumi, Jamal; El Ammari, Lahcen; Saadi, Mohamed; Berraho, Moha","(1<i>S</i>,3<i>S</i>,8<i>R</i>,10<i>R</i>,11<i>R</i>)-3,7,7,10-Tetramethyltricyclo[6.4.0.0^1,3^]dodecan-11-ol","Acta Crystallographica Section E","2013","69","8","o1350","","10.1107/S1600536813020576","","","0.71073","MoKα","","0.0462","0.0382","","","0.0963","0.1019","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238323","24.27","0.005","6.193","0.005","23.578","0.005","90","","107.554","0.005","90","","3379","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-Amino-4-(1,3-benzoxazol-2-yl)-5-(cyclohexylamino)thiophene-2-carbonitrile","","- C18 H18 N4 O S -","- C18 H18 N4 O S -","- C144 H144 N32 O8 S8 -","8","1","BV2222","Youssef, Chiraz; Belhouchet, Mohamed; Ben Ammar, Hamed; Ben Salem, Ridha","3-Amino-4-(1,3-benzoxazol-2-yl)-5-(cyclohexylamino)thiophene-2-carbonitrile","Acta Crystallographica Section E","2013","69","8","o1339","","10.1107/S1600536813019880","","","0.71073","MoKα","","0.0799","0.0424","","","0.0944","0.1119","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238324","7.0281","0.0002","9.7903","0.0003","30.3813","0.0006","90","","94.168","0.002","90","","2084.92","0.1","119.8","0.6","119.8","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2'-{[2-(2-Chlorophenyl)-4-methylimidazolidine-1,3-diyl]bis(methylene)}diphenol","","- C24 H25 Cl N2 O2 -","- C24 H25 Cl N2 O2 -","- C96 H100 Cl4 N8 O8 -","4","1","BX2443","Rivera, Augusto; Cárdenas, Lorena; Ríos-Motta, Jaime; Kučeraková, Monika; Dušek, Michal","2,2'-{[2-(2-Chlorophenyl)-4-methylimidazolidine-1,3-diyl]bis(methylene)}diphenol","Acta Crystallographica Section E","2013","69","8","o1221","o1222","10.1107/S1600536813017923","","","0.71069","MoKα","","0.0661","0.0574","","","0.0781","0.0809","","","","","","2.66","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238325","10.9371","0.0005","10.4462","0.0005","13.5104","0.0007","90","","108.533","0.005","90","","1463.53","0.13","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2-Chloro-3-[(2-oxo-2<i>H</i>-chromen-6-yl)amino]naphthalene-1,4-dione","","- C19 H10 Cl N O4 -","- C19 H10 Cl N O4 -","- C76 H40 Cl4 N4 O16 -","4","1","BX2446","Sousa, Mikaelly O. B.; Silveira, Gleiciani Q.; Gomez, Javier A. G.","2-Chloro-3-[(2-oxo-2<i>H</i>-chromen-6-yl)amino]naphthalene-1,4-dione","Acta Crystallographica Section E","2013","69","8","o1317","","10.1107/S1600536813019922","","","0.71073","MoKα","","0.0571","0.0362","","","","0.065","","","","","","0.908","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238326","6.6296","0.0005","6.8074","0.0006","8.7962","0.0007","94.579","0.006","103.326","0.006","106.552","0.006","365.75","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[[tetraaquamagnesium]-<i>trans</i>-μ-[(piperazine-1,4-diium-1,4-diyl)bis(methylene)]diphosphonato] hemihydrate]","","- C6 H23 Mg N2 O10.5 P2 -","- C6 H23 Mg N2 O10.5 P2 -","- C6 H23 Mg N2 O10.5 P2 -","1","0.5","CQ2003","Schilling, Lars-Hendrik; Stock, Norbert","<i>catena</i>-Poly[[[tetraaquamagnesium]-<i>trans</i>-μ-[(piperazine-1,4-diium-1,4-diyl)bis(methylene)]diphosphonato] hemihydrate]","Acta Crystallographica Section E","2013","69","8","m452","m453","10.1107/S1600536813018722","","","0.71073","MoKα","","0.0351","0.0298","","","0.0779","0.0799","","","","","","1.005","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238327","11.8619","0.0004","11.8619","0.0004","9.8668","0.0004","90","","90","","120","","1202.31","0.08","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","Calcium hexakis(dihydrogenphosphito)stannate(IV), Ca[Sn(H~2~PO~2~)~6~], with some remarks on the so-called Ge~2~(H~2~PO~2~)~6~ structure type","","- Ca H12 O12 P6 Sn -","- Ca H12 O12 P6 Sn -","- Ca3 H36 O36 P18 Sn3 -","3","0.166667","CQ2005","Gieschen, Tobias; Reuter, Hans","Calcium hexakis(dihydrogenphosphito)stannate(IV), Ca[Sn(H~2~PO~2~)~6~], with some remarks on the so-called Ge~2~(H~2~PO~2~)~6~ structure type","Acta Crystallographica Section E","2013","69","8","i44","","10.1107/S1600536813018205","","","0.71073","MoKα","","0.0214","0.02","","","0.057","0.0575","","","","","","1.207","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238328","4.063","0.0007","9.0941","0.0015","13.23","0.002","90","","94.453","0.002","90","","487.36","0.14","105","2","105","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N,N'-bis(2-diazoacetyl)piperazine","1,4-Bis(2-diazoacetyl)piperazine","","- C8 H10 N6 O2 -","- C8 H10 N6 O2 -","- C16 H20 N12 O4 -","2","0.5","CV5412","Kaupang, Åsmund; Görbitz, Carl Henrik; Bonge-Hansen, Tore","1,4-Bis(2-diazoacetyl)piperazine","Acta Crystallographica Section E","2013","69","8","o1241","","10.1107/S1600536813018801","","","0.71073","MoKα","","0.0403","0.0335","","","0.0863","0.0902","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238329","10.5508","0.0016","28.371","0.004","10.5228","0.0014","90","","90","","90","","3149.9","0.8","200","2","200","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","Tenulin 0.25-hydrate","2-Hydroxy-2,2a,6,9a-tetramethyl-2a,4a,5,6,6a,9a,9b,9c-octahydro-2<i>H</i>- 1,4-dioxadicyclopent[<i>cd</i>,<i>f</i>]azulene-3,9-dione 0.25-hydrate","","- C17 H22.5 O5.25 -","- C17 H22.5 O5.25 -","- C136 H180 O42 -","8","2","CV5419","Knight, Kyle S.; Smith, Cole T.; Waddell, Thomas G.; Noll, Bruce","Tenulin 0.25-hydrate, a sesquiterpene lactone isolated from <i>Helenium amarum</i>","Acta Crystallographica Section E","2013","69","8","o1237","o1238","10.1107/S1600536813018369","","","0.71073","MoKα","","0.0604","0.0493","","","0.1158","0.1206","","","","","","1.259","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238330","7.4332","0.0007","9.1093","0.0008","20.1946","0.0019","90","","90","","90","","1367.4","0.2","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","<i>N</i>,<i>N</i>-Diethyl-4-[(<i>E</i>)-(pyridin-3-yl)diazenyl]aniline","","- C15 H18 N4 -","- C15 H18 N4 -","- C60 H72 N16 -","4","1","CV5422","Draguta, Sergiu; Leonova, Evgeniya; Fokina, Maria; Denisyuk, Igor; Timofeeva, Tatiana V.","<i>N</i>,<i>N</i>-Diethyl-4-[(<i>E</i>)-(pyridin-3-yl)diazenyl]aniline","Acta Crystallographica Section E","2013","69","8","o1280","","10.1107/S1600536813019545","","","0.71073","MoKα","","0.0477","0.0458","","","0.1109","0.1129","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238331","8.1719","0.0006","8.5341","0.0006","23.5868","0.0016","83.771","0.006","85.484","0.006","74.827","0.006","1576","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","2-{(4-Chlorophenyl)[2-(dimethylazaniumyl)ethoxy]methyl}pyridinium bis(2,4,6-trinitrophenolate)","","- C28 H25 Cl N8 O15 -","- C28 H25 Cl N8 O15 -","- C56 H50 Cl2 N16 O30 -","2","1","CV5423","Ramya, V.; Jasinski, Jerry P.; Shannon, James P.; Yathirajan, H. S.; Ravishankara, D. K.","Carbinoxaminium dipicrate","Acta Crystallographica Section E","2013","69","8","o1264","o1265","10.1107/S1600536813018886","","","1.54184","CuKα","","0.0609","0.05","","","0.1335","0.1446","","","","","","1.021","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238332","6.4565","0.0011","17.625","0.003","27.997","0.004","90","","90","","90","","3185.9","0.9","200","2","200.15","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Isotenulin","","","- C17 H22 O5 -","- C17 H22 O5 -","- C136 H176 O40 -","8","2","CV5424","Knight, Kyle S.; Smith, Cole T.; Waddell, Thomas G.","Isotenulin","Acta Crystallographica Section E","2013","69","8","o1290","","10.1107/S1600536813019703","","","0.71073","MoKα","","0.0528","0.0428","","","0.0958","0.1002","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238333","7.1147","0.0009","8.3841","0.0009","12.9217","0.0013","90","","105.266","0.005","90","","743.59","0.15","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","4-Fluoro-N-[3,4,5-trimethoxybenzylidene]aniline","4-Fluoro-<i>N</i>-[(<i>E</i>)-3,4,5-trimethoxybenzylidene]aniline","","- C16 H16 F N O3 -","- C16 H16 F N O3 -","- C32 H32 F2 N2 O6 -","2","1","DS2233","Balachandar, R. K.; Kalainathan, S.; Eappen, Shibu M.; Podder, Jiban","4-Fluoro-<i>N</i>-[(<i>E</i>)-3,4,5-trimethoxybenzylidene]aniline","Acta Crystallographica Section E","2013","69","8","o1234","","10.1107/S1600536813017741","","","0.71073","MoKα","","0.0613","0.0401","","","0.1126","0.1282","","","","","","0.996","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238334","24.1921","0.0009","14.6474","0.0006","17.4681","0.0007","90","","115.28","","90","","5597.1","0.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tris(2-formylphenolato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')samarium(III)","","- C33 H23 N2 O6 Sm -","- C33 H23 N2 O6 Sm -","- C264 H184 N16 O48 Sm8 -","8","1","FF2109","Zhong, Yun; Yang, Jinbing; Hu, Ling","Tris(2-formylphenolato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')samarium(III)","Acta Crystallographica Section E","2013","69","8","m430","","10.1107/S1600536813016139","","","0.71073","MoKα","","0.0207","0.0174","","","0.0459","0.0487","","","","","","1.09","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238335","12.5596","0.0004","7.587","0.0003","14.3433","0.0006","90","","94.66","0.002","90","","1362.25","0.09","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","phenylamino-3H-chromenedione","3-[1-(2-Hydroxyanilino)ethylidene]-3<i>H</i>-chromen-2,4-dione","","- C17 H13 N O4 -","- C17 H13 N O4 -","- C68 H52 N4 O16 -","4","1","FF2111","Brahmia, Ameni; Ben Ayed, Taicir; Ben Hassen, Rached","3-[1-(2-Hydroxyanilino)ethylidene]-3<i>H</i>-chromen-2,4-dione","Acta Crystallographica Section E","2013","69","8","o1296","","10.1107/S160053681301934X","","","0.71073","MoKα","","0.1466","0.0579","","","0.1434","0.1941","","","","","","0.908","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238336","8.8712","0.0004","8.8712","0.0004","6.0246","0.0003","90","","90","","120","","410.6","0.03","293","2","293","2","","","","","","","","3","P 63/m c m","-P 6c 2","193","","Pentazirconium copper tribismuth","","- Bi3 Cu Zr5 -","- Bi3 Cu Zr5 -","- Bi6 Cu2 Zr10 -","2","0.0833333","FF2112","Balinska, Agnieszka; Tarasiuk, Ivan; Pavlyuk, Volodymyr","Pentazirconium copper tribismuth","Acta Crystallographica Section E","2013","69","8","i51","","10.1107/S1600536813019235","","","0.71073","MoKα","","0.0236","0.0229","","","0.0412","0.0413","","","","","","0.868","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238337","25.8781","0.0016","9.782","0.0006","20.9904","0.0011","90","","121.292","0.0015","90","","4540.6","0.5","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(<i>E</i>)-2,2'-[3-(4-Chlorophenyl)prop-2-ene-1,1-diyl]bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one)","","- C25 H29 Cl O4 -","- C25 H29 Cl O4 -","- C200 H232 Cl8 O32 -","8","1","FF2113","Cha, Joo Hwan; Lee, Jae Kyun; Min, Sun-Joon; Cho, Yong Seo; Park, Junghwan","(<i>E</i>)-2,2'-[3-(4-Chlorophenyl)prop-2-ene-1,1-diyl]bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one)","Acta Crystallographica Section E","2013","69","8","o1347","","10.1107/S1600536813020357","","","0.71075","MoKα","","","0.0447","","","","0.1352","","","","","","1.075","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238338","10.0768","0.0007","12.0387","0.0008","7.7047","0.0006","90","","90","","90","","934.67","0.12","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","(<i>Z</i>)-Ethyl 2-cyano-3-(1<i>H</i>-imidazol-2-yl)acrylate","","- C9 H9 N3 O2 -","- C9 H9 N3 O2 -","- C36 H36 N12 O8 -","4","1","FJ2635","Kalkhambkar, Rajesh G.; Kumar, Mahesh; Gayathri, D.; Oh, Jeongsu; Jeong, Yeon Tae","(<i>Z</i>)-Ethyl 2-cyano-3-(1<i>H</i>-imidazol-2-yl)acrylate","Acta Crystallographica Section E","2013","69","8","o1223","","10.1107/S1600536813018278","","","0.71073","MoKα","","0.059","0.0486","","","0.1302","0.145","","","","","","0.827","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238339","9.5538","0.0005","11.2638","0.0005","13.4079","0.0006","98.739","0.002","93.733","0.003","98.627","0.002","1404.25","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","5-Chloro-3-ethylsulfinyl-2-(3-fluorophenyl)-1-benzofuran","","- C16 H12 Cl F O2 S -","- C16.0028 H12 Cl F O2 S -","- C64.0112 H48 Cl4 F4 O8 S4 -","4","2","FJ2636","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Chloro-3-ethylsulfinyl-2-(3-fluorophenyl)-1-benzofuran","Acta Crystallographica Section E","2013","69","8","o1210","","10.1107/S1600536813018151","","","0.71073","MoKα","","0.0526","0.0376","","","0.094","0.1021","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238340","7.54","0.003","8.415","0.003","12.722","0.004","98.933","0.019","105.001","0.019","93.53","0.018","765.8","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-(2-Bromophenylsulfinyl)-2,5,7-trimethyl-1-benzofuran","","- C17 H15 Br O2 S -","- C17 H15 Br O2 S -","- C34 H30 Br2 O4 S2 -","2","1","FJ2637","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","3-(2-Bromophenylsulfinyl)-2,5,7-trimethyl-1-benzofuran","Acta Crystallographica Section E","2013","69","8","o1299","","10.1107/S1600536813019867","","","0.71073","MoKα","","0.0395","0.0327","","","0.0809","0.0848","","","","","","1.12","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238341","21.371","0.003","13.474","0.002","13.436","0.002","90","","99.018","0.009","90","","3821.1","1","110","0.5","110","0.5","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tris(4-formylphenyl)phosphane oxide tetrahydrofuran hemisolvate","","- C23 H19 O4.5 P -","- C23 H19 O4.5 P -","- C184 H152 O36 P8 -","8","1","FJ2638","Kakoullis, Jr, James; Fronczek, Frank R.; Maverick, Andrew W.","Tris(4-formylphenyl)phosphane oxide tetrahydrofuran hemisolvate","Acta Crystallographica Section E","2013","69","8","o1362","o1363","10.1107/S1600536813020059","","","0.71073","MoKα","","0.061","0.042","","","0.106","0.116","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2238342","6.6799","0.0007","7.3713","0.0009","32.9075","0.0014","90","","90","","90","","1620.4","0.3","296","1","296","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2<i>S</i>,3<i>S</i>)-3-(3-Bromophenyl)-6,6-dimethyl-2-nitro-2,3,6,7-tetrahydrobenzofuran-4(5<i>H</i>)-one","","- C16 H16 Br N O4 -","- C16 H16 Br N O4 -","- C64 H64 Br4 N4 O16 -","4","1","FY2101","Wang, Yifeng; Yao, Minjie; Dong, Kun; Xu, Danqian","(2<i>S</i>,3<i>S</i>)-3-(3-Bromophenyl)-6,6-dimethyl-2-nitro-2,3,6,7-tetrahydrobenzofuran-4(5<i>H</i>)-one","Acta Crystallographica Section E","2013","69","8","o1270","","10.1107/S160053681301920X","","","0.71073","MoKα","","0.0949","0.0509","","","0.0888","0.1075","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238343","5.6882","0.0003","18.4086","0.0009","14.4668","0.001","90","","91.272","0.008","90","","1514.47","0.15","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","5-Bromoisatin-3-(4-phenyl)thiosemicarbazone","1-(5-Bromo-2-oxoindolin-3-ylidene)-4-phenylthiosemicarbazide","","- C15 H11 Br N4 O S -","- C15 H11 Br N4 O S -","- C60 H44 Br4 N16 O4 S4 -","4","1","FY2102","Bandeira, Katlen C. T.; Bresolin, Leandro; Näther, Christian; Jess, Inke; de Oliveira, Adriano Bof","1-(5-Bromo-2-oxoindolin-3-ylidene)-4-phenylthiosemicarbazide","Acta Crystallographica Section E","2013","69","8","o1337","o1338","10.1107/S1600536813020497","","","0.71073","MoKα","","0.0627","0.0457","","","0.0979","0.1053","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238344","8.967","0.003","15.367","0.005","15.96","0.002","69.21","0.017","75.653","0.016","76.52","0.03","1966.2","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5-(4-Chlorophenyl)-7-(4-methylphenyl)-4-(pyrrolidin-1-yl)-7<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidine","","- C23 H21 Cl N4 -","- C23 H21 Cl N4 -","- C92 H84 Cl4 N16 -","4","2","GG2114","Patel, Urmila H.; Modh, Rajesh D.; Shah, Dhaval A.","5-(4-Chlorophenyl)-7-(4-methylphenyl)-4-(pyrrolidin-1-yl)-7<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidine","Acta Crystallographica Section E","2013","69","8","o1286","o1287","10.1107/S1600536813019168","","","0.71073","MoKα","","0.1223","0.0418","","","0.0991","0.1249","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238345","9.1634","0.0018","17.57","0.003","10.717","0.004","90","","117.89","0.02","90","","1525","0.7","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-(Diphenylmethylidene)-2,3-dihydro-1<i>H</i>-inden-1-one","","- C22 H16 O -","- C22 H16 O -","- C88 H64 O4 -","4","1","GG2117","Zhang, Tao; Bandero, Vilmar; McCabe, Tom; Frankish, Neil; Sheridan, Helen","2-(Diphenylmethylidene)-2,3-dihydro-1<i>H</i>-inden-1-one","Acta Crystallographica Section E","2013","69","8","o1306","o1307","10.1107/S1600536813018990","","","0.71073","MoKα","","0.0734","0.0701","","","0.1437","0.1452","","","","","","1.254","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238346","7.5207","0.0008","13.8672","0.0015","21.816","0.002","90","","95.449","0.002","90","","2264.9","0.4","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3-{5-Bromo-2-[(triphenylphosphanylidene)amino]phenyl}-4,5-dihydro-1,2,3-oxadiazol-3-ylium-5-olate","","- C26 H19 Br N3 O2 P -","- C26 H19 Br N3 O2 P -","- C104 H76 Br4 N12 O8 P4 -","4","1","GG2120","Grossie, David; Harrison, Leanna; Turnbull, Kenneth","3-{5-Bromo-2-[(triphenylphosphanylidene)amino]phenyl}-4,5-dihydro-1,2,3-oxadiazol-3-ylium-5-olate","Acta Crystallographica Section E","2013","69","8","o1196","","10.1107/S1600536813017765","","","0.71073","MoKα","","0.037","0.029","","0.0736","0.0711","0.0736","","","","","","0.9188","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238347","10.102","0.002","13.925","0.003","14.764","0.002","90","","105.27","0.01","90","","2003.5","0.7","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{2-[2,2-Bis(4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl-\ κ<i>N</i>)propyl]pyridine}dichloridoiron(II)","","- C18 H25 Cl2 Fe N3 O2 -","- C18 H25 Cl2 Fe N3 O2 -","- C72 H100 Cl8 Fe4 N12 O8 -","4","1","GG2121","Roviello, Giuseppina; Tuzi, Angela; Capacchione, Carmine; Milione, Stefano; Ferone, Claudio","{2-[2,2-Bis(4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl-κ<i>N</i>)propyl]pyridine}dichloridoiron(II)","Acta Crystallographica Section E","2013","69","8","m433","m434","10.1107/S1600536813018047","","","0.71073","MoKα","","0.085","0.0406","","","0.0709","0.0826","","","","","","1.01","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238348","8.5907","0.0001","5.1716","0.0001","20.0375","0.0003","90","","94.23","0.001","90","","887.79","0.02","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-Quinolinesulfonamide","","","- C9 H8 N2 O2 S -","- C9 H8 N2 O2 S -","- C36 H32 N8 O8 S4 -","4","1","GK2577","Marciniec, Krzysztof; Maślankiewicz, Andrzej; Kusz, Joachim; Nowak, Maria","Quinoline-2-sulfonamide","Acta Crystallographica Section E","2013","69","8","o1357","o1358","10.1107/S160053681302062X","","","0.71073","MoKα","","0.0299","0.0296","","","0.0722","0.0724","","","","","","1.117","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238349","12.336","0.005","8.666","0.004","7.052","0.007","90","","104.19","0.05","90","","730.9","0.9","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Hydroxyisoquinoline-1,3(2<i>H</i>,4<i>H</i>)-dione","","- C9 H7 N O3 -","- C9 H7 N O3 -","- C36 H28 N4 O12 -","4","1","GK2583","Ishikawa, Yoshinobu; Matsuo, Soichiro","2-Hydroxyisoquinoline-1,3(2<i>H</i>,4<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","8","o1312","","10.1107/S1600536813019843","","","0.71069","MoKα","","","0.0322","","","","0.0886","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238350","14.902","0.005","11.314","0.005","12.479","0.005","90","","94.644","0.005","90","","2097.1","1.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>-Diethyl-4-[1-phenyl-3-(pyridin-2-yl)-4,5-dihydro-1<i>H</i>-pyrazol-5-yl]aniline","","- C24 H26 N4 -","- C24 H26 N4 -","- C96 H104 N16 -","4","1","GK2584","Zhu, Ying-Zhong; Wang, Hui; Sun, Ping-Ping; Tian, Yu-Peng","<i>N</i>,<i>N</i>-Diethyl-4-[1-phenyl-3-(pyridin-2-yl)-4,5-dihydro-1<i>H</i>-pyrazol-5-yl]aniline","Acta Crystallographica Section E","2013","69","8","o1316","","10.1107/S1600536813019879","","","0.71069","MoKα","","0.0986","0.0732","","","0.2137","0.2414","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238351","12.7906","0.0015","8.0149","0.001","16.644","0.002","90","","108.305","0.001","90","","1619.9","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[6-(3,5-Dimethylpyrazol-1-yl)-1,2,4,5-tetrazin-3-yl]guanidin-2-ium perchlorate methanol monosolvate","","- C9 H16 Cl N9 O5 -","- C9 H16 Cl N9 O5 -","- C36 H64 Cl4 N36 O20 -","4","1","GK2585","Hu, Yong-Peng; Yan, Biao; Li, Jie; Ma, Hai-Xia","1-[6-(3,5-Dimethylpyrazol-1-yl)-1,2,4,5-tetrazin-3-yl]guanidin-2-ium perchlorate methanol monosolvate","Acta Crystallographica Section E","2013","69","8","o1332","","10.1107/S1600536813020448","","","0.71073","MoKα","","0.0457","0.0382","","","0.1068","0.1125","","","","","","1.056","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238352","10.4777","0.0001","12.4283","0.0002","13.155","0.0002","90","","90","","90","","1713.04","0.04","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>N</i>-<i>tert</i>-Butoxycarbonyl-α-(2-fluorobenzyl)-<i>L</i>-proline","","- C17 H22 F N O4 -","- C17 H22 F N O4 -","- C68 H88 F4 N4 O16 -","4","1","GK2586","Rajalakshmi, P.; Srinivasan, N.; Krishnakumar, R. V.; Razak, Ibrahim Abdul; Rosli, Mohd Mustaqim","<i>N</i>-<i>tert</i>-Butoxycarbonyl-α-(2-fluorobenzyl)-<small>L</small>-proline","Acta Crystallographica Section E","2013","69","8","o1297","","10.1107/S1600536813019788","","","0.71073","MoKα","","0.0717","0.0502","","","0.1036","0.1138","","","","","","1.056","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238353","11.3956","0.0007","20.1346","0.0012","14.386","0.0008","90","","103.153","0.001","90","","3214.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1''-Allyl-5''-(4-methoxybenzylidene)-7'-(4-methoxyphenyl)-1',3',5',6',7',7a'-hexahydrodispiro[acenaphthylene-1,5'-pyrrolo[1,2-<i>c</i>][1,3]thiazole-6',3''-piperidine]-2,4''(1<i>H</i>)-dione","","- C39 H36 N2 O4 S -","- C39 H36 N2 O4 S -","- C156 H144 N8 O16 S4 -","4","1","GW2135","Almansour, Abulrahman I.; Suresh Kumar, Raju; Arumugam, Natarajan; Nagalakshmi, R. A.; Suresh, J.","1''-Allyl-5''-(4-methoxybenzylidene)-7'-(4-methoxyphenyl)-1',3',5',6',7',7a'-hexahydrodispiro[acenaphthylene-1,5'-pyrrolo[1,2-<i>c</i>][1,3]thiazole-6',3''-piperidine]-2,4''(1<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","8","o1345","o1346","10.1107/S1600536813020084","","","0.71073","MoKα","","0.048","0.037","","","0.0968","0.1039","","","","","","1.073","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238354","13.8159","0.0003","13.8159","0.0003","13.5221","0.0006","90","","90","","90","","2581.09","0.14","123","2","123","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","2-(10',10'-Dimethyl-3'-sulfanylidene-4'-azatricyclo[5.2.1.0^1,5^]decan-2'-yl)-10,10-dimethyl-4-azatricyclo[5.2.1.0^1,5^]decane-3-thione","","- C28 H40 N2 O2 S2 -","- C28 H40 N2 O2 S2 -","- C112 H160 N8 O8 S8 -","4","0.5","GW2136","Walker, Ashley; Forsyth, Craig M.; Perlmutter, Patrick","2-(10',10'-Dimethyl-3'-sulfanylidene-4'-azatricyclo[5.2.1.0^1,5^]decan-2'-yl)-10,10-dimethyl-4-azatricyclo[5.2.1.0^1,5^]decane-3-thione","Acta Crystallographica Section E","2013","69","8","o1282","","10.1107/S1600536813019211","","","0.71073","MoKα","","0.0528","0.0492","","","0.0981","0.0996","","","","","","1.193","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238355","11.124","0.0005","12.6825","0.0005","25.8778","0.0011","89.823","0.004","81.185","0.002","88.305","0.003","3606.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5''-(4-Nitrobenzylidene)-7'-(4-nitrophenyl)-1''-methyl-1',3',5',6',7',7a'-hexahydrodispiro[acenaphthylene-1,5'-pyrrolo[1,2-<i>c</i>][1,3]thiazole-6',3''-piperidine]-2,4''(1<i>H</i>)-dione including an unknown solvate","","- C35 H28 N4 O6 S -","- C35 H28 N4 O6 S -","- C140 H112 N16 O24 S4 -","4","2","HB7098","Vishnupriya, R.; Suresh, J.; Sivakumar, S.; Kumar, R. Ranjith.; Lakshman, P. L. Nilantha","5''-(4-Nitrobenzylidene)-7'-(4-nitrophenyl)-1''-methyl-1',3',5',6',7',7a'-hexahydrodispiro[acenaphthylene-1,5'-pyrrolo[1,2-<i>c</i>][1,3]thiazole-6',3''-piperidine]-2,4''(1<i>H</i>)-dione including an unknown solvate","Acta Crystallographica Section E","2013","69","8","o1208","o1209","10.1107/S1600536813017704","","","0.71073","MoKα","","0.0905","0.0499","","","0.1302","0.1429","","","","","","1.023","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238356","8.0273","0.0013","15.048","0.002","13.686","0.002","90","","101.546","0.003","90","","1619.7","0.4","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2,4-Dinitrophenyl)-2-[(<i>E</i>)-2,4,5-trimethoxybenzylidene]hydrazine","","- C16 H16 N4 O7 -","- C16 H16 N4 O7 -","- C64 H64 N16 O28 -","4","1","HB7102","Fun, Hoong-Kun; Chantrapromma, Suchada; Nilwanna, Boonlerd; Kobkeatthawin, Thawanrat; Boonnak, Nawong","1-(2,4-Dinitrophenyl)-2-[(<i>E</i>)-2,4,5-trimethoxybenzylidene]hydrazine","Acta Crystallographica Section E","2013","69","8","o1203","o1204","10.1107/S1600536813018345","","","0.71073","MoKα","","0.1277","0.0551","","","0.1117","0.1437","","","","","","1.007","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238357","9.8","0.001","8.468","0.001","28.637","0.002","90","","94.14","0.01","90","","2370.3","0.4","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Heptasodium trialuminium tetrakis(diarsenate)","","- Al3 As8 Na7 O28 -","- Al3 As8 Na7 O28 -","- Al12 As32 Na28 O112 -","4","0.5","HB7105","Fakhar Bourguiba, Noura; Driss, Ahmed","Na~7~Al~3~(As~2~O~7~)~4~","Acta Crystallographica Section E","2013","69","8","i53","","10.1107/S1600536813020151","","","0.71073","MoKα","","0.0496","0.0336","","","0.0791","0.0845","","","","","","1.1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238358","10.1474","0.0015","8.6979","0.0013","18.073","0.003","90","","90","","90","","1595.1","0.4","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Cyanoanilinium iodide","","- C7 H7 I N2 -","- C7 H7 I N2 -","- C56 H56 I8 N16 -","8","1","HB7106","Vumbaco, David J.; Kammer, Michael N.; Koplitz, Lynn V.; Mague, Joel T.","2-Cyanoanilinium iodide","Acta Crystallographica Section E","2013","69","8","o1288","","10.1107/S1600536813019314","","","0.71073","MoKα","","0.0168","0.0162","","","0.0402","0.0408","","","","","","1.1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238359","13.1605","0.0003","10.4876","0.0002","14.8786","0.0003","90","","106.354","0.002","90","","1970.49","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2<i>E</i>)-3-(6-Chloro-2-methoxyquinolin-3-yl)-1-(2,4-dimethylquinolin-3-yl)prop-2-en-1-one","","- C24 H19 Cl N2 O2 -","- C24 H19 Cl N2 O2 -","- C96 H76 Cl4 N8 O8 -","4","1","HB7107","Prasath, R.; Sarveswari, S.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-3-(6-Chloro-2-methoxyquinolin-3-yl)-1-(2,4-dimethylquinolin-3-yl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","8","o1274","","10.1107/S1600536813019399","","","1.54184","CuKα","","0.0492","0.0443","","","0.122","0.1265","","","","","","1.066","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238360","7.415","0.0005","9.9045","0.0006","14.0696","0.0009","71.072","0.005","88.427","0.005","72.552","0.005","929.66","0.11","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(2<i>E</i>)-3-(2-Chloro-8-methylquinolin-3-yl)-1-(2,4-dimethylquinolin-3-yl)prop-2-en-1-one","","- C24 H19 Cl N2 O -","- C24 H19 Cl N2 O -","- C48 H38 Cl2 N4 O2 -","2","1","HB7108","Prasath, R.; Sarveswari, S.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-3-(2-Chloro-8-methylquinolin-3-yl)-1-(2,4-dimethylquinolin-3-yl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","8","o1275","","10.1107/S1600536813019405","","","1.54184","CuKα","","0.0366","0.0348","","","0.0939","0.0953","","","","","","1.037","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238361","22.1215","0.0005","10.862","0.0002","11.3215","0.0002","90","","98.879","0.002","90","","2687.77","0.09","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Flunarizinium hydrogen maleate","4-[Bis(4-fluorophenyl)methyl]-1-[(2<i>E</i>)-3-phenylprop-2-en-1-yl]piperazin-1-ium hydrogen maleate","","- C30 H30 F2 N2 O4 -","- C30 H30 F2 N2 O4 -","- C120 H120 F8 N8 O16 -","4","1","HB7110","Kavitha, Channappa N.; Jasinski, Jerry P.; Matar, Somer M.; Yathirajan, H. S.; Ramesha, A. R.","Flunarizinium hydrogen maleate","Acta Crystallographica Section E","2013","69","8","o1344","","10.1107/S1600536813020291","","","1.5418","CuKα","","0.0556","0.0479","","","0.1288","0.136","","","","","","1.028","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238362","8.1717","0.001","8.3117","0.001","14.6841","0.0015","93.119","0.009","98.369","0.01","118.043","0.012","862.2","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-Butanoyl-<i>N</i>-(3-chloro-1,4-dioxonaphthalen-2-yl)butanamide","","- C18 H18 Cl N O4 -","- C18 H18 Cl N O4 -","- C36 H36 Cl2 N2 O8 -","2","1","HG5322","Butcher, Ray J.; Berhe, Solomon; Anderson, Alan J.; Bakare, Oladapo","<i>N</i>-Butanoyl-<i>N</i>-(3-chloro-1,4-dioxonaphthalen-2-yl)butanamide","Acta Crystallographica Section E","2013","69","8","o1230","","10.1107/S1600536813016401","","","1.54178","CuKα","","0.1143","0.0767","","","0.2003","0.2265","","","","","","1.117","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238363","9.1688","0.0004","10.08","0.0004","11.4141","0.0006","98.826","0.002","108.777","0.002","110.403","0.004","893.17","0.08","295","","295","","","","","","","","","4","P -1","-P 1","2","","2-[1'-(Benzyloxy)spiro[indane-1,2'-pyrrolidine]-5'-yl]acetonitrile","","- C21 H22 N2 O -","- C21 H22 N2 O -","- C42 H44 N4 O2 -","2","1","HG5325","Moreno-Fuquen, Rodolfo; Soto, Diana M.; Jaramillo-Gómez, Luz M.; Ellena, Javier; Tenorio, Juan C.","2-[1'-(Benzyloxy)spiro[indane-1,2'-pyrrolidine]-5'-yl]acetonitrile","Acta Crystallographica Section E","2013","69","8","o1192","o1193","10.1107/S1600536813017674","","","0.71073","MoKα","","0.0922","0.0593","","","0.1661","0.1912","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238364","7.5731","0.0005","10.1861","0.0005","10.3636","0.0006","94.945","0.004","96.581","0.005","110.974","0.005","734.56","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2-Chloro-<i>N</i>-(3-methoxybenzoyl)benzenesulfonamide","","- C14 H12 Cl N O4 S -","- C14 H12 Cl N O4 S -","- C28 H24 Cl2 N2 O8 S2 -","2","1","HG5328","Suchetan, P. A.; Palakshamurthy, B. S.; Mamatha, G. R.; Kumar, Vijith; Mohan, N. R.; Sreenivasa, S.","2-Chloro-<i>N</i>-(3-methoxybenzoyl)benzenesulfonamide","Acta Crystallographica Section E","2013","69","8","o1215","","10.1107/S1600536813018291","","","0.71073","MoKα","","0.0466","0.0366","","","0.0925","0.101","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238365","10.9881","0.0008","9.1468","0.0006","12.5575","0.0009","90","","109.4","0.008","90","","1190.44","0.16","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-[1-(2-Hydroxy-4-methoxyphenyl)ethylidene]-<i>N</i>-methylhydrazinecarbothioamide","","- C11 H15 N3 O2 S -","- C11 H15 N3 O2 S -","- C44 H60 N12 O8 S4 -","4","1","HG5331","Anderson, Brian J.; Freedman, Michael B.; Millikan, Sean P.; Jasinski, Jerry P.","2-[1-(2-Hydroxy-4-methoxyphenyl)ethylidene]-<i>N</i>-methylhydrazinecarbothioamide","Acta Crystallographica Section E","2013","69","8","o1315","","10.1107/S1600536813019831","","","0.7107","MoKα","","0.0899","0.0755","","","0.2205","0.2305","","","","","","1.156","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238366","7.1647","0.0008","15.5586","0.0019","11.3201","0.0013","90","","96.026","0.007","90","","1254.9","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Hydroxymethyl-1,3-dimethyl-1<i>H</i>-imidazol-3-ium triiodide","","- C6 H11 I3 N2 O -","- C6 H11 I3 N2 O -","- C24 H44 I12 N8 O4 -","4","1","HG5333","Said, Mohamed El Hadi; Bouraiou, Abdelmalek; Bouacida, Sofiane; Merazig, Hocine; Belfaitah, Ali; Chibani, Aissa","2-Hydroxymethyl-1,3-dimethyl-1<i>H</i>-imidazol-3-ium triiodide","Acta Crystallographica Section E","2013","69","8","o1340","o1341","10.1107/S1600536813020266","","","0.71073","MoKα","","0.0165","0.015","","","0.0336","0.034","","","","","","1.153","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238367","17.1714","0.0003","10.7099","0.0002","14.5248","0.0002","90","","100.021","0.002","90","","2630.42","0.08","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2<i>E</i>)-3-(6-Chloro-2-methoxyquinolin-3-yl)-1-(2-methyl-4-phenylquinolin-3-yl)prop-2-en-1-one acetone monosolvate","","- C32 H27 Cl N2 O3 -","- C32 H27 Cl N2 O3 -","- C128 H108 Cl4 N8 O12 -","4","1","HG5334","Prasath, R.; Sarveswari, S.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-3-(6-Chloro-2-methoxyquinolin-3-yl)-1-(2-methyl-4-phenylquinolin-3-yl)prop-2-en-1-one acetone monosolvate","Acta Crystallographica Section E","2013","69","8","o1319","","10.1107/S1600536813020217","","","1.54184","CuKα","","0.0675","0.0581","","","0.1558","0.1666","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238368","10.9837","0.0002","21.0604","0.0003","9.3927","0.0001","90","","90.009","0.001","90","","2172.73","0.06","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2<i>E</i>)-3-(2-Chloro-8-methylquinolin-3-yl)-1-(2-methyl-4-phenylquinolin-3-yl)prop-2-en-1-one","","- C29 H21 Cl N2 O -","- C29 H21 Cl N2 O -","- C116 H84 Cl4 N8 O4 -","4","1","HG5335","Prasath, R.; Sarveswari, S.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-3-(2-Chloro-8-methylquinolin-3-yl)-1-(2-methyl-4-phenylquinolin-3-yl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","8","o1318","","10.1107/S1600536813020229","","","1.54184","CuKα","","0.0388","0.0343","","","0.0887","0.0925","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238369","15.551","0.007","17.022","0.007","20.865","0.009","90","","90","","90","","5523","4","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(2,2'-Bipyridyl-κ^2^<i>N</i>,<i>N</i>')bis(η^5^-pentamethylcyclopentadienyl)barium","","- C30 H38 Ba N2 -","- C30 H38 Ba N2 -","- C240 H304 Ba8 N16 -","8","1","HP2057","Kazhdan, Daniel; Rozenel, Sergio S.","(2,2'-Bipyridyl-κ^2^<i>N</i>,<i>N</i>')bis(η^5^-pentamethylcyclopentadienyl)barium","Acta Crystallographica Section E","2013","69","8","m429","","10.1107/S1600536813017170","","","0.71073","MoKα","","0.0386","0.0275","","","0.065","0.0708","","","","","","1.067","","","","has coordinates,has Fobs","192353","2020-10-21","18:00:00",""
"2238370","7.4505","0.0013","12.793","0.002","17.745","0.003","78.664","0.002","86.558","0.002","80.344","0.002","1634.2","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Bis(1-ethyl-4,4'-bipyridin-1-ium) bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","","- C32 H26 N8 Ni S4 -","- C32 H26 N8 Ni S4 -","- C64 H52 N16 Ni2 S8 -","2","1","HY2630","Chen, Yao; Ning, Wei-hua; Liu, Jian-Lan","Bis(1-ethyl-4,4'-bipyridin-1-ium) bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","Acta Crystallographica Section E","2013","69","8","m428","","10.1107/S1600536813015493","","","0.71073","MoKα","","0.1348","0.051","","","0.0968","0.1279","","","","","","0.965","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238371","10.217","0.0003","11.119","0.0004","11.8243","0.0003","104.384","0.003","105.912","0.003","108.096","0.003","1143.23","0.08","180","2","180","2","","","","","","","","5","P -1","-P 1","2","(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)zinc (18-crown-6)","(5,10,15,20-Tetraphenylporphyrinato-κ^4^<i>N</i>)zinc‒18-crown-6 (1/1)","","- C56 H52 N4 O6 Zn -","- C56 H52 N4 O6 Zn -","- C56 H52 N4 O6 Zn -","1","0.5","HY2633","Denden, Zouhour; Bel Haj Hassen, Leila; Belkhiria, Mohamed Salah; Daran, Jean-Claude; Nasri, Habib","(5,10,15,20-Tetraphenylporphyrinato-κ^4^<i>N</i>)zinc‒18-crown-6 (1/1)","Acta Crystallographica Section E","2013","69","8","m444","m445","10.1107/S1600536813018126","","","0.71073","MoKα","","0.046","0.0388","","","0.1052","0.1079","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238372","12.6577","0.0007","12.6577","0.0007","16.8174","0.0018","90","","90","","120","","2333.5","0.3","296","2","296","2","","","","","","","","6","P 6/m c c","-P 6 2c","192","","Bis(1,3-dimethyl-1<i>H</i>-imidazolium) hexafluorosilicate methanol 0.33-solvate","","- C31 H58 F18 N12 O Si3 -","- C31 H58 F18 N12 O Si3 -","- C62 H116 F36 N24 O2 Si6 -","2","0.0833333","IM2435","Tian, Chong; Nie, Wanli; Borzov, Maxim V.","Bis(1,3-dimethyl-1<i>H</i>-imidazolium) hexafluorosilicate methanol 0.33-solvate","Acta Crystallographica Section E","2013","69","8","o1216","o1217","10.1107/S1600536813018230","","","0.71073","MoKα","","0.0505","0.0356","","","0.0922","0.0976","","","","","","1.096","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238373","20.0318","0.0004","10.2866","0.0002","9.5351","0.0002","90","","90","","90","","1964.79","0.07","100","1","100","1","","","","","","","","6","P c a 21","P 2c -2ac","29","","2,2-Diphenyl-<i>N</i>-{[2-(trifluoromethyl)phenyl]carbamothioyl}acetamide","","- C22 H17 F3 N2 O S -","- C22 H17 F3 N2 O S -","- C88 H68 F12 N8 O4 S4 -","4","1","IS5283","Yusof, Mohd Sukeri Mohd; Razali, Nur Rafikah; Arshad, Suhana; Rahman, Azhar Abdul; Razak, Ibrahim Abdul","2,2-Diphenyl-<i>N</i>-{[2-(trifluoromethyl)phenyl]carbamothioyl}acetamide","Acta Crystallographica Section E","2013","69","8","o1255","o1256","10.1107/S1600536813018680","","","0.71073","MoKα","","0.0597","0.0436","","","0.0739","0.0811","","","","","","1.024","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238374","15.888","0.004","12.689","0.003","17.143","0.005","90","","100.28","0.05","90","","3400.6","1.6","203","2","203","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Bis[2-(1,3-benzothiazol-2-yl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>][1,3-bis(4-bromophenyl)propane-1,3-dionato-κ^2^<i>O</i>,<i>O</i>']iridium(III)","","- C41 H25 Br2 Ir N2 O2 S2 -","- C41 H25 Br2 Ir N2 O2 S2 -","- C164 H100 Br8 Ir4 N8 O8 S8 -","4","0.5","IS5287","Kim, Young-Inn; Yun, Seong-Jae; Kang, Sung Kwon","Bis[2-(1,3-benzothiazol-2-yl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>][1,3-bis(4-bromophenyl)propane-1,3-dionato-κ^2^<i>O</i>,<i>O</i>']iridium(III)","Acta Crystallographica Section E","2013","69","8","m443","","10.1107/S1600536813018394","","","0.71073","MoKα","","0.0385","0.0303","","","","0.0761","","","","","","1.058","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238375","13.0887","0.0006","14.0869","0.0007","13.3521","0.0007","90","","113.524","0.002","90","","2257.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 3'-benzyl-4'-(2-chlorophenyl)-1'-methyl-2-oxospiro[indoline-3,2'-pyrrolidine]-3'-carboxylate","","- C27 H25 Cl N2 O3 -","- C27 H25 Cl N2 O3 -","- C108 H100 Cl4 N8 O12 -","4","1","IS5288","Anuradha, T.; Devaraj, A.; Seshadri, P. R.; Bakthadoss, M.","Methyl 3'-benzyl-4'-(2-chlorophenyl)-1'-methyl-2-oxospiro[indoline-3,2'-pyrrolidine]-3'-carboxylate","Acta Crystallographica Section E","2013","69","8","o1214","","10.1107/S1600536813018424","","","0.71073","MoKα","","0.068","0.0439","","","0.1078","0.1221","","","","","","0.981","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238376","6.3558","0.0004","21.2388","0.0014","10.9252","0.0009","90","","95.753","0.002","90","","1467.36","0.18","200","","200","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[μ-3,5-bis(pyridin-2-yl)pyrazolato]bis[(hexafluorophosphato)copper(II)]","","- C26 H18 Cu2 F12 N8 P2 -","- C26 H18 Cu2 F12 N8 P2 -","- C52 H36 Cu4 F24 N16 P4 -","2","0.5","IS5289","Mishima, Akio; Katsuta, Nagisa; Furusyou, Midori; Fuyuhiro, Akira; Kawata, Satoshi","Bis[μ-3,5-bis(pyridin-2-yl)pyrazolato]bis[(hexafluorophosphato)copper(II)]","Acta Crystallographica Section E","2013","69","8","m455","m456","10.1107/S1600536813018813","","","0.71075","MoKα","","","0.0271","","","","0.0739","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238377","3.9904","0.0011","15.689","0.004","24.58","0.007","90","","90","","90","","1538.8","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(E)-1-((2,4,6-tribromophenyl)diazenyl)naphthalen-2-ol.","(<i>E</i>)-1-[(2,4,6-Tribromophenyl)diazenyl]naphthalen-2-ol","","- C16 H9 Br3 N2 O -","- C16 H9 Br3 N2 O -","- C64 H36 Br12 N8 O4 -","4","1","IS5290","Chetioui, Souheyla; Boudraa, Issam; Bouacida, Sofiane; Bouchoul, Abdelkader; Bouaoud, Salah Eddine","(<i>E</i>)-1-[(2,4,6-Tribromophenyl)diazenyl]naphthalen-2-ol","Acta Crystallographica Section E","2013","69","8","o1250","","10.1107/S1600536813018977","","","0.71073","MoKα","","0.0568","0.0338","","","0.0609","0.0663","","","","","","0.962","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238378","13.3276","0.0009","11.6435","0.0007","11.9965","0.0009","90","","111.8","0.003","90","","1728.5","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-2-[(2-Formylphenoxy)methyl]-3-(4-isopropylphenyl)acrylonitrile","","- C20 H19 N O2 -","- C20 H19 N O2 -","- C80 H76 N4 O8 -","4","1","IS5291","Kanchanadevi, J.; Anbalagan, G.; Selvakumar, R.; Bakthadoss, M.; Gunasekaran, B.; Manivannan, V.","(<i>E</i>)-2-[(2-Formylphenoxy)methyl]-3-(4-isopropylphenyl)acrylonitrile","Acta Crystallographica Section E","2013","69","8","o1354","","10.1107/S1600536813020618","","","0.71073","MoKα","","0.0994","0.0559","","","0.1504","0.1789","","","","","","1.088","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238379","5.6616","0.0001","7.8407","0.0002","11.7631","0.0003","97.169","0.002","94.992","0.003","101.39","0.002","504.53","0.02","296","2","296","2","","","","","","","","5","P -1","-P 1","2","1-Benzoyl-4-thiobiuret","{[(Phenylformamido)carbonyl]amino}methanethioamide","","- C9 H9 N3 O2 S -","- C9 H9 N3 O2 S -","- C18 H18 N6 O4 S2 -","2","1","IS5292","Kang, Sung Kwon","1-Benzoyl-4-thiobiuret","Acta Crystallographica Section E","2013","69","8","o1327","","10.1107/S1600536813019983","","","0.71073","MoKα","","0.0711","0.0371","","","","0.0974","","","","","","0.873","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238380","15.3593","0.0006","3.8699","0.0002","23.4189","0.0009","90","","106.33","0.001","90","","1335.84","0.1","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-bromo-5-fluorobenzaldehyde","2-Bromo-5-fluorobenzaldehyde","","- C7 H4 Br F O -","- C7 H4 Br F O -","- C56 H32 Br8 F8 O8 -","8","2","JJ2171","Tureski, Robert E.; Tanski, Joseph M.","2-Bromo-5-fluorobenzaldehyde","Acta Crystallographica Section E","2013","69","8","o1246","","10.1107/S1600536813018783","","","0.71073","MoKα","","0.0343","0.0268","","","0.0647","0.0679","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238381","5.681","0.0003","16.036","0.002","16.2954","0.0018","68.94","0.012","88.914","0.006","88.486","0.007","1384.8","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","4-[4-(Heptyloxy)benzoyloxy]phenyl 2-oxo-7-trifluoromethyl-2<i>H</i>-chromene-3-carboxylate","","- C31 H27 F3 O7 -","- C31 H27 F3 O7 -","- C62 H54 F6 O14 -","2","1","KJ2229","Devarajegowda, H. C.; Palakshamurthy, B. S.; Harishkumar, H. N.; Suchetan, P. A.; Sreenivasa, S.","4-[4-(Heptyloxy)benzoyloxy]phenyl 2-oxo-7-trifluoromethyl-2<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section E","2013","69","8","o1355","o1356","10.1107/S1600536813020679","","","0.71073","MoKα","","0.1429","0.1044","","","0.2655","0.3162","","","","","","0.993","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238382","9.5775","0.0003","10.8224","0.0003","14.1445","0.0004","96.787","0.002","109.701","0.001","91.324","0.002","1367.5","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-Hydroxyanilinium <i>p</i>-toluenesulfonate","","- C13 H15 N O4 S -","- C13 H15 N O4 S -","- C52 H60 N4 O16 S4 -","4","2","KP2454","Bincy, Impichira Pykkat; Gopalakrishnan, Rengasamy","3-Hydroxyanilinium <i>p</i>-toluenesulfonate","Acta Crystallographica Section E","2013","69","8","o1277","","10.1107/S1600536813018692","","","0.71073","MoKα","","0.056","0.0402","","","0.11","0.1217","","","","","","1.028","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238383","7.2817","0.0015","6.9635","0.0014","15.186","0.003","90","","90","","90","","770","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Triaqua(pyrazole-4-carboxylato-κ<i>N</i>^1^)lithium","","- C4 H9 Li N2 O5 -","- C4 H9 Li N2 O5 -","- C16 H36 Li4 N8 O20 -","4","1","KP2455","Starosta, Wojciech; Leciejewicz, Janusz","Triaqua(pyrazole-4-carboxylato-κ<i>N</i>^1^)lithium","Acta Crystallographica Section E","2013","69","8","m438","","10.1107/S160053681301831X","","","0.71073","MoKα","","0.0615","0.0424","","","0.1088","0.119","","","","","","1.009","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238384","9.574","0.002","9.904","0.003","10.513","0.003","74.215","0.007","67.172","0.007","70.346","0.007","853.7","0.4","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","2-Diphenylphosphanyl-1-methyl-1<i>H</i>-benzimidazole","","- C20 H18 N2 P -","- C20 H18 N2 P -","- C40 H36 N4 P2 -","2","1","KP2457","Jenkins, Darkus E.; Assefa, Zerihun","2-Diphenylphosphanyl-1-methyl-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2013","69","8","o1364","","10.1107/S1600536813020588","","","0.71073","MoKα","","0.0481","0.0404","","","0.1111","0.1177","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238385","8.05","0.002","15.762","0.004","16.073","0.004","90","","102.852","0.008","90","","1988.3","0.9","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>trans</i>-Acetyldicarbonyl(η^5^-cyclopentadienyl)[tris(furan-2-yl)phosphane-κ<i>P</i>]molybdenum(II)","","- C21 H17 Mo O6 P -","- C21 H17 Mo O6 P -","- C84 H68 Mo4 O24 P4 -","4","1","KQ2007","Whited, Matthew T.; Bakker-Arkema, Julia G.; Greenwald, Julia E.; Morrill, Lucas A.; Janzen, Daron E.","<i>trans</i>-Acetyldicarbonyl(η^5^-cyclopentadienyl)[tris(furan-2-yl)phosphane-κ<i>P</i>]molybdenum(II)","Acta Crystallographica Section E","2013","69","8","m475","m476","10.1107/S160053681302059X","","","0.71075","MoKα","","","0.0347","","","","0.075","","","","","","1.059","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238386","13.211","0.001","13.211","0.001","19.555","0.003","90","","90","","120","","2955.7","0.6","291","2","291","2","","","","","","","","6","P 32","P 32","145","","7-Benzyl-3-methyl-6-phenylimidazo[2,1-<i>b</i>][1,3]thiazol-7-ium chloride 0.75-hydrate","","- C19 H18.5 Cl N2 O0.75 S -","- C19 H18.5 Cl N2 O0.75 S -","- C114 H111 Cl6 N12 O4.5 S6 -","6","2","LD2101","Guo-Li, Huang; Bo, Liu; Jun-Feng, Kou","7-Benzyl-3-methyl-6-phenylimidazo[2,1-<i>b</i>][1,3]thiazol-7-ium chloride 0.75-hydrate","Acta Crystallographica Section E","2013","69","8","o1247","o1248","10.1107/S1600536813018795","","","0.71073","MoKα","","0.076","0.0595","","","0.1194","0.1229","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238387","11.451","0.002","13.496","0.002","20.815","0.003","90","","96.206","0.009","90","","3198","0.9","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1'-(1,3-Diphenyl-1<i>H</i>-pyrazol-4-yl)-1''-(prop-2-en-1-yl)-2',3',5',6',7',7a'-hexahydro-1'<i>H</i>-dispiro[1-benzopyran-3,2'-pyrrolizine-3',3''-indoline]-2'',4-dione 0.75-hydrate","","- C40 H35.5 N4 O3.75 -","- C40 H35.5 N4 O3.75 -","- C160 H142 N16 O15 -","4","1","LD2105","Jagadeesan, G.; Kathirvelan, D.; Haribabu, J.; Reddy, B. S. R.; Sethusankar, K.","1'-(1,3-Diphenyl-1<i>H</i>-pyrazol-4-yl)-1''-(prop-2-en-1-yl)-2',3',5',6',7',7a'-hexahydro-1'<i>H</i>-dispiro[1-benzopyran-3,2'-pyrrolizine-3',3''-indoline]-2'',4-dione 0.75-hydrate","Acta Crystallographica Section E","2013","69","8","o1194","o1195","10.1107/S160053681301773X","","","0.71073","MoKα","","0.0868","0.0513","","","0.1298","0.1527","","","","","","1.024","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238388","8.224","0.0008","9.7901","0.0009","8.7753","0.0009","90","","90.106","0.001","90","","706.53","0.12","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(1,3-dimethyl-1<i>H</i>-imidazolium) hexafluorosilicate","","- C10 H18 F6 N4 Si -","- C10 H18 F6 N4 Si -","- C20 H36 F12 N8 Si2 -","2","0.5","LD2107","Tian, Chong; Nie, Wanli; Borzov, Maxim V.","Bis(1,3-dimethyl-1<i>H</i>-imidazolium) hexafluorosilicate: the second monoclinic polymorph","Acta Crystallographica Section E","2013","69","8","o1218","o1219","10.1107/S1600536813018242","","","0.71073","MoKα","","0.0309","0.0275","","","0.0788","0.0811","","","","","","1.094","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238389","26.572","0.016","12.194","0.005","11.213","0.006","90","","96.03","0.05","90","","3613","3","100","","100","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Ethyl (<i>Z</i>)-4'-(4-ethoxy-1-hydroxy-3,4-dioxobut-1-en-1-yl)-[1,1'-biphenyl]-3-carboxylate","","- C21 H20 O6 -","- C21 H20 O6 -","- C168 H160 O48 -","8","1","LD2109","Ishikawa, Yoshinobu; Ugai, Atsushi","Ethyl (<i>Z</i>)-4'-(4-ethoxy-1-hydroxy-3,4-dioxobut-1-en-1-yl)-[1,1'-biphenyl]-3-carboxylate","Acta Crystallographica Section E","2013","69","8","o1231","","10.1107/S1600536813018503","","","0.71069","MoKα","","","0.0402","","","","0.1036","","","","","","1.008","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238390","5.4633","0.0004","10.4173","0.0008","20.2426","0.0015","90","","97.308","0.001","90","","1142.71","0.15","125","2","125","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-Benzyl(1-phenylethylidene)amine","","- C15 H15 N -","- C15 H15 N -","- C60 H60 N4 -","4","1","LD2110","Majer, Sean H.; Tanski, Joseph M.","(<i>E</i>)-Benzyl(1-phenylethylidene)amine","Acta Crystallographica Section E","2013","69","8","o1289","","10.1107/S1600536813019636","","","0.71073","MoKα","","0.074","0.0469","","","0.1117","0.1268","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238391","7.8177","0.0002","16.6464","0.0003","8.7222","0.0002","90","","97.165","0.001","90","","1126.21","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,4,8,11-Tetraazoniacyclotetradecane tetrakis(hydrogensulfate)","","- C10 H32 N4 O16 S4 -","- C10 H32 N4 O16 S4 -","- C20 H64 N8 O32 S8 -","2","0.5","LH5619","Said, Salem; Mhadhbi, Noureddine; Hajlaoui, Fadhel; Bataille, Thierry; Naïli, Houcine","1,4,8,11-Tetraazoniacyclotetradecane tetrakis(hydrogensulfate)","Acta Crystallographica Section E","2013","69","8","o1278","","10.1107/S1600536813018953","","","0.71073","MoKα","","0.052","0.0423","","","0.1144","0.1226","","","","","","1.048","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238392","6.1457","0.0001","8.2466","0.0002","27.4454","0.0007","90","","90","","90","","1390.96","0.05","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1<i>R</i>,3<i>S</i>,8<i>R</i>,11<i>R</i>)-3,7,7,10-Tetramethyltricyclo[6.4.0.0^1,3^]dodec-9-en-11-ol","","- C16 H26 O -","- C16 H26 O -","- C64 H104 O4 -","4","1","LH5626","Abdoullah, Bimoussa; Aziz, Auhmani; Ait Itto, My Youssef; Daran, Jean-Claude; Abdelwahed, Auhmani","Absolute configuration of (1<i>R</i>,3<i>S</i>,8<i>R</i>,11<i>R</i>)-3,7,7,10-tetramethyltricyclo[6.4.0.0^1,3^]dodec-9-en-11-ol","Acta Crystallographica Section E","2013","69","8","o1308","o1309","10.1107/S1600536813018497","","","1.5418","CuKα","","0.0386","0.0367","","","0.0956","0.0978","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238393","8.8092","0.0003","9.8629","0.0004","10.9278","0.0004","105.633","0.004","99.971","0.003","104.961","0.003","852.75","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(<i>Z</i>)-3-methyl-4-[1-(4-methylanilino)propylidene]-1-phenyl-1<i>H</i>-pyrazol-5(4<i>H</i>)-one","","- C20 H21 N3 O -","- C20 H21 N3 O -","- C40 H42 N6 O2 -","2","1","LH5629","Sharma, Naresh; Vyas, Komal M.; Jadeja, R. N.; Kant, Rajni; Gupta, Vivek K.","(<i>Z</i>)-3-Methyl-4-[1-(4-methylanilino)propylidene]-1-phenyl-1<i>H</i>-pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2013","69","8","o1271","","10.1107/S1600536813019144","","","0.71073","MoKα","","0.1007","0.052","","","0.1072","0.1303","","","","","","1.01","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238394","25.777","0.003","8.6754","0.0004","16.7916","0.0017","90","","125.228","0.015","90","","3067.3","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis(pyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)zinc dimethylformamide hemisolvate","","- C13.5 H15.5 N2.5 O6.5 Zn -","- C13.5 H15.5 N2.5 O6.5 Zn -","- C108 H124 N20 O52 Zn8 -","8","1","LH5630","Croitor, Lilia; Chisca, Diana; Coropceanu, Eduard B.; Fonari, Marina S.","Diaquabis(pyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)zinc dimethylformamide hemisolvate","Acta Crystallographica Section E","2013","69","8","m454","","10.1107/S1600536813018941","","","0.71073","MoKα","","0.114","0.0616","","","0.0917","0.1143","","","","","","1","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238395","11.4189","0.0009","10.6877","0.0009","18.3778","0.0015","90","","106.022","0.001","90","","2155.7","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[5,10,15,20-Tetrakis(4-methoxyphenyl)porphyrinato]zinc dichloromethane disolvate","","- C50 H40 Cl4 N4 O4 Zn -","- C50 H40 Cl4 N4 O4 Zn -","- C100 H80 Cl8 N8 O8 Zn2 -","2","0.5","LH5631","McGill, Sean; Nesterov, Vladimir N.; Gould, Stephanie L.","[5,10,15,20-Tetrakis(4-methoxyphenyl)porphyrinato]zinc dichloromethane disolvate","Acta Crystallographica Section E","2013","69","8","m471","","10.1107/S1600536813019338","","","0.71073","MoKα","","0.0479","0.0389","","","0.1151","0.1211","","","","","","1.06","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238396","7.3818","0.0015","13.106","0.003","18.719","0.004","90","","95.25","0.03","90","","1803.4","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","<i>N</i>-Methyl-5-nitrosalicylhydrazide","2-Hydroxy-<i>N</i>'-methyl-5-nitrobenzohydrazide","","- C8 H9 N3 O4 -","- C8 H9 N3 O4 -","- C64 H72 N24 O32 -","8","2","LH5633","Yang, Ming; Jin, Chengzhi; Zhou, Xiaodong; Jin, Longfei","2-Hydroxy-<i>N</i>'-methyl-5-nitrobenzohydrazide","Acta Crystallographica Section E","2013","69","8","o1305","","10.1107/S1600536813019776","","","0.71073","MoKα","","0.0946","0.0583","","","0.1245","0.1419","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238397","4.0185","0.0002","14.6418","0.0008","18.8276","0.0011","90","","90","","90","","1107.78","0.1","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","5-Bromoisatin-3-thiosemicarbazone","1-(5-Bromo-2-oxoindolin-3-ylidene)thiosemicarbazone","","- C9 H7 Br N4 O S -","- C9 H7 Br N4 O S -","- C36 H28 Br4 N16 O4 S4 -","4","1","LR2109","Bandeira, Katlen C. T.; Bresolin, Leandro; Näther, Christian; Jess, Inke; Oliveira, Adriano B.","1-(5-Bromo-2-oxoindolin-3-ylidene)thiosemicarbazone","Acta Crystallographica Section E","2013","69","8","o1251","o1252","10.1107/S1600536813018564","","","0.71073","MoKα","","0.0491","0.0394","","","0.0861","0.091","","","","","","1.022","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238398","6.5881","0.0003","10.1576","0.0003","18.3884","0.0007","90","","92.81","0.003","90","","1229.06","0.08","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Azido-κ<i>N</i>){(<i>E</i>)-2-[1-(pyridin-2-yl)ethylideneamino]phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}copper(II)","","- C13 H11 Cu N5 O -","- C13 H11 Cu N5 O -","- C52 H44 Cu4 N20 O4 -","4","1","LR2111","Datta, Amitabha; Clegg, Jack K.; Huang, Jui-Hsien; Sheu, Shiann-Cherng","(Azido-κ<i>N</i>){(<i>E</i>)-2-[1-(pyridin-2-yl)ethylideneamino]phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}copper(II)","Acta Crystallographica Section E","2013","69","8","m468","","10.1107/S1600536813019570","","","1.54184","CuKα","","0.0341","0.0319","","","0.0895","0.0923","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238399","14.541","0.005","6.052","0.005","32.633","0.005","90","","101.871","0.005","90","","2810","3","150","2","150","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","1-[(<i>E</i>)-2-(2-Hydroxy-5-methylphenyl)diazen-2-ium-1-yl]naphthalen-2-olate","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C136 H112 N16 O16 -","8","2","LR2112","Chetioui, Souheyla; Boudraa, Issam; Bouacida, Sofiane; Bouchoul, Abdelkader; Bouaoud, Salah Eddine","1-[(<i>E</i>)-2-(2-Hydroxy-5-methylphenyl)diazen-2-ium-1-yl]naphthalen-2-olate","Acta Crystallographica Section E","2013","69","8","o1322","o1323","10.1107/S160053681302014X","","","0.71073","MoKα","","0.1454","0.0683","","","0.1649","0.2019","","","","","","1.048","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238400","9.253","0.002","13.179","0.003","13.36","0.003","90","","90","","90","","1629.2","0.6","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-[1-(1,3-Dimethyl-2,4,6-trioxohexahydropyrimidin-5-yl)-2-oxopropyl]-1,3-dimethylpyrimidine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trione","","- C15 H18 N4 O7 -","- C15 H18 N4 O7 -","- C60 H72 N16 O28 -","4","1","MW2109","Sweidan, Kamal; Steimann, Manfred","5-[1-(1,3-Dimethyl-2,4,6-trioxohexahydropyrimidin-5-yl)-2-oxopropyl]-1,3-dimethylpyrimidine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trione","Acta Crystallographica Section E","2013","69","8","o1334","","10.1107/S1600536813020138","","","0.71073","MoKα","","0.0949","0.0434","","","0.0831","0.0988","","","","","","1.069","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238401","10.0388","0.001","10.2425","0.0008","15.0692","0.0011","83.916","0.008","86.47","0.009","77.124","0.008","1500.8","0.2","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","4-(2-Hydroxyethoxy)phenol","","- C8 H10 O3 -","- C8 H10 O3 -","- C64 H80 O24 -","8","4","MW2112","Meister, Anne C.; Lang, Mathias; Nieger, Martin; Bräse, Stefan","4-(2-Hydroxyethoxy)phenol","Acta Crystallographica Section E","2013","69","8","o1303","o1304","10.1107/S1600536813019818","","","0.71073","MoKα","","0.1063","0.0507","","","0.093","0.1097","","","","","","1.02","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238402","20.0084","0.0008","7.189","0.0003","10.7804","0.0004","90","","101.478","0.002","90","","1519.65","0.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(4-Bromophenylsulfinyl)-2,5,6-trimethyl-1-benzofuran","","- C17 H15 Br O2 S -","- C17 H15 Br O2 S -","- C68 H60 Br4 O8 S4 -","4","1","NC2313","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","3-(4-Bromophenylsulfinyl)-2,5,6-trimethyl-1-benzofuran","Acta Crystallographica Section E","2013","69","8","o1205","","10.1107/S1600536813017753","","","0.71073","MoKα","","0.0589","0.0408","","","0.1033","0.1137","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238403","7.8885","0.0004","9.3783","0.0004","9.8039","0.0005","110.39","0.003","96.395","0.004","102.992","0.005","648","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","[EMIM]~2~P~2~Se~8~","Bis(1-ethyl-3-methylimidazolium) 3,6-diselanylidene-1,2,4,5-tetraselena-3,6-diphosphacyclohexane-3,6-diselenolate","","- C12 H22 N4 P2 Se8 -","- C12 H22 N4 P2 Se8 -","- C12 H22 N4 P2 Se8 -","1","0.5","NC2314","Cody, Jason A.; Alexander, Grant C. B.; Guillot-Deudon, Catherine","Bis(1-ethyl-3-methylimidazolium) 3,6-diselanylidene-1,2,4,5-tetraselena-3,6-diphosphacyclohexane-3,6-diselenolate","Acta Crystallographica Section E","2013","69","8","o1359","o1360","10.1107/S1600536813020308","","","0.71073","MoKα","","0.0574","0.0294","","","0.0566","0.0626","","","","","","1.024","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238404","4.9158","0.001","10.514","0.002","9.814","0.002","90","","93.716","0.003","90","","506.17","0.17","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","4-sulfomylanilinium perchlorate","4-Sulfomylanilinium perchlorate","","- C6 H9 Cl N2 O6 S -","- C6 H9 Cl N2 O6 S -","- C12 H18 Cl2 N4 O12 S2 -","2","1","NG5332","Anitha, R.; Athimoolam, S.; Gunasekaran, M.; Sridhar, B.","4-Sulfamoylanilinium perchlorate","Acta Crystallographica Section E","2013","69","8","o1236","","10.1107/S1600536813017972","","","0.71073","MoKα","","0.0216","0.0216","","","0.0611","0.0611","","","","","","1.075","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238405","12.1337","0.0003","12.2267","0.0003","16.4423","0.0004","90","","107.744","0.001","90","","2323.26","0.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-(4-chlorophenyl)-2-phenyl-3-(4-phenyl-1,2,3-selenadiazol-5-yl)propanoate","","- C25 H21 Cl N2 O2 Se -","- C25 H21 Cl N2 O2 Se -","- C100 H84 Cl4 N8 O8 Se4 -","4","1","NG5333","Sugumar, P.; Sankari, S.; Manisankar, P.; Thiruselvam, V.; Ponnuswamy, M. N.","Ethyl 3-(4-chlorophenyl)-2-phenyl-3-(4-phenyl-1,2,3-selenadiazol-5-yl)propanoate","Acta Crystallographica Section E","2013","69","8","o1239","","10.1107/S1600536813017790","","","0.71073","MoKα","","0.0694","0.0367","","","0.0936","0.1068","","","","","","1.017","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238406","27.459","0.002","5.558","0.0004","19.467","0.0015","90","","100.168","0.002","90","","2924.3","0.4","292","2","292","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{<i>N</i>-benzyl-<i>N</i>-[2-(thiophen-2-yl)ethyl]dithiocarbamato-κ^2^<i>S</i>,<i>S</i>'}lead(II)","","- C28 H28 N2 Pb S6 -","- C28 H28 N2 Pb S6 -","- C112 H112 N8 Pb4 S24 -","4","0.5","NG5336","Sathiyaraj, E.; Thirumaran, S.; Sridhar, B.; Selvanayagam, S.","Bis{<i>N</i>-benzyl-<i>N</i>-[2-(thiophen-2-yl)ethyl]dithiocarbamato-κ^2^<i>S</i>,<i>S</i>'}lead(II)","Acta Crystallographica Section E","2013","69","8","m457","","10.1107/S1600536813019259","","","0.71073","MoKα","","0.0304","0.0255","","","0.0712","0.0743","","","","","","1.007","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238407","8.0694","0.0008","8.0763","0.0008","11.4208","0.0011","90.185","0.006","96.28","0.006","111.701","0.006","686.63","0.12","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Chloro-2-(4-methylphenyl)-3-methylsulfinyl-1-benzofuran","","- C16 H13 Cl O2 S -","- C16 H13 Cl O2 S -","- C32 H26 Cl2 O4 S2 -","2","1","NK2211","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Chloro-2-(4-methylphenyl)-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2013","69","8","o1213","","10.1107/S1600536813018400","","","0.71073","MoKα","","0.0429","0.0381","","","0.1001","0.1033","","","","","","1.052","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238408","10.805","0.0005","11.647","0.0005","24.521","0.0008","90","","94.984","0.005","90","","3074.2","0.2","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')tetrakis(dimethyl sulfoxide-κ<i>O</i>)copper(II) bis(perchlorate)","","- C18 H32 Cl2 Cu N2 O12 S4 -","- C18 H32 Cl2 Cu N2 O12 S4 -","- C72 H128 Cl8 Cu4 N8 O48 S16 -","4","1","NR2046","Iskenderov, Turganbay","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')tetrakis(dimethyl sulfoxide-κ<i>O</i>)copper(II) bis(perchlorate)","Acta Crystallographica Section E","2013","69","8","m448","m449","10.1107/S1600536813018485","","","0.71073","MoKα","","0.1828","0.0745","","","0.1388","0.1596","","","","","","1.069","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238409","11.0069","0.0008","15.0344","0.0011","15.435","0.0011","80.075","0.001","77.527","0.001","83.077","0.001","2447.4","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Tetraethylammonium dicyanido(5,10,15,20-tetraphenylporphyrinato)ferrate(III) dichloromethane monosolvate","","- C55 H50 Cl2 Fe N7 -","- C54.994 H49.988 Cl1.988 Fe N7 -","- C109.988 H99.976 Cl3.976 Fe2 N14 -","2","1","PJ2003","Kassenova, Nazira; Hietsoi, Oleksandr; Yerkassov, Rakhmetulla; Shatruk, Michael","Tetraethylammonium dicyanido(5,10,15,20-tetraphenylporphyrinato)ferrate(III) dichloromethane monosolvate","Acta Crystallographica Section E","2013","69","8","m462","m463","10.1107/S1600536813019119","","","0.71073","MoKα","","0.0749","0.0504","","","0.1189","0.1288","","","","","","1.117","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238410","8.784","0.002","18.551","0.004","9.195","0.002","90","","90.7","0.03","90","","1498.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[ammonium [aquabis(μ-2,3,5,6-tetraoxo-4-nitropyridin-4-ido)argentate(I)]]","","- C10 H8 Ag N5 O13 -","- C10 H8 Ag N5 O13 -","- C40 H32 Ag4 N20 O52 -","4","1","PJ2004","Dinh Do, Nguyen; Kovalchukova, Olga; Stash, Adam; Strashnova, Svetlana","<i>catena</i>-Poly[ammonium [aquabis(μ-2,3,5,6-tetraoxo-4-nitropyridin-4-ido)argentate(I)]]","Acta Crystallographica Section E","2013","69","8","m477","m478","10.1107/S1600536813020631","","","0.71073","MoKα","","0.0629","0.0214","","","0.0618","0.0659","","","","","","1.087","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238411","7.2162","0.0008","7.3372","0.0008","25.9727","0.0013","90","","90","","90","","1375.2","0.2","296","1","296","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2<i>S</i>,3<i>R</i>)-3-(2-Bromophenyl)-2-nitro-2,3,6,7-tetrahydro-1-benzofuran-4(5<i>H</i>)-one","","- C14 H12 Br N O4 -","- C14 H12 Br N O4 -","- C56 H48 Br4 N4 O16 -","4","1","PK2489","Wang, Yifeng; Lou, Liuliu; Dong, Kun; Xu, Danqian","(2<i>S</i>,3<i>R</i>)-3-(2-Bromophenyl)-2-nitro-2,3,6,7-tetrahydro-1-benzofuran-4(5<i>H</i>)-one","Acta Crystallographica Section E","2013","69","8","o1197","","10.1107/S1600536813017698","","","0.71073","MoKα","","0.1106","0.0589","","","0.1093","0.1248","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238412","10.181","0.002","12.163","0.002","8.8624","0.0018","90","","100.17","0.03","90","","1080.2","0.4","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,3-Trimethylene-7,8-dihydropyrrolo[1,2-<i>a</i>]thieno[2,3-<i>d</i>] pyrimidin-4(6<i>H</i>)-one","15-Thia-2,7-diazatetracyclo[7.6.0.0^3,7^.0^10,14^]pentadeca-1(9),2,10(14)-trien-8-one","","- C12 H12 N2 O S -","- C12 H12 N2 O S -","- C48 H48 N8 O4 S4 -","4","1","PK2490","Bozorov, Khurshed; Elmuradov, Burkhon; Shakhidoyatov, Khusnutdin; Aisa, Haji Akber; Tashkhodjaev, Bakhodir","2,3-Trimethylene-7,8-dihydropyrrolo[1,2-<i>a</i>]thieno[2,3-<i>d</i>]pyrimidin-4(6<i>H</i>)-one","Acta Crystallographica Section E","2013","69","8","o1224","","10.1107/S1600536813017935","","","1.54184","CuKα","","0.0492","0.0415","","","0.1178","0.1243","","","","","","1.062","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238413","10.7837","0.0004","11.7075","0.0004","12.0586","0.0004","114.352","0.003","96.245","0.002","109.53","0.005","1252.07","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","[(4<i>E</i>)-1-Methyl-2,6-diphenyl-3-(propan-2-yl)piperidin-4-ylidene]amino 3-methylbenzoate","","- C29 H32 N2 O2 -","- C29 H32 N2 O2 -","- C58 H64 N4 O4 -","2","1","PV2632","Vinuchakkaravarthy, T.; Sivakumar, R.; Srinivasan, T.; Thanikachalam, V.; Velmurugan, D.","[(4<i>E</i>)-1-Methyl-2,6-diphenyl-3-(propan-2-yl)piperidin-4-ylidene]amino 3-methylbenzoate","Acta Crystallographica Section E","2013","69","8","o1276","","10.1107/S160053681301893X","","","0.71073","MoKα","","0.0632","0.0468","","","0.1302","0.144","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238414","7.702","0.002","7.057","0.003","21.55","0.004","90","","109.044","0.019","90","","1107.2","0.6","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>'-(2,4-Dinitrophenyl)acetohydrazide monohydrate","","- C8 H10 N4 O6 -","- C8 H10 N4 O6 -","- C32 H40 N16 O24 -","4","1","PV2637","Essid, Manel; Marouani, Houda; Al-Deyab, Salem S.; Rzaigui, Mohamed","<i>N</i>'-(2,4-Dinitrophenyl)acetohydrazide monohydrate","Acta Crystallographica Section E","2013","69","8","o1249","","10.1107/S1600536813018916","","","0.56083","AgKα","","0.2385","0.0712","","","0.1402","0.1947","","","","","","0.978","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238415","23.093","0.004","23.093","0.004","6.603","0.003","90","","90","","120","","3049.5","1.6","293","","293","","","","","","","","","4","R -3 :H","-R 3","148","","","","- C4 H6 N4 O4 -","- C4 H6 N4 O4 -","- C72 H108 N72 O72 -","18","1","PV2640","Essid, Manel; Marouani, Houda; Al-Deyab, Salem S.; Rzaigui, Mohamed","5-Amino-1<i>H</i>-1,2,4-triazol-4-ium hydrogen oxalate","Acta Crystallographica Section E","2013","69","8","o1279","","10.1107/S1600536813019363","","","0.5608","AgKα","","0.1223","0.0604","","","0.1608","0.194","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238416","14.078","0.005","20.416","0.005","20.789","0.005","90","","90","","90","","5975","3","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1-Ethyl-4'-(1<i>H</i>-indol-3-ylcarbonyl)-1'-methyl-2,2''-dioxodispiro[indoline-3,2'-pyrrolidine-3',3''-indoline]-4'-carbonitrile dimethyl sulfoxide monosolvate","","- C33 H31 N5 O4 S -","- C33 H31 N5 O4 S -","- C264 H248 N40 O32 S8 -","8","1","RK2408","Inglebert, S. Antony; Arun, Yuvaraj; Sethusankar, K.; Perumal, Paramasivam T.","1-Ethyl-4'-(1<i>H</i>-indol-3-ylcarbonyl)-1'-methyl-2,2''-dioxodispiro[indoline-3,2'-pyrrolidine-3',3''-indoline]-4'-carbonitrile dimethyl sulfoxide monosolvate","Acta Crystallographica Section E","2013","69","8","o1328","o1329","10.1107/S1600536813020485","","","0.71073","MoKα","","0.0733","0.0415","","","0.0971","0.1195","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238417","11.312","0.005","28.284","0.008","9.294","0.004","90","","90","","90","","2974","2","100","","100","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-[(<i>E</i>)-(Benzyliminiumyl)methyl]-6,8-dichloro-2<i>H</i>-chromen-4-olate","","- C17 H13 Cl2 N O2 -","- C17 H13 Cl2 N O2 -","- C136 H104 Cl16 N8 O16 -","8","1","RN2117","Ishikawa, Yoshinobu; Motohashi, Yuya","3-[(<i>E</i>)-(Benzyliminiumyl)methyl]-6,8-dichloro-2<i>H</i>-chromen-4-olate","Acta Crystallographica Section E","2013","69","8","o1225","","10.1107/S1600536813018072","","","0.71069","MoKα","","","0.034","","","","0.0946","","","","","","1.011","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238418","8.0052","0.0002","17.3439","0.0005","12.4588","0.0003","90","","114.789","0.001","90","","1570.41","0.07","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3-(4-Aminophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","3-(4-Aminophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","","- C17 H18 N4 O S -","- C17 H18 N4 O S -","- C68 H72 N16 O4 S4 -","4","1","RZ5075","Suwunwong, Thitipone; Chantrapromma, Suchada; Chidan Kumar, C. S.; Fun, Hoong-Kun","3-(4-Aminophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","Acta Crystallographica Section E","2013","69","8","o1227","o1228","10.1107/S1600536813018096","","","0.71073","MoKα","","0.0418","0.0364","","","0.0983","0.1036","","","","","","1.048","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238419","12.2451","0.0005","16.5509","0.0006","15.8934","0.0006","90","","90","","90","","3221.1","0.2","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","<i>catena</i>-Poly[heptylenediammonium [[tetrachloridobismuthate(III)]-μ-chlorido]]","","- C7 H20 Bi Cl5 N2 -","- C7 H20 Bi Cl5 N2 -","- C56 H160 Bi8 Cl40 N16 -","8","1","RZ5076","Ouasri, Ali; Rhandour, Ali; Saadi, Mohamed; El Ammari, Lahcen","<i>catena</i>-Poly[heptylenediammonium [[tetrachloridobismuthate(III)]-μ-chlorido]]","Acta Crystallographica Section E","2013","69","8","m437","","10.1107/S1600536813018102","","","0.71073","MoKα","","0.0334","0.0207","","","0.0455","0.0507","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238420","7.2573","0.0011","10.1538","0.0015","13.665","0.002","94.467","0.003","99.12","0.004","95.85","0.004","984.5","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","3,4-Dimethylthieno[2,3-<i>b</i>]thiophene-2,5-dicarbonitrile","","- C10 H6 N2 S2 -","- C10 H6 N2 S2 -","- C40 H24 N8 S8 -","4","2","RZ5077","Mabkhot, Yahia Nasser; Al-Showiman, S. S.; Barakat, Assem; Choudhary, M. Iqbal; Yousuf, Sammer","3,4-Dimethylthieno[2,3-<i>b</i>]thiophene-2,5-dicarbonitrile","Acta Crystallographica Section E","2013","69","8","o1272","","10.1107/S1600536813017960","","","0.71073","MoKα","","0.0987","0.0554","","","0.1122","0.1315","","","","","","0.985","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238421","12.0127","0.0003","19.4679","0.0005","15.2083","0.0004","90","","106.045","0.001","90","","3418.09","0.15","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>N</i>'-Phenyl-<i>N</i>'-[3-(2,4,5-triphenyl-2,5-dihydro-1<i>H</i>-pyrazol-3-yl)quinoxalin-2-yl]benzohydrazide","","- C42 H32 N6 O -","- C42 H32 N6 O -","- C168 H128 N24 O4 -","4","1","RZ5080","Ramli, Youssef; Karrouchi, Khalid; Essassi, El Mokhtar; El Ammari, Lahcen","<i>N</i>'-Phenyl-<i>N</i>'-[3-(2,4,5-triphenyl-2,5-dihydro-1<i>H</i>-pyrazol-3-yl)quinoxalin-2-yl]benzohydrazide","Acta Crystallographica Section E","2013","69","8","o1320","o1321","10.1107/S1600536813020035","","","0.71073","MoKα","","0.0984","0.0466","","","0.098","0.1173","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238422","15.19","0.001","11.3138","0.0009","6.72","0.0005","90","","100.627","0.007","90","","1135.07","0.15","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Poly[μ-aqua-μ-(<i>N</i>,4-dichloro-2-methylbenzenesulfonamidato)-potassium]","","- C7 H8 Cl2 K N O3 S -","- C7 H8 Cl2 K N O3 S -","- C28 H32 Cl8 K4 N4 O12 S4 -","4","1","SJ5326","Spandana, H. S.; Foro, Sabine; Gowda, B. Thimme","Poly[μ-aqua-μ-(<i>N</i>,4-dichloro-2-methylbenzenesulfonamidato)-potassium]","Acta Crystallographica Section E","2013","69","8","m426","","10.1107/S1600536813015845","","","0.71073","MoKα","","0.0836","0.0759","","","0.1894","0.1933","","","","","","1.281","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238423","8.46436","0.00018","9.38481","0.00019","11.4373","0.0003","101.038","0.0018","104.955","0.0019","96.3847","0.0017","849.08","0.04","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Dichloridobis[3-(4-chlorophenyl)-2,<i>N</i>,<i>N</i>-trimethyl-2,3-dihydro-1,2,4-oxadiazole-5-amine-κ<i>N</i>^4^]platinum(II)‒4-chlorobenzaldehyde (1/1)","","- C29 H35 Cl5 N6 O3 Pt -","- C29 H35 Cl5 N6 O3 Pt -","- C29 H35 Cl5 N6 O3 Pt -","1","0.5","SJ5329","Kritchenkov, Andreii S.; Gurzhiy, Vladislav V.; Bokach, Nadezhda A.; Kalibabchuk, Valentina A.","Dichloridobis[3-(4-chlorophenyl)-2,<i>N</i>,<i>N</i>-trimethyl-2,3-dihydro-1,2,4-oxadiazole-5-amine-κ<i>N</i>^4^]platinum(II)‒4-chlorobenzaldehyde (1/1)","Acta Crystallographica Section E","2013","69","8","m446","m447","10.1107/S1600536813017376","","","0.71073","MoKα","","0.0224","0.0223","","","0.0534","0.0535","","","","","","1.062","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238424","9.8733","0.0003","10.771","0.0004","14.1044","0.0005","90","","97.943","0.002","90","","1485.55","0.09","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","<i>N</i>,<i>N</i>-diethyl-2-(naphthalen-1-yloxy)propanamide","","- C17 H21 N O2 -","- C17 H21 N O2 -","- C68 H84 N4 O8 -","4","2","SJ5338","Cho, Seonghwa; Kim, Jineun; Jeon, Youngeun; Kim, Tae Ho","Napropamide","Acta Crystallographica Section E","2013","69","8","o1207","","10.1107/S1600536813017947","","","0.71073","MoKα","","0.0477","0.0365","","","0.0777","0.083","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238425","16.8974","0.0008","9.4893","0.0005","12.5287","0.0006","90","","92.928","0.004","90","","2006.29","0.17","119.8","0.4","119.8","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[(4-Methyl-2-phenylimidazolidine-1,3-diyl)bis(methylene)]diphenol","","- C24 H26 N2 O2 -","- C24 H26 N2 O2 -","- C96 H104 N8 O8 -","4","1","SJ5339","Rivera, Augusto; Cárdenas, Lorena; Ríos-Motta, Jaime; Eigner, Václav; Dušek, Michal","2,2'-[(4-Methyl-2-phenylimidazolidine-1,3-diyl)bis(methylene)]diphenol","Acta Crystallographica Section E","2013","69","8","o1198","","10.1107/S1600536813017893","","","1.5418","CuKα","","0.0558","0.0416","","","0.1044","0.1126","","","","","","1.51","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238426","26.713","0.005","7.3717","0.0004","19.636","0.003","90","","131.21","0.03","90","","2908.9","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>N</i>-(3-Methoxybenzoyl)-2-methylbenzenesulfonamide","","- C15 H15 N O4 S -","- C15 H15 N O4 S -","- C120 H120 N8 O32 S8 -","8","1","SJ5340","Sreenivasa, S.; Darshan, D.; Prakash Shet, M.; Mohan, N. R.; Kumar, Vijith; Suchetan, P. A.","<i>N</i>-(3-Methoxybenzoyl)-2-methylbenzenesulfonamide","Acta Crystallographica Section E","2013","69","8","o1232","","10.1107/S1600536813018539","","","0.71073","MoKα","","0.0598","0.0446","","","0.104","0.1184","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238427","10.162","0.003","13.831","0.005","16.35","0.004","90","","90","","90","","2298","1.2","295","2","295","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Tetrakis(pyridine-κ<i>N</i>)bis(tetrafluoridoborato-κ<i>F</i>)copper(II)","","- C20 H20 B2 Cu F8 N4 -","- C20 H20 B2 Cu F8 N4 -","- C80 H80 B8 Cu4 F32 N16 -","4","1","SJ5342","De Silva, Nirosha; Pannu, Ajay Pal Singh; Plieger, Paul G.","Tetrakis(pyridine-κ<i>N</i>)bis(tetrafluoridoborato-κ<i>F</i>)copper(II)","Acta Crystallographica Section E","2013","69","8","m450","m451","10.1107/S1600536813018643","","","1.54178","CuKα","","0.0727","0.0493","","","","0.1165","","","","","","1.009","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238428","23.4627","0.0008","23.4627","0.0008","11.3722","0.0004","90","","90","","120","","5421.6","0.3","173","2","173","2","","","","","","","","4","R -3","-R 3","148","","2-[(2-Chlorophenyl)(hydroxy)methyl]phenol","","- C13 H11 Cl O2 -","- C13 H11 Cl O2 -","- C234 H198 Cl18 O36 -","18","","SJ5343","Prakasha, G.; Jasinski, Jerry P.; Brown, Jared S.; Yathirajan, H. S.; Ravishankara, D. K.","2-[(2-Chlorophenyl)(hydroxy)methyl]phenol","Acta Crystallographica Section E","2013","69","8","o1240","","10.1107/S1600536813018667","","","1.5418","CuKα","","0.0715","0.065","","","0.2032","0.2129","","","","","","1.065","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238429","14.3222","0.0009","8.4083","0.0005","16.0102","0.001","90","","113.507","0.001","90","","1768.03","0.19","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Methanol-κ<i>O</i>)-<i>cis</i>-dioxido{(4<i>Z</i>,<i>N</i>'<i>E</i>)-<i>N</i>'-[(<i>Z</i>)-4-oxido-4-phenylbut-3-en-2-ylidene]isonicotinohydrazidato}molybdenum(VI)","","- C17 H17 Mo N3 O5 -","- C17 H17 Mo N3 O5 -","- C68 H68 Mo4 N12 O20 -","4","1","SJ5344","Kurapati, Sathish Kumar","(Methanol-κ<i>O</i>)-<i>cis</i>-dioxido{(4<i>Z</i>,<i>N</i>'<i>E</i>)-<i>N</i>'-[(<i>Z</i>)-4-oxido-4-phenylbut-3-en-2-ylidene]isonicotinohydrazidato}molybdenum(VI)","Acta Crystallographica Section E","2013","69","8","m460","m461","10.1107/S1600536813019077","","","0.71073","MoKα","","0.0273","0.0257","","","0.0685","0.0698","","","","","","1.072","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238430","24.2482","0.001","9.8145","0.0003","35.1675","0.0015","90","","102.45","0.004","90","","8172.5","0.6","119.8","","119.8","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,2'-{[2-(2-Hydroxyphenyl)-4-methylimidazolidine-1,3-diyl]bis(methylene)}diphenol","","- C24 H26 N2 O3 -","- C24 H26 N2 O3 -","- C384 H416 N32 O48 -","16","2","SJ5345","Rivera, Augusto; Cárdenas, Lorena; Ríos-Motta, Jaime; Kučeráková, Monika; Dušek, Michal","2,2'-{[2-(2-Hydroxyphenyl)-4-methylimidazolidine-1,3-diyl]bis(methylene)}diphenol","Acta Crystallographica Section E","2013","69","8","o1295","o1296","10.1107/S1600536813019417","","","1.5418","CuKα","","0.0566","0.0395","","","0.0445","0.0475","","","","","","1.68","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238431","22.7875","0.0012","23.6254","0.0012","8.5593","0.0005","90","","90","","90","","4608","0.4","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Diammonium tetrakis(isothiocyanato)zincate‒1,4,10,13,16-hexaoxacyclooctadecane‒water (1/2/1)","","- C28 H58 N6 O13 S4 Zn -","- C28 H58 N6 O13 S4 Zn -","- C112 H232 N24 O52 S16 Zn4 -","4","0.5","SU2617","Showrilu, K.; Rajarajan, K.; NizamMohideen, M.","Diammonium tetrakis(isothiocyanato)zincate‒1,4,10,13,16-hexaoxacyclooctadecane‒water (1/2/1)","Acta Crystallographica Section E","2013","69","8","m469","m470","10.1107/S1600536813019739","","","0.71073","MoKα","","0.119","0.0518","","","0.1348","0.1749","","","","","","1.004","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238432","6.9461","0.0006","15.5688","0.0011","16.5572","0.0011","90","","90","","90","","1790.5","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Allyl 2-(2,2-dimethyl-3a,6a-dihydrofuro[3,2-<i>d</i>][1,3]dioxol-5-yl)-4-oxo-4<i>H</i>-chromene-3-carboxylate","","- C20 H18 O7 -","- C20 H18 O7 -","- C80 H72 O28 -","4","1","SU2620","Fatima, Zeenat; Srinivasan, Thothadri; Rao, Jonnalagadda Naga Siva; Raghunathan, Raghavachary; Velmurugan, Devadasan","Allyl 2-(2,2-dimethyl-3a,6a-dihydrofuro[3,2-<i>d</i>][1,3]dioxol-5-yl)-4-oxo-4<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section E","2013","69","8","o1257","o1258","10.1107/S1600536813018904","","","0.71073","MoKα","","0.0867","0.0449","","","0.1066","0.1272","","","","","","1.008","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238433","6.8875","0.0003","15.4958","0.0006","15.9035","0.0006","90","","90","","90","","1697.34","0.12","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Methyl 2-(2,2-dimethyl-3a,6a-dihydrofuro[3,2-<i>d</i>][1,3]dioxol-5-yl)-4-oxo-4<i>H</i>-chromene-3-carboxylate","","- C18 H16 O7 -","- C18 H16 O7 -","- C72 H64 O28 -","4","1","SU2622","Fatima, Zeenat; Srinivasan, Thothadri; Rao, Jonnalagadda Naga Siva; Raghunathan, Raghavachary; Velmurugan, Devadasan","Methyl 2-(2,2-dimethyl-3a,6a-dihydrofuro[3,2-<i>d</i>][1,3]dioxol-5-yl)-4-oxo-4<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section E","2013","69","8","o1310","","10.1107/S1600536813019648","","","0.71073","MoKα","","0.0627","0.0412","","","0.0976","0.1083","","","","","","1.034","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238434","11.6697","0.0011","6.025","0.0006","18.6441","0.0018","90","","94.346","0.001","90","","1307.1","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(1,3-Benzothiazol-2-yl)iminomethyl]-6-methoxyphenol","","- C15 H12 N2 O2 S -","- C15 H12 N2 O2 S -","- C60 H48 N8 O8 S4 -","4","1","SU2623","Affan, Md. Abu; Jessop, Philip G.; Salam, Md. Abdus; Halim, Siti Nadiah Binti Abdul; Tiekink, Edward R. T.","2-[(1,3-Benzothiazol-2-yl)iminomethyl]-6-methoxyphenol: a new monoclinic polymorph","Acta Crystallographica Section E","2013","69","8","o1273","","10.1107/S1600536813019387","","","0.71073","MoKα","","0.0488","0.0364","","","0.0875","0.0953","","","","","","1.047","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238435","9.7556","0.0005","11.3298","0.0006","12.0571","0.0006","73.187","0.001","87.082","0.001","79.841","0.001","1255.69","0.11","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H25 N O4 Sn -","- C30 H25 N O4 Sn -","- C60 H50 N2 O8 Sn2 -","2","1","TK5234","Bhatti, Moazzam H.; Yunus, Uzma; Mussarat, Nosheen; Helliwell, Madeleine; Prendergast, Richard","<i>catena</i>-Poly[[triphenyltin(IV)]-μ-<i>N</i>-(4-acetylphenyl)maleamato]","Acta Crystallographica Section E","2013","69","8","m427","","10.1107/S1600536813017613","","","0.71073","MoKα","","0.0246","0.0238","","","0.0607","0.0613","","","","","","1.087","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238436","10.4053","0.0002","16.8563","0.0005","10.3624","0.0002","90","","100.882","0.002","90","","1784.83","0.07","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>'-(3-Sulfanylidene-3,4-dihydroquinoxalin-2-yl)benzohydrazide dimethylformamide monosolvate","","- C18 H19 N5 O2 S -","- C18 H19 N5 O2 S -","- C72 H76 N20 O8 S4 -","4","1","TK5236","Zanzoul, Asmae; Essassi, El Mokhtar; Pratviel, Geneviève; Saadi, Mohamed; El Ammari, Lahcen","<i>N</i>'-(3-Sulfanylidene-3,4-dihydroquinoxalin-2-yl)benzohydrazide dimethylformamide monosolvate","Acta Crystallographica Section E","2013","69","8","o1268","","10.1107/S1600536813019181","","","0.71073","MoKα","","0.0716","0.0474","","","0.1066","0.1191","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238437","6.585","0.007","29.05","0.03","9.385","0.009","90","","110.29","0.02","90","","1684","3","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(1<i>S</i>,3<i>S</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-10,10-Dibromo-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","","- C17 H26 Br2 -","- C17 H26 Br2 -","- C68 H104 Br8 -","4","2","TK5238","Benharref, Ahmed; El karroumi, Jamal; El Ammari, Lahcen; Saadi, Mohamed; Berraho, Moha","(1<i>S</i>,3<i>S</i>,8<i>R</i>,9<i>S</i>,11<i>R</i>)-10,10-Dibromo-3,7,7,11-tetramethyltetracyclo[6.5.0.0^1,3^.0^9,11^]tridecane","Acta Crystallographica Section E","2013","69","8","o1261","","10.1107/S160053681301903X","","","0.71073","MoKα","","0.0631","0.0417","","","0.088","0.0952","","","","","","1.099","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238438","8.5161","0.0003","16.8176","0.0006","20.5195","0.0006","90","","99.845","0.002","90","","2895.53","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5''-(2-Fluorobenzylidene)-1'-(2-fluorophenyl)-1''-methyl-1',2',3',5',6',7',8',8a'-octahydrodispiro[acenaphthylene-1,3'-indolizine-2',3''-piperidine]-2,4''(1<i>H</i>)-dione","","- C37 H32 F2 N2 O2 -","- C37 H32 F2 N2 O2 -","- C148 H128 F8 N8 O8 -","4","1","TK5239","Vishnupriya, R.; Suresh, J.; Sivakumar, S.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","5''-(2-Fluorobenzylidene)-1'-(2-fluorophenyl)-1''-methyl-1',2',3',5',6',7',8',8a'-octahydrodispiro[acenaphthylene-1,3'-indolizine-2',3''-piperidine]-2,4''(1<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","8","o1291","o1292","10.1107/S1600536813019594","","","0.71073","MoKα","","0.0719","0.0522","","","0.131","0.146","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238439","9.5785","0.0006","8.5687","0.0005","20.2229","0.0013","90","","90","","90","","1659.8","0.18","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Cyano-1-methylpyridinium iodide","","- C7 H7 I N2 -","- C7 H7 I N2 -","- C56 H56 I8 N16 -","8","1","TK5240","Kammer, Michael N.; Koplitz, Lynn V.; Mague, Joel T.","2-Cyano-1-methylpyridinium iodide","Acta Crystallographica Section E","2013","69","8","o1281","","10.1107/S1600536813019302","","","0.71073","MoKα","","0.0504","0.0356","","","0.0803","0.0908","","","","","","1.028","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238440","8.2594","0.0007","13.0352","0.0011","16.6241","0.0013","90","","90","","90","","1789.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1<i>S</i>,3<i>R</i>,8<i>R</i>,11<i>S</i>)-11-Bromo-10-bromomethyl-2,2-dichloro-3,7,7-trimethyltricyclo[6.4.0.0^1,3^]dodec-9-ene","","- C16 H22 Br2 Cl2 -","- C16 H22 Br2 Cl2 -","- C64 H88 Br8 Cl8 -","4","1","TK5241","Benharref, Ahmed; El karroumi, Jamal; El Ammari, Lahcen; Saadi, Mohamed; Berraho, Moha","(1<i>S</i>,3<i>R</i>,8<i>R</i>,11<i>S</i>)-11-Bromo-10-bromomethyl-2,2-dichloro-3,7,7-trimethyltricyclo[6.4.0.0^1,3^]dodec-9-ene","Acta Crystallographica Section E","2013","69","8","o1283","","10.1107/S1600536813019697","","","0.71073","MoKα","","0.0467","0.0383","","","0.0978","0.1023","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238441","12.668","0.003","6.2153","0.0012","16.4","0.003","90","","95.91","0.03","90","","1284.4","0.5","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Thiophene-2-carbonyl azide","","- C5 H3 N3 O S -","- C5 H3 N3 O S -","- C40 H24 N24 O8 S8 -","8","1","TK5242","Hsu, Gene C.; Singer, Laci M.; Cordes, David B.; Findlater, Michael","Thiophene-2-carbonyl azide","Acta Crystallographica Section E","2013","69","8","o1298","","10.1107/S1600536813019740","","","0.71073","MoKα","","0.0656","0.0499","","","0.1447","0.1542","","","","","","1.127","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238442","23.5515","0.0009","8.9081","0.0003","20.8278","0.0008","90","","122.628","0.002","90","","3680.1","0.2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>N</i>-(2-Allyl-4-chloro-2<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide hemihydrate","","- C17 H17 Cl N3 O3.5 S -","- C17 H17 Cl N3 O3.5 S -","- C136 H136 Cl8 N24 O28 S8 -","8","1","TK5244","Chicha, Hakima; Kouakou, Assoman; Rakib, El Mostapha; Saadi, Mohamed; El Ammari, Lahcen","<i>N</i>-(2-Allyl-4-chloro-2<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide hemihydrate","Acta Crystallographica Section E","2013","69","8","o1353","","10.1107/S1600536813020606","","","0.71073","MoKα","","0.0891","0.0471","","","0.1025","0.1221","","","","","","1.018","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238443","8.738","0.0017","6.166","0.0012","28.67","0.006","90","","95.95","0.03","90","","1536.4","0.5","293","2","293","2","","","","","","","","5","P 1 c 1","P -2yc","7","","2-[4-(2-Chloroacetyl)phenyl]-2-methyl-1-(pyrrolidin-1-yl)propan-1-one","","- C16 H20 Cl N O2 -","- C16 H20 Cl N O2 -","- C64 H80 Cl4 N4 O8 -","4","2","VM2196","Ren, Dong-mei","2-[4-(2-Chloroacetyl)phenyl]-2-methyl-1-(pyrrolidin-1-yl)propan-1-one","Acta Crystallographica Section E","2013","69","8","o1326","","10.1107/S1600536813020175","","","0.71073","MoKα","","0.1212","0.0597","","","0.0572","0.0686","","","","","","0.922","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238444","6.963","0.002","9.844","0.003","11.213","0.003","103.93","0.03","105.83","0.03","106.38","0.03","666.1","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Bis(p-nitrophenyl) phosphate sodium salt","Poly[[μ-bis(4-nitrophenyl) phosphato-κ^2^<i>O</i>,<i>O</i>']sodium]","","- C12 H8 N2 Na O8 P -","- C12 H8 N2 Na O8 P -","- C24 H16 N4 Na2 O16 P2 -","2","1","WM2751","Gerus, Aleksandra; Lis, Tadeusz","Poly[[μ-bis(4-nitrophenyl) phosphato-κ^2^<i>O</i>,<i>O</i>']sodium]","Acta Crystallographica Section E","2013","69","8","m464","m465","10.1107/S1600536813019260","","","0.71073","MoKα","","0.0408","0.03","","","0.0856","0.0899","","","","","","1.069","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238445","10.8343","0.0011","14.2291","0.0015","17.3994","0.0018","90","","102.095","0.002","90","","2622.8","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>trans</i>-Bis(μ-benzenethiolato-κ^2^<i>S</i>:<i>S</i>)bis[chlorido(triphenylphosphane-κ<i>P</i>)palladium(II)] chloroform disolvate","","- C50 H42 Cl8 P2 Pd2 S2 -","- C50 H42 Cl8 P2 Pd2 S2 -","- C100 H84 Cl16 P4 Pd4 S4 -","2","0.5","WM2753","Avila-Sorrosa, Alcives; Reyes-Arellano, Alicia; Germán-Acacio, Juan Manuel; Reyes-Martínez, Reyna; Morales-Morales, David","<i>trans</i>-Bis(μ-benzenethiolato-κ^2^<i>S</i>:<i>S</i>)bis[chlorido(triphenylphosphane-κ<i>P</i>)palladium(II)] chloroform disolvate","Acta Crystallographica Section E","2013","69","8","m472","","10.1107/S1600536813019806","","","0.71073","MoKα","","0.0429","0.0389","","","0.0862","0.0882","","","","","","1.082","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238446","8.9075","0.0007","7.3903","0.0006","15.3253","0.0012","90","","90","","90","","1008.85","0.14","296","2","296","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Trichlorido(1,3-dimethyl-2,3-dihydro-1<i>H</i>-imidazol-2-ylidene-κ<i>C</i>^2^)aluminium(III)","","- C5 H8 Al Cl3 N2 -","- C5 H8 Al Cl3 N2 -","- C20 H32 Al4 Cl12 N8 -","4","0.5","WM2754","Tian, Chong; Gao, Xiaofei; Chen, Qiao; Nie, Wanli; Borzov, Maxim V.","Trichlorido(1,3-dimethyl-2,3-dihydro-1<i>H</i>-imidazol-2-ylidene-κ<i>C</i>^2^)aluminium(III)","Acta Crystallographica Section E","2013","69","8","m441","m442","10.1107/S1600536813018254","","","0.71073","MoKα","","0.0361","0.0328","","","0.0844","0.0866","","","","","","1.071","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238447","10.6571","0.0007","13.2482","0.0009","15.0132","0.001","100.843","0.002","110.596","0.002","92.096","0.002","1936.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(2,4,6-triaminopyrimidin-1-ium) sulfate pentahydrate","","- C8 H26 N10 O9 S -","- C8 H26 N10 O9 S -","- C32 H104 N40 O36 S4 -","4","2","WM2755","Nimthong, Ruthairat; Chamchong, Siva; Pakawatchai, Chaveng; Mokhagul, Jedsada; Wattanakanjana, Yupa","Bis(2,4,6-triaminopyrimidin-1-ium) sulfate pentahydrate","Acta Crystallographica Section E","2013","69","8","o1266","o1267","10.1107/S1600536813019223","","","0.71073","MoKα","","0.13","0.0772","","","0.1478","0.1695","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238448","11.2293","0.0009","15.715","0.001","12.8464","0.001","90","","93.238","0.002","90","","2263.4","0.3","115","2","115","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(cyclohexylammonium) tetrachlorido(oxalato)stannate(IV)","","- C14 H28 Cl4 N2 O4 Sn -","- C14 H28 Cl4 N2 O4 Sn -","- C56 H112 Cl16 N8 O16 Sn4 -","4","1","WM2756","Sarr, Modou; Diasse-Sarr, Aminata; Diallo, Waly; Plasseraud, Laurent; Cattey, Hélène","Bis(cyclohexylammonium) tetrachlorido(oxalato)stannate(IV)","Acta Crystallographica Section E","2013","69","8","m473","m474","10.1107/S1600536813019284","","","0.71073","MoKα","","0.0423","0.0354","","","0.0786","0.0834","","","","","","1.118","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238449","7.8535","0.0001","8.7793","0.0002","9.6165","0.0002","90","","101.434","0.001","90","","649.88","0.02","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Distrontium trimanganese(II) bis(hydrogenphosphate) bis(orthophosphate)","","- H2 Mn3 O16 P4 Sr2 -","- H2 Mn3 O16 P4 Sr2 -","- H4 Mn6 O32 P8 Sr4 -","2","0.5","WM2758","Khmiyas, Jamal; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen","Distrontium trimanganese(II) bis(hydrogenphosphate) bis(orthophosphate)","Acta Crystallographica Section E","2013","69","8","i50","","10.1107/S1600536813018898","","","0.71073","MoKα","","0.022","0.0186","","","0.0443","0.0451","","","","","","1.063","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238450","12.77795","0.00019","8.57581","0.00015","15.1086","0.0003","90","","95.0717","0.0017","90","","1649.14","0.05","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichloridobis[3-(4-methoxyphenyl)-2-methyl-5-(piperidin-1-yl)-2,3-dihydro-1,2,4-oxadiazole-κ<i>N</i>^4^]platinum(II)","","- C30 H42 Cl2 N6 O4 Pt -","- C30 H42 Cl2 N6 O4 Pt -","- C60 H84 Cl4 N12 O8 Pt2 -","2","0.5","XU5715","Kritchenkov, Andreii S.; Lavnevich, Leonid V.; Starova, Galina L.; Bokach, Nadezhda A.; Kalibabchuk, Valentina A.","Dichloridobis[3-(4-methoxyphenyl)-2-methyl-5-(piperidin-1-yl)-2,3-dihydro-1,2,4-oxadiazole-κ<i>N</i>^4^]platinum(II)","Acta Crystallographica Section E","2013","69","8","m435","m436","10.1107/S1600536813018059","","","0.71073","MoKα","","0.0328","0.0201","","","0.0382","0.0417","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238451","12.6077","0.0004","16.7569","0.0005","12.1402","0.0004","90","","99.647","0.002","90","","2528.54","0.14","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis(μ-3-chlorobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(<i>N</i>,<i>N</i>-diethylnicotinamide-κ<i>N</i>^1^)copper(II)]","","- C48 H44 Cl4 Cu2 N4 O10 -","- C48 H44 Cl4 Cu2 N4 O10 -","- C96 H88 Cl8 Cu4 N8 O20 -","2","0.5","XU5716","Bozkurt, Nihat; Tunç, Tuncay; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","Tetrakis(μ-3-chlorobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(<i>N</i>,<i>N</i>-diethylnicotinamide-κ<i>N</i>^1^)copper(II)]","Acta Crystallographica Section E","2013","69","8","m431","m432","10.1107/S1600536813017881","","","0.71073","MoKα","","0.0336","0.0305","","","0.0811","0.0829","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238452","12.8911","0.0003","8.0049","0.0002","16.8757","0.0004","90","","90","","90","","1741.44","0.07","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Diaquabis[2-(2-hydroxyethyl)pyridine-κ^2^<i>N</i>,<i>O</i>]cobalt(II) dichloride","","- C14 H22 Cl2 Co N2 O4 -","- C14 H22 Cl2 Co N2 O4 -","- C56 H88 Cl8 Co4 N8 O16 -","4","0.5","XU5717","Zeghouan, Ouahida; Guenifa, Fatiha; Hadjadj, Nasreddine; Bendjeddou, Lamia; Merazig, Hocine","Diaquabis[2-(2-hydroxyethyl)pyridine-κ^2^<i>N</i>,<i>O</i>]cobalt(II) dichloride","Acta Crystallographica Section E","2013","69","8","m439","m440","10.1107/S1600536813018321","","","0.71073","MoKα","","0.0223","0.0198","","","0.0542","0.0562","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238453","13.08","0.0012","13.517","0.0013","7.008","0.0004","90","","94.14","0.006","90","","1235.8","0.18","150","","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-1-(2-Phenyldiazen-2-ium-1-yl)naphthalen-2-olate","","- C16 H12 N2 O -","- C16 H12 N2 O -","- C64 H48 N8 O4 -","4","1","XU5718","Bougueria, Hassiba; Chetioui, Souheyla; Boudraa, Issam; el kader Bouchoul, Abd; Bouaoud, Salah Eddine","(<i>E</i>)-1-(2-Phenyldiazen-2-ium-1-yl)naphthalen-2-olate","Acta Crystallographica Section E","2013","69","8","o1335","o1336","10.1107/S1600536813020102","","","0.71073","MoKα","","0.076","0.0537","","","0.1282","0.1435","","","","","","1.058","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238454","15.9185","0.0009","19.2366","0.0011","11.5535","0.0007","90","","90","","90","","3537.9","0.4","296","2","296","2","","","","","","","","6","I b a 2","I 2 -2c","45","","Aquabis(3-chlorobenzoato-κ<i>O</i>)bis(<i>N</i>,<i>N</i>-diethylnicotinamide-κ<i>N</i>)copper(II)","","- C34 H38 Cl2 Cu N4 O7 -","- C34 H38 Cl2 Cu N4 O7 -","- C136 H152 Cl8 Cu4 N16 O28 -","4","0.5","XU5719","Bozkurt, Nihat; Tunç, Tuncay; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","Aquabis(3-chlorobenzoato-κ<i>O</i>)bis(<i>N</i>,<i>N</i>-diethylnicotinamide-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2013","69","8","m458","m459","10.1107/S1600536813018989","","","0.71073","MoKα","","0.0403","0.0316","","","0.0823","0.0862","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238455","7.6629","0.001","11.8442","0.0014","14.342","0.002","90","","90","","90","","1301.7","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-[(<i>E</i>)-(5-Chloro-2-methylphenyl)iminomethyl]-4-methylphenol","","- C15 H14 Cl N O -","- C15 H14 Cl N O -","- C60 H56 Cl4 N4 O4 -","4","1","XU5720","Zheng, Yun-Fa","2-[(<i>E</i>)-(5-Chloro-2-methylphenyl)iminomethyl]-4-methylphenol","Acta Crystallographica Section E","2013","69","8","o1349","","10.1107/S1600536813019454","","","0.71073","MoKα","","0.068","0.0413","","","0.0871","0.1001","","","","","","1.025","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238456","25.1809","0.0005","7.0161","0.0003","30.6755","0.0006","90","","106.203","0.003","90","","5204.2","0.3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[aquabis(3-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')cadmium]-μ-<i>N</i>,<i>N</i>-diethylnicotinamide-κ^2^<i>N</i>^1^:<i>O</i>]","","- C24 H24 Cd Cl2 N2 O6 -","- C24 H24 Cd Cl2 N2 O6 -","- C192 H192 Cd8 Cl16 N16 O48 -","8","1","XU5721","Bozkurt, Nihat; Tunç, Tuncay; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer","<i>catena</i>-Poly[[aquabis(3-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')cadmium]-μ-<i>N</i>,<i>N</i>-diethylnicotinamide-κ^2^<i>N</i>^1^:<i>O</i>]","Acta Crystallographica Section E","2013","69","8","m466","m467","10.1107/S160053681301965X","","","0.71073","MoKα","","0.0488","0.0461","","","0.0925","0.0932","","","","","","1.351","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238457","10.702","0.0014","7.0263","0.0008","18.024","0.003","90","","106.252","0.007","90","","1301.2","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>'-{(<i>E</i>)-[5-(Hydroxymethyl)furan-2-yl]methylidene}pyridine-4-carbohydrazide dihydrate","","- C12 H15 N3 O5 -","- C12 H15 N3 O5 -","- C48 H60 N12 O20 -","4","1","YK2097","Prasanna, M. K.; Sithambaresan, M.; Pradeepkumar, K.; Kurup, M. R. Prathapachandra","<i>N</i>'-{(<i>E</i>)-[5-(Hydroxymethyl)furan-2-yl]methylidene}pyridine-4-carbohydrazide dihydrate","Acta Crystallographica Section E","2013","69","8","o1342","o1343","10.1107/S1600536813020114","","","0.71073","MoKα","","0.0546","0.0375","","","0.1001","0.1138","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238458","7.677","0.004","12.003","0.01","13.885","0.01","90","","90","","90","","1279.5","1.6","100","","100","","","","","","","","","4","P n a 21","P 2c -2n","33","","2-(Benzyloxy)isoquinoline-1,3(2<i>H</i>,4<i>H</i>)-dione","","- C16 H13 N O3 -","- C16 H13 N O3 -","- C64 H52 N4 O12 -","4","1","ZL2556","Ishikawa, Yoshinobu; Matsuo, Soichiro","2-(Benzyloxy)isoquinoline-1,3(2<i>H</i>,4<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","8","o1311","","10.1107/S1600536813019934","","","0.71069","MoKα","","","0.0686","","","","0.2119","","","","","","1.025","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238459","17.7791","0.0003","11.1766","0.0002","6.91805","0.00012","90","","90","","90","","1374.68","0.04","100","1","100","1","","","","","","","","6","P c a 21","P 2c -2ac","29","","(Dimethylphosphoryl)methanaminium iodide‒(dimethylphosphoryl)methanamine (1/1)","","- C6 H21 I N2 O2 P2 -","- C6 H21 I N2 O2 P2 -","- C24 H84 I4 N8 O8 P8 -","4","1","ZL2559","Reiss, Guido J.","(Dimethylphosphoryl)methanaminium iodide‒(dimethylphosphoryl)methanamine (1/1)","Acta Crystallographica Section E","2013","69","8","o1253","o1254","10.1107/S1600536813019004","","","0.71073","MoKα","","0.0176","0.0163","","","0.0321","0.0325","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238460","20.1034","0.0012","17.799","0.001","6.1366","0.0003","90","","90","","90","","2195.8","0.2","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","(2-<i>tert</i>-Butyl-3-phenyl-2,3-dihydroisoxazole-4,5-diyl)bis(phenylmethanone)","","- C27 H25 N O3 -","- C27 H25 N O3 -","- C108 H100 N4 O12 -","4","1","ZL2560","Sandhya, R.; Sithambaresan, M.; Prathapan, S.; Kurup, M. R. Prathapachandra","(2-<i>tert</i>-Butyl-3-phenyl-2,3-dihydroisoxazole-4,5-diyl)bis(phenylmethanone)","Acta Crystallographica Section E","2013","69","8","o1284","o1285","10.1107/S1600536813019508","","","0.71073","MoKα","","0.0512","0.0378","","","0.0858","0.0941","","","","","","1.049","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238461","16.286","0.007","8.91","0.006","12.008","0.009","90","","102.65","0.04","90","","1700.2","1.9","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-6,8-Dichloro-3-{[(naphthalen-1-ylmethyl)iminio]methyl}-2<i>H</i>-chromen-4-olate","","- C21 H15 Cl2 N O2 -","- C21 H15 Cl2 N O2 -","- C84 H60 Cl8 N4 O8 -","4","1","ZP2006","Ishikawa, Yoshinobu; Motohashi, Yuya","(<i>E</i>)-6,8-Dichloro-3-{[(naphthalen-1-ylmethyl)iminiumyl]methyl}-2<i>H</i>-chromen-4-olate","Acta Crystallographica Section E","2013","69","8","o1226","","10.1107/S1600536813018084","","","0.71069","MoKα","","","0.0333","","","","0.0831","","","","","","1.041","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238462","10.1828","0.0011","10.3414","0.0011","15.5542","0.0016","90","","102.688","0.002","90","","1597.9","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","<i>N</i>^2^-(4-Methoxysalicylidene)arginine hemihydrate","(2<i>S</i>)-5-{[Amino(iminiumyl)methyl]amino}-2-{[(1<i>Z</i>)-4-methoxy-2-oxidobenzylidene]azaniumyl}pentanoate hemihydrate","","- C14 H21 N4 O4.5 -","- C14 H21 N4 O4.5 -","- C56 H84 N16 O18 -","4","2","ZS2267","Sethuram, M.; Bhargavi, G.; Dhandapani, M.; Amirthaganesan, G.; NizamMohideen, M.","<i>N</i>^2^-(4-Methoxysalicylidene)arginine hemihydrate","Acta Crystallographica Section E","2013","69","8","o1301","o1302","10.1107/S1600536813019727","","","0.71073","MoKα","","0.0907","0.0722","","","0.1561","0.1668","","","","","","1.098","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238463","8.4945","0.0007","9.961","0.0008","10.3969","0.0008","64.601","0.001","68.72","0.001","70.421","0.001","723.48","0.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Bifenox","Methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate","","- C14 H9 Cl2 N O5 -","- C14 H9 Cl2 N O5 -","- C28 H18 Cl4 N2 O10 -","2","1","ZS2269","Jeon, Youngeun; Kim, Jineun; Cho, Seonghwa; Kim, Tae Ho","Bifenox: methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate","Acta Crystallographica Section E","2013","69","8","o1206","","10.1107/S1600536813018266","","","0.71073","MoKα","","0.0653","0.047","","","0.092","0.0975","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238464","11.9362","0.0011","7.511","0.0007","37.514","0.003","90","","91.65","0.002","90","","3361.8","0.5","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Amitraz","dimethylphenyl)carboximidoyl]-<i>N</i>-methylmethanimidamide","","- C19 H23 N3 -","- C19 H23 N3 -","- C152 H184 N24 -","8","2","ZS2270","Lee, Sangjin; Kim, Tae Ho; Shin, Yong Woon; Jeon, Youngeun; Kim, Jineun","Amitraz","Acta Crystallographica Section E","2013","69","8","o1300","","10.1107/S1600536813019764","","","0.71073","MoKα","","0.1337","0.0624","","","0.1476","0.1815","","","","","","0.981","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238465","13.98","0.003","21.808","0.004","9.8492","0.0016","90","","90","","90","","3002.8","1","173","","173","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Trichlorido{methyl[4-(methylimino)pent-2-en-2-yl]azanido-κ^2^<i>N</i>,<i>N</i>'}hafnium(IV)","","- C29 H41 Cl3 Hf N2 -","- C29 H41 Cl3 Hf N2 -","- C116 H164 Cl12 Hf4 N8 -","4","0.5","BH2479","Ikeda, Ken; Masuda, Hideki","Trichlorido{methyl[4-(methylimino)pent-2-en-2-yl]azanido-κ^2^<i>N</i>,<i>N</i>'}hafnium(IV)","Acta Crystallographica Section E","2013","69","9","m505","","10.1107/S1600536813022745","","","0.7107","MoKα","","","0.0285","","","","0.0684","","","","","","1.095","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238466","24.9465","0.0015","4.3709","0.0003","21.8091","0.0013","90","","90","","90","","2378","0.3","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","<i>N</i>'-[(<i>E</i>)-2-Chlorobenzylidene]thiophene-2-carbohydrazide","","- C12 H9 Cl N2 O S -","- C12 H9 Cl N2 O S -","- C96 H72 Cl8 N16 O8 S8 -","8","2","BH2481","Warad, Ismail; Haddad, Salim F.; Al-Noaimi, Mousa; Hammouti, Belkheir; Ben Hadda, Taibi","<i>N</i>'-[(<i>E</i>)-2-Chlorobenzylidene]thiophene-2-carbohydrazide","Acta Crystallographica Section E","2013","69","9","o1442","","10.1107/S1600536813020850","","","0.71073","MoKα","","0.0516","0.0438","","","0.1078","0.1127","","","","","","1.082","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238467","8.0026","0.0003","12.8195","0.0004","14.1321","0.0004","90","","91.602","0.002","90","","1449.24","0.08","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Methyl-<i>N</i>-(1-methyl-1<i>H</i>-indazol-5-yl)benzenesulfonamide","","- C15 H15 N3 O2 S -","- C15 H15 N3 O2 S -","- C60 H60 N12 O8 S4 -","4","1","BH2482","Chicha, Hakima; Oulemda, Bassou; Rakib, El Mostapha; Saadi, Mohamed; El Ammari, Lahcen","4-Methyl-<i>N</i>-(1-methyl-1<i>H</i>-indazol-5-yl)benzenesulfonamide","Acta Crystallographica Section E","2013","69","9","o1471","","10.1107/S1600536813023398","","","0.71073","MoKα","","0.0767","0.0461","","","0.1166","0.1344","","","","","","1.016","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238468","6.719","0.001","8.169","0.002","34.12","0.005","90","","90","","90","","1872.8","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl (20α)-16,17-didehydro-19α-methyl-18-oxayohimban-16-carboxylate","","- C21 H24 N2 O3 -","- C21 H24 N2 O3 -","- C84 H96 N8 O12 -","4","1","BQ2388","Cachet, Xavier; Porée, François-Hugues; Michel, Sylvie; Lemoine, Pascale","Tetrahydroalstonine","Acta Crystallographica Section E","2013","69","9","o1389","o1390","10.1107/S1600536813021168","","","0.71069","MoKα","","0.0638","0.0436","","","0.1009","0.1142","","","","","","1.012","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238469","11.2716","0.0001","11.2716","0.0001","4.6981","0.0001","90","","90","","90","","596.889","0.015","293","2","293","2","","","","","","","","5","I -4","I -4","82","","Zinc mercury(II) tetrakis(selenocyanate)","","- C4 Hg N4 Se4 Zn -","- C4 Hg N4 Se4 Zn -","- C8 Hg2 N8 Se8 Zn2 -","2","0.25","BR2230","Sun, Hai-Qing; Wang, Xin-Qiang; Zhang, Wei-Wei","Zinc mercury(II) tetrakis(selenocyanate)","Acta Crystallographica Section E","2013","69","9","i59","","10.1107/S1600536813022502","","","0.71073","MoKα","","0.03","0.026","","","0.0518","0.0527","","","","","","0.86","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238470","5.645","0.0009","11.2255","0.0017","11.5281","0.0017","73.911","0.009","89.898","0.009","81.466","0.009","693.53","0.19","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","<i>r</i>-2,<i>c</i>-6-Diphenylpiperidine","","- C17 H19 N -","- C17 H19 N -","- C34 H38 N2 -","2","1","BT6919","Maheshwaran, V.; Abdul Basheer, S.; Akila, A.; Ponnuswamy, S.; Ponnuswamy, M. N.","<i>r</i>-2,<i>c</i>-6-Diphenylpiperidine","Acta Crystallographica Section E","2013","69","9","o1371","","10.1107/S1600536813020382","","","0.71073","MoKα","","0.0576","0.0426","","","0.1121","0.1246","","","","","","1.057","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238471","10.1069","0.0003","13.6178","0.0003","10.853","0.0002","90","","90.777","0.002","90","","1493.6","0.06","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Methoxy-<i>N</i>-(1-methyl-1<i>H</i>-indazol-5-yl)benzenesulfonamide","","- C15 H15 N3 O3 S -","- C15 H15 N3 O3 S -","- C60 H60 N12 O12 S4 -","4","1","BT6924","Chicha, Hakima; Rakib, El Mostapha; Geffken, Detlef; Saadi, Mohamed; El Ammari, Lahcen","4-Methoxy-<i>N</i>-(1-methyl-1<i>H</i>-indazol-5-yl)benzenesulfonamide","Acta Crystallographica Section E","2013","69","9","o1398","","10.1107/S1600536813021624","","","0.71073","MoKα","","0.0551","0.0407","","","0.1138","0.1248","","","","","","1.021","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238472","13.3025","0.0006","11.2505","0.0005","7.3092","0.0003","90","","91.343","0.002","90","","1093.59","0.08","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Allyl-3-chloro-5-nitro-1<i>H</i>-indazole","","- C10 H8 Cl N3 O2 -","- C10 H8 Cl N3 O2 -","- C40 H32 Cl4 N12 O8 -","4","1","BT6927","Chicha, Hakima; Rakib, El Mostapha; Spinelli, Domenico; Saadi, Mohamed; El Ammari, Lahcen","1-Allyl-3-chloro-5-nitro-1<i>H</i>-indazole","Acta Crystallographica Section E","2013","69","9","o1410","","10.1107/S1600536813021995","","","0.71073","MoKα","","0.0884","0.0469","","","0.1161","0.136","","","","","","1.023","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238473","8.5427","0.0002","9.829","0.0002","13.2658","0.0003","81.133","0.001","78.763","0.001","64.343","0.001","981.73","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","3-Benzyl-1-{[3-(4-chlorophenyl)isoxazol-5-yl]methyl}-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","","- C24 H18 Cl N3 O2 -","- C24 H18 Cl N3 O2 -","- C48 H36 Cl2 N6 O4 -","2","1","BT6928","Kandri Rodi, Youssef; Haoudi, Amal; Capet, Frédéric; Rolando, Christian; El Ammari, Lahcen","3-Benzyl-1-{[3-(4-chlorophenyl)isoxazol-5-yl]methyl}-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","9","o1451","","10.1107/S160053681302299X","","","0.71073","MoKα","","0.06","0.0452","","","0.1279","0.1434","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238474","5.6423","0.0003","8.0808","0.0004","36.3864","0.0019","90","","90","","90","","1659.01","0.15","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(+)-(<i>S</i>)-<i>N</i>-[(1-Benzothiophen-2-yl)methylidene]-1-(naphthalen-1-yl)ethylamine","","- C21 H17 N S -","- C21 H17 N S -","- C84 H68 N4 S4 -","4","1","BT6929","Hernández-Téllez, Guadalupe; Portillo-Moreno, Oscar; Gutiérrez, René; Rios-Merino, Francisco J.; Mendoza, Angel","(+)-(<i>S</i>)-<i>N</i>-[(1-Benzothiophen-2-yl)methylidene]-1-(naphthalen-1-yl)ethylamine","Acta Crystallographica Section E","2013","69","9","o1480","","10.1107/S1600536813023611","","","1.54184","CuKα","","0.0506","0.0397","","","","0.0919","","","","","","1.011","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238475","15.6232","0.001","15.0696","0.0009","15.9063","0.0011","90","","98.873","0.002","90","","3700.1","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 2-amino-4-(4-methyl-1,3-thiazol-5-yl)-5-oxo-4<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>]chromene-3-carboxylate","","- C19 H16 N2 O5 S -","- C19 H16 N2 O5 S -","- C152 H128 N16 O40 S8 -","8","2","BX2447","Karthikeyan, V.; Ramkumar, V.; Karunakaran, R. Joel","Ethyl 2-amino-4-(4-methyl-1,3-thiazol-5-yl)-5-oxo-4<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>]chromene-3-carboxylate","Acta Crystallographica Section E","2013","69","9","o1411","o1412","10.1107/S1600536813021703","","","0.71073","MoKα","","0.1058","0.0481","","","0.1137","0.1445","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238476","6.27869","0.00007","15.43607","0.00012","15.27141","0.00013","90","","96.2633","0.0009","90","","1471.24","0.02","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","arylpyrazoles","Ethyl 5-amino-1-[(4-methylphenyl)sulfonyl]-1<i>H</i>-pyrazole-4-carboxylate","","- C13 H15 N3 O4 S -","- C13 H15 N3 O4 S -","- C52 H60 N12 O16 S4 -","4","1","CV5421","Elgazwy, Abdel-Sattar S. Hamad; Nassar, Ibrahim F.; Jones, Peter G.","Ethyl 5-amino-1-[(4-methylphenyl)sulfonyl]-1<i>H</i>-pyrazole-4-carboxylate","Acta Crystallographica Section E","2013","69","9","o1376","","10.1107/S1600536813019326","","","1.54184","CuKα","","0.0272","0.0271","","","0.0738","0.0738","","","","","","1.05","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238477","22.3068","0.0008","7.5667","0.0002","12.7114","0.0005","90","","98.837","0.004","90","","2120.07","0.13","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tricyclo[3.3.1.0^3,7^]nonane-3,7-diyl bis(4-methylbenzenesulfonate)","","- C23 H26 O6 S2 -","- C23 H26 O6 S2 -","- C92 H104 O24 S8 -","4","0.5","FB2286","Ioannou, Savvas; Moushi, Eleni","Tricyclo[3.3.1.0^3,7^]nonane-3,7-diyl bis(4-methylbenzenesulfonate)","Acta Crystallographica Section E","2013","69","9","o1464","o1465","10.1107/S1600536813023234","","","0.71073","MoKα","","0.035","0.0317","","","0.0864","0.0885","","","","","","1.086","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238478","6.2028","0.0002","6.5971","0.0001","8.5963","0.0002","109.734","0.002","102.621","0.003","97.031","0.002","315.649","0.015","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Diaquadichloridobis(pyridine-κ<i>N</i>)cobalt(II)","","- C10 H14 Cl2 Co N2 O2 -","- C10 H14 Cl2 Co N2 O2 -","- C10 H14 Cl2 Co N2 O2 -","1","0.5","FB2288","Kannan, P.S.; Ganeshraja, A. S.; Anbalagan, K.; Govindan, E.; SubbiahPandi, A.","Diaquadichloridobis(pyridine-κ<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2013","69","9","m508","m509","10.1107/S1600536813022484","","","0.71073","MoKα","","0.0518","0.0474","","","0.1462","0.1494","","","","","","1.157","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238479","4.8761","0.0002","12.1025","0.0004","9.822","0.0003","90","","99.112","0.003","90","","572.31","0.04","100","1","100","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Levulinic acid","4-Oxopentanoic acid","","- C5 H8 O3 -","- C5 H8 O3 -","- C20 H32 O12 -","4","1","FF2114","Hachuła, Barbara; Polasz, Anna; Dzida, Marzena; Nowak, Maria; Kusz, Joachim","Levulinic acid","Acta Crystallographica Section E","2013","69","9","o1406","","10.1107/S1600536813021090","","","0.71073","MoKα","","0.0447","0.04","","","0.1103","0.1136","","","","","","1.058","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238480","19.9481","0.0009","4.4138","0.0001","13.3277","0.0005","90","","109.027","0.004","90","","1109.35","0.07","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","<i>anti</i>-Ethyl acetohydroximate","Ethyl <i>N</i>-hydroxyethanecarboximidate","","- C4 H9 N O2 -","- C4 H9 N O2 -","- C32 H72 N8 O16 -","8","1","FF2116","Hachuła, Barbara; Polasz, Anna; Nowak, Maria; Kusz, Joachim","<i>anti</i>-Ethyl acetohydroximate","Acta Crystallographica Section E","2013","69","9","o1418","","10.1107/S1600536813022368","","","0.71073","MoKα","","0.0378","0.034","","","0.0964","0.0982","","","","","","1.082","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238481","11.3755","0.0003","11.9028","0.0003","12.5261","0.0003","86.122","0.001","85.949","0.001","89.206","0.001","1687.86","0.07","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","2-Isopropyl-2-(6-methoxy-1,3-benzothiazol-2-yl)-5,5-dimethyl-1,3-thiazolidin-4-one","","- C16 H20 N2 O2 S2 -","- C16 H20 N2 O2 S2 -","- C64 H80 N8 O8 S8 -","4","2","FK2073","Würfel, Hendryk; Görls, Helmar; Weiss, Dieter; Beckert, Rainer","2-Isopropyl-2-(6-methoxy-1,3-benzothiazol-2-yl)-5,5-dimethyl-1,3-thiazolidin-4-one","Acta Crystallographica Section E","2013","69","9","o1391","","10.1107/S1600536813019521","","","0.71073","MoKα","","0.0457","0.0392","","","0.0828","0.0878","","","","","","1.077","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238482","15.1438","0.0004","5.7099","0.0002","18.7388","0.0006","90","","91.967","0.002","90","","1619.38","0.09","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Amino-2-(pivaloylamino)pyridinium benzoate","","- C17 H21 N3 O3 -","- C17 H21 N3 O3 -","- C68 H84 N12 O12 -","4","1","FY2103","Checińska, Lilianna; Ośmiałowski, Borys; Valkonen, Arto","6-Amino-2-(pivaloylamino)pyridinium benzoate","Acta Crystallographica Section E","2013","69","9","o1483","o1484","10.1107/S1600536813023787","","","0.71073","MoKα","","0.1398","0.0655","","","0.1209","0.1411","","","","","","1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238483","7.5473","0.0008","11.7362","0.001","11.5228","0.0011","90","","96.436","0.003","90","","1014.22","0.17","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-2-Bromomethyl-3-(<i>o</i>-tolyl)acrylonitrile","","- C11 H10 Br N -","- C11 H10 Br N -","- C44 H40 Br4 N4 -","4","1","GK2587","Kanchanadevi, J.; Anbalagan, G.; Selvakumar, R.; Bakthadoss, M.; Gunasekaran, B.; Manivannan, V.","(<i>E</i>)-2-Bromomethyl-3-(<i>o</i>-tolyl)acrylonitrile","Acta Crystallographica Section E","2013","69","9","o1367","","10.1107/S1600536813021041","","","0.71073","MoKα","","0.075","0.0347","","","0.0707","0.0845","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238484","9.4967","0.0003","11.2837","0.0002","12.0297","0.0004","109.897","0.002","96.388","0.002","102.048","0.002","1161.9","0.06","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)-2-(1,1-Dicyclohexyl-3-phenylallyl)-5,5-dimethyl-1,3,2-dioxaborinane","","- C26 H39 B O2 -","- C26 H39 B O2 -","- C52 H78 B2 O4 -","2","1","GO2094","El-Hiti, Gamal A.; Smith, Keith; Elliott, Mark C.; Jones, Dyfyr Heulyn; Kariuki, Benson M.","(<i>E</i>)-2-(1,1-Dicyclohexyl-3-phenylallyl)-5,5-dimethyl-1,3,2-dioxaborinane","Acta Crystallographica Section E","2013","69","9","o1403","","10.1107/S1600536813021739","","","0.71073","MoKα","","0.0658","0.05","","","0.1167","0.1275","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238485","7.7994","0.0014","10.2797","0.0008","10.8056","0.0008","116.862","0.003","103.956","0.004","96.78","0.004","723.8","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Dimethyl 6-iodo-2-methyl-1,2-dihydroquinoline-2,4-dicarboxylate","","- C14 H14 I N O4 -","- C14 H14 I N O4 -","- C28 H28 I2 N2 O8 -","2","1","GW2137","Gültekin, Zeynep; Frey, Wolfgang; Hökelek, Tuncer","Dimethyl 6-iodo-2-methyl-1,2-dihydroquinoline-2,4-dicarboxylate","Acta Crystallographica Section E","2013","69","9","o1476","","10.1107/S1600536813023544","","","0.71073","MoKα","","0.0272","0.0267","","","0.073","0.0733","","","","","","1.239","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238486","21.5802","0.0006","15.3758","0.0004","5.73626","0.00014","90","","90","","90","","1903.36","0.09","291","2","291","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","1,2:1',2'-Di-<i>O</i>-isopropylidenedifuranose","6-{5-Ethyl-6-hydroxy-2,2-dimethyltetrahydro-2<i>H</i>-furo[2,3-<i>d</i>][1,3]dioxol-6a-yl}-5-ethylidene-2,2-dimethyl-tetrahydro-2<i>H</i>-furo[2,3-<i>d</i>][1,3]dioxol-6-ol","","- C18 H28 O8 -","- C18 H28 O8 -","- C72 H112 O32 -","4","1","HB7100","Zhang, Qiurong; Zhou, Guangqiang; He, Peng; Chen, Xuebin; Liu, Hongmin","1,2:1',2'-Di-<i>O</i>-isopropylidenedifuranose-C12 higher carbon sugar","Acta Crystallographica Section E","2013","69","9","o1399","","10.1107/S1600536813021776","","","1.54184","CuKα","","0.0416","0.0371","","","0.094","0.0986","","","","","","1.048","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238487","11.1812","0.0002","11.5623","0.0002","16.4471","0.0002","101.42","0.001","98.127","0.001","101.316","0.001","2007.43","0.06","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","<i>N</i>,<i>N</i>'-Bis(phenylcarbamothioyl)benzene-1,3-dicarboxamide","","- C22 H18 N4 O2 S2 -","- C22 H18 N4 O2 S2 -","- C88 H72 N16 O8 S8 -","4","2","HB7103","Ngaini, Zainab; Mohd Ariff, Maya Asyikin; Wan Zullkiplee, Wan Sharifatun Handayani; Hussain, Hasnain; Rosli, Mohd Mustaqim","<i>N</i>,<i>N</i>'-Bis(phenylcarbamothioyl)benzene-1,3-dicarboxamide","Acta Crystallographica Section E","2013","69","9","o1374","o1375","10.1107/S1600536813020163","","","0.71073","MoKα","","0.0592","0.0443","","","0.1113","0.1215","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238488","9.7158","0.0002","12.504","0.0002","13.5925","0.0002","106.415","0.001","100.882","0.001","94.854","0.001","1538.74","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","2-Oxo-2-(2-oxo-2<i>H</i>-chromen-3-yl)ethyl pyrrolidine-1-carbodithioate","","- C16 H15 N O3 S2 -","- C16 H15 N O3 S2 -","- C64 H60 N4 O12 S8 -","4","2","HB7109","Kumar, K. Mahesh; Mahabhaleshwaraiah, N. M.; Kotresh, O.; Roopashree, K. R.; Devarajegowda, H. C.","2-Oxo-2-(2-oxo-2<i>H</i>-chromen-3-yl)ethyl pyrrolidine-1-carbodithioate","Acta Crystallographica Section E","2013","69","9","o1382","","10.1107/S1600536813020965","","","0.71073","MoKα","","0.048","0.0388","","","0.104","0.109","","","","","","1.086","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238489","8.5905","0.0003","8.7215","0.0003","20.7373","0.0007","90","","90","","90","","1553.68","0.09","291","2","291.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Cyclopropyl-1-(6'-Deoxy-1',2'-<i>O</i>-isopropylidene-α-<i>D</i>-glucofuranosyl)-1<i>H</i>-1,2,3-triazole","","- C14 H21 N3 O5 -","- C14 H21 N3 O5 -","- C56 H84 N12 O20 -","4","1","HB7111","Zhang, Qiurong; He, Peng; Zhou, Guangqiang; Yu, Kang; Liu, Hongmin","4-Cyclopropyl-1-(6'-deoxy-1',2'-<i>O</i>-isopropylidene-α-<small>D</small>-glucofuranosyl)-1<i>H</i>-1,2,3-triazole","Acta Crystallographica Section E","2013","69","9","o1386","","10.1107/S1600536813021351","","","1.54178","CuKα","","0.0467","0.0415","","","0.1076","0.1127","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238490","17.996","0.008","9.127","0.006","11.649","0.007","90","","102","0.04","90","","1871.5","1.9","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-3-{[([1,1'-Biphenyl]-3-ylmethyl)iminiumyl]methyl}-6,8-dichloro-2<i>H</i>-chromen-4-olate","","- C23 H17 Cl2 N O2 -","- C23 H17 Cl2 N O2 -","- C92 H68 Cl8 N4 O8 -","4","1","HB7114","Ishikawa, Yoshinobu; Motohashi, Yuya","(<i>E</i>)-3-{[([1,1'-Biphenyl]-3-ylmethyl)iminiumyl]methyl}-6,8-dichloro-2<i>H</i>-chromen-4-olate","Acta Crystallographica Section E","2013","69","9","o1448","","10.1107/S160053681302285X","","","0.71069","MoKα","","","0.0447","","","","0.1149","","","","","","1.005","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238491","16.3379","0.0005","9.6445","0.0003","20.5078","0.0006","90","","90","","90","","3231.43","0.17","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","2-Oxo-2-(2-oxo-2<i>H</i>-chromen-3-yl)ethyl diethyldithiocarbamate","","- C16 H17 N O3 S2 -","- C16 H17 N O3 S2 -","- C128 H136 N8 O24 S16 -","8","1","HB7115","Meenakshi, T. G.; Devarajegowda, H. C.; Kumar, K. Mahesh; Kotresh, O.; Devaru, Venkatesh B.","2-Oxo-2-(2-oxo-2<i>H</i>-chromen-3-yl)ethyl diethyldithiocarbamate","Acta Crystallographica Section E","2013","69","9","o1454","","10.1107/S1600536813021806","","","0.71073","MoKα","","0.0528","0.0351","","","0.0835","0.0895","","","","","","1.049","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238492","9.3684","0.0007","6.6146","0.0004","16.072","0.0011","90","","99.939","0.004","90","","981.01","0.12","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(4-Methoxyphenyl)pyrrolidine-2,5-dione","","- C11 H11 N O3 -","- C11 H11 N O3 -","- C44 H44 N4 O12 -","4","1","HB7117","Sirajuddin, Muhammad; Ali, Saqib","1-(4-Methoxyphenyl)pyrrolidine-2,5-dione","Acta Crystallographica Section E","2013","69","9","o1439","","10.1107/S1600536813022460","","","0.71073","MoKα","","0.0411","0.0339","","","0.0862","0.0935","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238493","17.674","0.003","6.1352","0.0012","23.961","0.005","90","","95.359","0.009","90","","2586.8","0.9","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(3-Chlorobenzoyl)-3-(3,4-dichlorophenyl)-1-(4-ferrocenylphenyl)guanidine","","- C30 H22 Cl3 Fe N3 O -","- C30 H22 Cl3 Fe N3 O -","- C120 H88 Cl12 Fe4 N12 O4 -","4","1","HB7118","Gul, Rukhsana; Khan, Azim; Badshah, Amin; Tahir, M. Nawaz","2-(3-Chlorobenzoyl)-3-(3,4-dichlorophenyl)-1-(4-ferrocenylphenyl)guanidine","Acta Crystallographica Section E","2013","69","9","m486","","10.1107/S1600536813021892","","","0.71073","MoKα","","0.1305","0.0599","","","0.1002","0.1222","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238494","9.855","0.002","12.064","0.002","16.345","0.003","90","","97.61","0.03","90","","1926.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[2,5-Dibromo-4-(4-methylbenzoyl)phenyl](4-methylphenyl)methanone","1,4-Dibromo-2,5-di-<i>p</i>-toluoylbenzene","","- C22 H16 Br2 O2 -","- C22 H16 Br2 O2 -","- C88 H64 Br8 O8 -","4","1","HB7121","He, Guang-Ke; Song, Guang-Liang; Chen, Chen; Zhu, Hong-Jun","1,4-Dibromo-2,5-di-<i>p</i>-toluoylbenzene","Acta Crystallographica Section E","2013","69","9","o1444","","10.1107/S160053681302237X","","","0.71073","MoKα","","0.1644","0.0651","","","0.1082","0.1325","","","","","","0.998","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238495","12.3467","0.0004","10.3227","0.0003","17.0611","0.0006","90","","90.864","0.002","90","","2174.21","0.12","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Triphenyl(pyrrolidine-1-carbodithioato-κ<i>S</i>)tin(IV)","","- C23 H23 N S2 Sn -","- C23 H23 N S2 Sn -","- C92 H92 N4 S8 Sn4 -","4","1","HB7122","Sirajuddin, Muhammad; Uddin, Noor; Ali, Saqib","Triphenyl(pyrrolidine-1-carbodithioato-κ<i>S</i>)tin(IV)","Acta Crystallographica Section E","2013","69","9","m497","","10.1107/S1600536813022472","","","0.71073","MoKα","","0.0305","0.0224","","","0.0534","0.0618","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238496","12.426","0.0003","12.9136","0.0003","17.9749","0.0004","89.7528","0.0018","79.4467","0.0019","71.298","0.002","2681.23","0.11","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Bis[<i>O</i>,<i>O</i>'-bis(4-<i>tert</i>-butylphenyl) dithiophosphato-κ^2^<i>S</i>,<i>S</i>']bis(pyridine-κ<i>N</i>)lead(II)","","- C50 H62 N2 O4 P2 Pb S4 -","- C50 H62 N2 O4 P2 Pb S4 -","- C100 H124 N4 O8 P4 Pb2 S8 -","2","1","HB7129","Zhang, Xiulan; Xie, Bin; He, Linxin; Lu, Lu; Chen, Neng","Bis[<i>O</i>,<i>O</i>'-bis(4-<i>tert</i>-butylphenyl) dithiophosphato-κ^2^<i>S</i>,<i>S</i>']bis(pyridine-κ<i>N</i>)lead(II)","Acta Crystallographica Section E","2013","69","9","m524","","10.1107/S1600536813023945","","","0.71073","MoKα","","0.0462","0.0328","","","0.0619","0.0675","","","","","","1.016","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238497","5.1264","0.001","8.035","0.0016","10.04","0.002","68.6","0.03","77.64","0.03","85.16","0.03","376.11","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-aqua-bis[aqua(5-carboxylato-1<i>H</i>-1,2,3-triazole-4-carboxylic acid-κ^2^<i>N</i>^3^,<i>O</i>^4^)lithium]","","- C8 H12 Li2 N6 O12 -","- C8 H12 Li2 N6 O12 -","- C8 H12 Li2 N6 O12 -","1","0.5","HB7130","Starosta, Wojciech; Leciejewicz, Janusz","Di-μ-aqua-bis[aqua(5-carboxylato-1<i>H</i>-1,2,3-triazole-4-carboxylic acid-κ^2^<i>N</i>^3^,<i>O</i>^4^)lithium]","Acta Crystallographica Section E","2013","69","9","m515","m516","10.1107/S1600536813023167","","","0.71073","MoKα","","0.073","0.0572","","","0.1385","0.1512","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238498","15.097","0.002","5.8121","0.001","10.486","0.002","90","","99.75","0.02","90","","906.8","0.3","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Methylbenzylammonium nitrate","","- C8 H12 N2 O3 -","- C8 H12 N2 O3 -","- C32 H48 N8 O12 -","4","1","HB7131","Gatfaoui, Sofian; Marouani, Houda; Rzaigui, Mohamed","4-Methylbenzylammonium nitrate","Acta Crystallographica Section E","2013","69","9","o1453","","10.1107/S1600536813022836","","","0.56083","AgKα","","0.225","0.0709","","","0.1642","0.2164","","","","","","0.958","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238499","6.1347","0.0005","7.1124","0.0003","19.8245","0.0013","90","","90","","90","","864.99","0.1","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-3-(4-Bromo-5-methylthiophen-2-yl)acrylonitrile","","- C8 H6 Br N S -","- C8 H6 Br N S -","- C32 H24 Br4 N4 S4 -","4","1","HG5330","El-Hiti, Gamal A.; Smith, Keith; Balakit, Asim A.; Masmali, Ali; Kariuki, Benson M.","(<i>E</i>)-3-(4-Bromo-5-methylthiophen-2-yl)acrylonitrile","Acta Crystallographica Section E","2013","69","9","o1385","","10.1107/S1600536813019752","","","0.71073","MoKα","","0.0526","0.0476","","","0.1157","0.1204","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238500","12.6926","0.0002","11.8015","0.0002","19.9701","0.0004","90","","103.883","0.002","90","","2903.97","0.09","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[3-({[Bis(2-methylpropyl)carbamothioyl]amino}carbonyl)benzoyl]-3,3-bis(2-methylpropyl)thiourea","","- C26 H42 N4 O2 S2 -","- C26 H42 N4 O2 S2 -","- C104 H168 N16 O8 S8 -","4","1","HG5336","Selvakumaran, N.; Karvembu, R.; Ng, Seik Weng; Tiekink, Edward R. T.","1-[3-({[Bis(2-methylpropyl)carbamothioyl]amino}carbonyl)benzoyl]-3,3-bis(2-methylpropyl)thiourea","Acta Crystallographica Section E","2013","69","9","o1368","","10.1107/S1600536813021053","","","1.54184","CuKα","","0.0541","0.0504","","","0.1378","0.1423","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238501","8.1888","0.0005","13.8545","0.0006","8.1592","0.0004","90","","98.771","0.005","90","","914.85","0.08","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-chlorido-bis[(2-aminobenzamide-κ^2^<i>N</i>^2^,<i>O</i>)chloridocopper(II)]","","- C14 H16 Cl4 Cu2 N4 O2 -","- C14 H16 Cl4 Cu2 N4 O2 -","- C28 H32 Cl8 Cu4 N8 O4 -","2","0.5","HG5337","Damous, Maamar; Dénès, George; Bouacida, Sofiane; Hamlaoui, Meriem; Merazig, Hocine; Daran, Jean-Claude","Di-μ-chlorido-bis[(2-aminobenzamide-κ^2^<i>N</i>^2^,<i>O</i>)chloridocopper(II)]","Acta Crystallographica Section E","2013","69","9","m488","","10.1107/S1600536813021879","","","0.71073","MoKα","","0.0247","0.0219","","","0.0566","0.0584","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238502","6.5536","0.0004","8.06","0.0005","11.3369","0.0006","100.068","0.005","106.344","0.004","105.712","0.005","532.35","0.06","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","8-Hydroxyquinolin-1-ium hydrogen sulfate monohydrate","","- C9 H11 N O6 S -","- C9 H11 N O6 S -","- C18 H22 N2 O12 S2 -","2","1","HG5339","Damous, Maamar; Dénès, George; Bouacida, Sofiane; Hamlaoui, Meriem; Merazig, Hocine; Daran, Jean-Claude","8-Hydroxyquinolin-1-ium hydrogen sulfate monohydrate","Acta Crystallographica Section E","2013","69","9","o1458","o1459","10.1107/S1600536813022319","","","0.71073","MoKα","","0.0321","0.0295","","","0.0773","0.0793","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238503","7.457","0.0015","9.049","0.0015","11.782","0.002","68.8","0.011","81.124","0.013","73.441","0.009","709.3","0.2","98","2","98","2","","","","","","","","4","P -1","-P 1","2","","Benzene-1,2,4,5-tetracarboxylic acid bis(1,3,7-trimethyl-2,3,6,7-tetrahydro-1<i>H</i>-purine-2,6-dione)","","- C26 H26 N8 O12 -","- C26 H26 N8 O12 -","- C26 H26 N8 O12 -","1","0.5","HG5340","Arman, Hadi D.; Tiekink, Edward R. T.","Benzene-1,2,4,5-tetracarboxylic acid bis(1,3,7-trimethyl-2,3,6,7-tetrahydro-1<i>H</i>-purine-2,6-dione)","Acta Crystallographica Section E","2013","69","9","o1443","","10.1107/S1600536813022563","","","0.71073","MoKα","","0.0468","0.0443","","","0.1175","0.1201","","","","","","1.043","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238504","9.4599","0.0002","23.3634","0.0005","17.2312","0.0004","90","","96.001","0.002","90","","3787.49","0.14","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Ethyl 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)cyclohexa-1,3-diene-1-carboxylate","Ethyl 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)cyclohexa-1,3-diene-1-carboxylate","","- C21 H19 Br F N O2 -","- C21 H19 Br F N O2 -","- C168 H152 Br8 F8 N8 O16 -","8","2","HG5341","Narayana, B.; Sapnakumari, M.; Jasinski, Jerry P.; Fraiser, Peter M.; Yathirajan, H. S.","Ethyl 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)cyclohexa-1,3-diene-1-carboxylate","Acta Crystallographica Section E","2013","69","9","o1473","","10.1107/S1600536813023325","","","1.5418","CuKα","","0.0629","0.051","","","0.137","0.1477","","","","","","1.025","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238505","4.9971","0.0004","8.6363","0.0004","13.5808","0.0009","97.869","0.004","91.66","0.006","100.968","0.005","569.06","0.07","200","1","200","1","","","","","","","","5","P -1","-P 1","2","Bis(4-methoxy-3,4-dihydroquinazolin-1-ium) chloranilate","Bis(4-methoxy-3,4-dihydroquinazolin-1-ium) 2,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,4-diolate","","- C24 H22 Cl2 N4 O6 -","- C24 H22 Cl2 N4 O6 -","- C24 H22 Cl2 N4 O6 -","1","0.5","HG5342","Gotoh, Kazuma; Ishida, Hiroyuki","Bis(4-methoxy-3,4-dihydroquinazolin-1-ium) chloranilate","Acta Crystallographica Section E","2013","69","9","o1482","","10.1107/S1600536813023635","","","0.71075","MoKα","","0.0949","0.0824","","","0.168","0.177","","","","","","0.843","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238506","15.1335","0.0006","9.6048","0.0002","16.9739","0.0006","90","","97.384","0.001","90","","2446.77","0.14","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,3-Dimethyl-<i>cis</i>-9a,13a-diphenyl-2,3,9a,11,12,13a-hexahydro-1<i>H</i>-benzo[<i>h</i>][1,4]dioxino[2',3':5,6][1,4]dioxino[2,3-<i>f</i>]chromene","","- C31 H28 O5 -","- C31 H28 O5 -","- C124 H112 O20 -","4","1","HG5343","Bernardes, Bauer O.; Ferreira, Aurelio B. Buarque; Wardell, James L.; Wardell, Solange M. S. V.; Netto-Ferreira, José C.; Tiekink, Edward R. T.","3,3-Dimethyl-<i>cis</i>-9a,13a-diphenyl-2,3,9a,11,12,13a-hexahydro-1<i>H</i>-benzo[<i>h</i>][1,4]dioxino[2',3':5,6][1,4]dioxino[2,3-<i>f</i>]chromene","Acta Crystallographica Section E","2013","69","9","o1487","o1488","10.1107/S1600536813023660","","","0.71073","MoKα","","0.1007","0.0499","","","0.1122","0.1385","","","","","","1.015","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238507","16.8808","0.0004","7.3212","0.0002","13.5268","0.0003","90","","128.364","0.001","90","","1310.79","0.06","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[di-μ-aqua-diaquabis(μ~7~-oxalato-κ^9^<i>O</i>^1^:<i>O</i>^1^:<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^2^:<i>O</i>^2'^:<i>O</i>^2'^,<i>O</i>^1'^:<i>O</i>^1'^)calciumdicaesium]","","- C4 H8 Ca Cs2 O12 -","- C4 H8 Ca Cs2 O12 -","- C16 H32 Ca4 Cs8 O48 -","4","0.5","HY2635","Kherfi, Hamza; Hamadène, Malika; Guehria-Laïdoudi, Achoura; Dahaoui, Slimane; Lecomte, Claude","Poly[di-μ-aqua-diaquabis(μ~7~-oxalato-κ^9^<i>O</i>^1^:<i>O</i>^1^:<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^2^:<i>O</i>^2'^:<i>O</i>^2'^,<i>O</i>^1'^:<i>O</i>^1'^)calciumdicaesium]","Acta Crystallographica Section E","2013","69","9","m493","m494","10.1107/S1600536813022654","","","0.71073","MoKα","","0.025","0.0241","","","0.0601","0.0602","","","","","","1.25","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238508","9.0667","0.0002","9.3922","0.0002","9.6486","0.0002","94.218","0.001","113.543","0.001","106.265","0.001","706.87","0.03","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","1-Allyl-3-benzyl-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","","- C17 H16 N2 O -","- C17 H16 N2 O -","- C34 H32 N4 O2 -","2","1","IM2438","Kandri Rodi, Youssef; Haoudi, Amal; Capet, Frédéric; Mazzah, Ahmed; Essassi, El Mokhtar; El Ammari, Lahcen","1-Allyl-3-benzyl-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2013","69","9","o1477","o1478","10.1107/S1600536813023568","","","0.71073","MoKα","","0.0657","0.0472","","","0.1271","0.1411","","","","","","1.059","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238509","8.2988","0.0004","10.4667","0.0003","10.9665","0.0003","75.568","0.002","85.411","0.002","74.145","0.002","887.33","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","(<i>Z</i>)-<i>N</i>-(2,6-Diisopropylphenyl)-4-nitrobenzimidoyl chloride","","- C19 H21 Cl N2 O2 -","- C19 H21 Cl N2 O2 -","- C38 H42 Cl2 N4 O4 -","2","1","IS5293","El-Hiti, Gamal A.; Smith, Keith; Jones, Dyfyr Heulyn; Masmali, Ali; Kariuki, Benson M.","(<i>Z</i>)-<i>N</i>-(2,6-Diisopropylphenyl)-4-nitrobenzimidoyl chloride","Acta Crystallographica Section E","2013","69","9","o1384","","10.1107/S1600536813020862","","","0.71073","MoKα","","0.0879","0.0616","","","0.1476","0.1732","","","","","","1.057","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238510","10.917","0.002","19.083","0.004","12.705","0.003","90","","104.201","0.002","90","","2565.9","0.9","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichlorido[6,8,22,24,34,36-hexamethyl-33,35-diaza-3,11,19,27-tetraazoniapentacyclo[27.3.1.1^5,9^.1^13,17^.1^21,25^]hexatriaconta-1(33),5,7,9(34),13,15,17(35),21,23,25(36),29,31-dodecaene-κ^6^<i>N</i>^3^,<i>N</i>^11^,<i>N</i>^19^,<i>N</i>^27^,<i>N</i>^33^,<i>N</i>^35^]dipalladium(II) bis(perchlorate) <i>N</i>,<i>N</i>-dimethylformamide disolvate methanol disolvate","","- C44 H68 Cl4 N8 O12 Pd2 -","- C44 H68 Cl4 N8 O12 Pd2 -","- C88 H136 Cl8 N16 O24 Pd4 -","2","0.5","IS5294","Oda, Kohei; Funahashi, Yasuhiro; Masuda, Hideki","Dichlorido[6,8,22,24,34,36-hexamethyl-33,35-diaza-3,11,19,27-tetraazoniapentacyclo[27.3.1.1^5,9^.1^13,17^.1^21,25^]hexatriaconta-1(33),5,7,9(34),13,15,17(35),21,23,25(36),29,31-dodecaene-κ^6^<i>N</i>^3^,<i>N</i>^11^,<i>N</i>^19^,<i>N</i>^27^,<i>N</i>^33^,<i>N</i>^35^]dipalladium(II) bis(perchlorate) <i>N</i>,<i>N</i>-dimethylformamide disolvate methanol disolvate","Acta Crystallographica Section E","2013","69","9","m520","m521","10.1107/S1600536813022666","","","0.7107","MoKα","","","0.0375","","","","0.0965","","","","","","1.08","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238511","22.3698","0.0011","22.4296","0.0016","15.3707","0.0007","90","","90","","90","","7712.2","0.8","170","2","170","2","","","","","","","","6","P n n 2","P 2 -2n","34","","Poly[[bis[μ~2~-1,2-bis(pyridin-4-yl)ethene-κ^2^<i>N</i>:<i>N</i>']bis(thiocyanato-κ<i>N</i>)cobalt(II)] 1,2-bis(pyridin-4-yl)ethene monosolvate dihydrate]","","- C38 H34 Co N8 O2 S2 -","- C38 H34 Co N8 O2 S2 -","- C304 H272 Co8 N64 O16 S16 -","8","2","IS5295","Wöhlert, Susanne; Jess, Inke; Näther, Christian","Poly[[bis[μ~2~-1,2-bis(pyridin-4-yl)ethene-κ^2^<i>N</i>:<i>N</i>']bis(thiocyanato-κ<i>N</i>)cobalt(II)] 1,2-bis(pyridin-4-yl)ethene monosolvate dihydrate]","Acta Crystallographica Section E","2013","69","9","m482","","10.1107/S1600536813021107","","","0.71073","MoKα","","0.0628","0.0462","","","0.1009","0.108","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238512","6.0108","0.0005","7.3394","0.0005","31.674","0.002","90","","90","","90","","1397.32","0.17","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","1,2-Bis(2-hydroxy-5-methylbenzylidene)hydrazine","2-{[2-(2-Hydroxy-5-methylbenzylidene)hydrazin-1-ylidene]methyl}-4-methylphenol","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C64 H64 N8 O8 -","4","1","IS5296","Saravanan, B.; Jayamani, A.; Sengottuvelan, N.; Chakkaravarthi, G.; Manivannan, V.","1,2-Bis(2-hydroxy-5-methylbenzylidene)hydrazine","Acta Crystallographica Section E","2013","69","9","o1394","o1395","10.1107/S160053681302148X","","","0.71073","MoKα","","0.0952","0.0503","","","0.128","0.1541","","","","","","1.022","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238513","10.5922","0.0005","8.2883","0.0003","19.1885","0.0009","90","","92.988","0.003","90","","1682.29","0.13","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Chloro-2-(4-methoxyphenyl)-4-phenylquinoline","","- C22 H16 Cl N O -","- C22 H16 Cl N O -","- C88 H64 Cl4 N4 O4 -","4","1","IS5297","Saravanan, B.; Thamilarasan, V.; Sengottuvelan, N.; Chakkaravarthi, G.; Manivannan, V.","6-Chloro-2-(4-methoxyphenyl)-4-phenylquinoline","Acta Crystallographica Section E","2013","69","9","o1463","","10.1107/S1600536813023295","","","0.71073","MoKα","","0.0592","0.0432","","","0.1105","0.1251","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238514","12.6138","0.0002","14.8745","0.0003","20.7862","0.0015","97.909","0.007","105.209","0.007","99.034","0.007","3650.7","0.3","85","2","85","2","","","","","","","","5","P -1","-P 1","2","","Bis(dimethylformamide)pentakis(μ-<i>N</i>,2-dioxidobenzene-1-carboximidato)tetrakis(1-methylimidazole)di-μ-propionato-pentamanganese(III)manganese(II)‒dimethylformamide‒methanol (1/0.24/1.36)","","- C65.264 H74.971 Mn6 N15.417 O22.43 -","- C65.264 H74.971 Mn6 N15.417 O22.43 -","- C130.528 H149.942 Mn12 N30.834 O44.86 -","2","1","JJ2172","Lutter, Jacob C.; Kampf, Jeff W.; Zeller, Matthias; Zaleski, Curtis M.","Bis(dimethylformamide)pentakis(μ-<i>N</i>,2-dioxidobenzene-1-carboximidato)tetrakis(1-methylimidazole)di-μ-propionato-pentamanganese(III)manganese(II)‒dimethylformamide‒methanol (1/0.24/1.36)","Acta Crystallographica Section E","2013","69","9","m483","m484","10.1107/S1600536813021314","","","1.54178","CuKα","","0.0707","0.0585","","","0.1553","0.1638","","","","","","1.093","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2238515","9.4901","0.0009","22.9466","0.0019","13.1776","0.0013","90","","97.978","0.006","90","","2841.9","0.5","100","0.5","100","0.5","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1',4,5-Tetrahydrotrispiro[1,3,2-diazaphosphole-2,2'-[1,3,5,2,4,6]triazatriphosphinine-4',6''-dibenzo[<i>d</i>,<i>f</i>][1,3,2]dioxaphosphepine-6',6'''-dibenzo[<i>d</i>,<i>f</i>][1,3,2]dioxaphosphepine] acetone monosolvate","","- C29 H28 N5 O5 P3 -","- C29 H28 N5 O5 P3 -","- C116 H112 N20 O20 P12 -","4","1","JJ2173","Fontenot, Krystal R.; Easson, Michael W.; Fronczek, Frank R.; Condon, Brian D.","1,1',4,5-Tetrahydrotrispiro[1,3,2-diazaphosphole-2,2'-[1,3,5,2,4,6]triazatriphosphinine-4',6''-dibenzo[<i>d</i>,<i>f</i>][1,3,2]dioxaphosphepine-6',6'''-dibenzo[<i>d</i>,<i>f</i>][1,3,2]dioxaphosphepine] acetone monosolvate","Acta Crystallographica Section E","2013","69","9","o1491","o1492","10.1107/S1600536813023830","","","1.54184","CuKα","","0.0452","0.0366","","","0.0973","0.1022","","","","","","1.079","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238516","18.854","0.002","13.937","0.002","19.249","0.002","90","","90.082","0.003","90","","5058","1","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(dimethyl sulfoxide-κ<i>O</i>)tetrakis(μ~2~-3,4,5-trimethoxybenzoato-κ^2^<i>O</i>:<i>O</i>')dizinc","","- C44 H56 O22 S2 Zn2 -","- C44 H56 O22 S2 Zn2 -","- C176 H224 O88 S8 Zn8 -","4","0.5","KJ2227","Deutsch, Diana; Zevaco, Thomas; Walter, Olaf","Bis(dimethyl sulfoxide-κ<i>O</i>)tetrakis(μ~2~-3,4,5-trimethoxybenzoato-κ^2^<i>O</i>:<i>O</i>')dizinc","Acta Crystallographica Section E","2013","69","9","m519","","10.1107/S1600536813023118","","","0.71073","MoKα","","0.1081","0.0647","","","0.1462","0.1642","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238517","8.9546","0.0001","9.0724","0.0001","10.6818","0.0002","79.556","0.001","75.42","0.001","83.451","0.001","823.79","0.02","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Fluazinam","3-Chloro-<i>N</i>-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2,6-dinitro-4-(trifluoromethyl)aniline","","- C13 H4 Cl2 F6 N4 O4 -","- C13 H4 Cl2 F6 N4 O4 -","- C26 H8 Cl4 F12 N8 O8 -","2","1","KJ2230","Jeon, Youngeun; Kim, Jineun; Lee, Sangjin; Kim, Tae Ho","Fluazinam","Acta Crystallographica Section E","2013","69","9","o1467","","10.1107/S1600536813023210","","","0.71073","MoKα","","0.0364","0.0323","","","0.0815","0.0845","","","","","","1.036","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238518","8.3432","0.0004","10.2446","0.0005","10.4543","0.0005","61.13","0.005","77.45","0.004","82.534","0.004","763.48","0.07","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","Ethyl (2<i>Z</i>)-3-oxo-2-(3,4,5-trimethoxybenzylidene)butanoate","","- C16 H20 O6 -","- C16 H20 O6 -","- C32 H40 O12 -","2","1","KJ2231","Zukerman-Schpector, Julio; Hino, Camila Lury; Moran, Paulo J. S.; de Paula, Bruno R. S.; Ng, Seik Weng; Tiekink, Edward R. T.","Ethyl (2<i>Z</i>)-3-oxo-2-(3,4,5-trimethoxybenzylidene)butanoate","Acta Crystallographica Section E","2013","69","9","o1474","","10.1107/S1600536813023374","","","1.54184","CuKα","","0.0354","0.034","","","0.0935","0.0948","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238519","10.616","0.002","13.006","0.003","9.0513","0.0018","90","","93.09","0.03","90","","1247.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dipotassium tetraaquabis(μ-citrato-κ^4^<i>O</i>:<i>O</i>',<i>O</i>'',<i>O</i>''')nickelate(II) tetrahydrate","","- C12 H26 K2 Ni2 O22 -","- C12 H26 K2 Ni2 O22 -","- C24 H52 K4 Ni4 O44 -","2","0.5","KP2456","Yao, Hua-Gang; Huang, Jia-Na; Deng, Run-Kang; Yao, Zhi-Bang","Dipotassium tetraaquabis(μ-citrato-κ^4^<i>O</i>:<i>O</i>',<i>O</i>'',<i>O</i>''')nickelate(II) tetrahydrate","Acta Crystallographica Section E","2013","69","9","m502","m503","10.1107/S1600536813022630","","","0.71073","MoKα","","0.0245","0.0226","","","0.0614","0.0626","","","","","","1.024","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238520","8.288","0.008","8.325","0.007","13.706","0.007","96.55","0.06","92.23","0.07","101.98","0.07","917.1","1.3","100","","100","","","","","","","","","4","P -1","-P 1","2","","6,8-Dichloro-4-oxochromene-3-carbaldehyde","","- C10 H4 Cl2 O3 -","- C10 H4 Cl2 O3 -","- C40 H16 Cl8 O12 -","4","2","LD2111","Ishikawa, Yoshinobu; Motohashi, Yuya","6,8-Dichloro-4-oxochromene-3-carbaldehyde","Acta Crystallographica Section E","2013","69","9","o1416","","10.1107/S1600536813022228","","","0.71069","MoKα","","","0.0758","","","","0.2121","","","","","","1.102","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238521","8.2663","0.0011","11.1661","0.0013","39.478","0.006","90","","90","","90","","3643.9","0.8","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(<i>E</i>,<i>Z</i>)-1-(4-Chlorophenyl)-5-phenyl-5-(phenylsulfanyl)penta-2,4-dien-1-one","","- C23 H17 Cl O S -","- C23 H17 Cl O S -","- C184 H136 Cl8 O8 S8 -","8","1","LD2112","Vologzhanina, Anna V.; Gusev, Dmitry M.; Golovanov, Alexander A.; Pisareva, Valentina S.","(<i>E</i>,<i>Z</i>)-1-(4-Chlorophenyl)-5-phenyl-5-(phenylsulfanyl)penta-2,4-dien-1-one","Acta Crystallographica Section E","2013","69","9","o1479","","10.1107/S160053681302312X","","","0.71073","MoKα","","0.1117","0.0491","","","0.0779","0.0995","","","","","","1.002","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238522","8.7879","0.0008","9.4844","0.0009","18.9207","0.0018","90","","90","","90","","1577","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 2-[(<i>tert</i>-butoxycarbonyl)amino]-3-(4-hydroxyphenyl)propanoate","","- C15 H21 N O5 -","- C15 H21 N O5 -","- C60 H84 N4 O20 -","4","1","LH5632","Li, Xiaokun","Methyl 2-[(<i>tert</i>-butoxycarbonyl)amino]-3-(4-hydroxyphenyl)propanoate","Acta Crystallographica Section E","2013","69","9","o1372","","10.1107/S160053681301979X","","","0.71073","MoKα","","0.0404","0.0388","","","0.1003","0.1015","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238523","5.638","0.004","16.16","0.011","16.798","0.012","90","","92.524","0.012","90","","1529","1.9","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Biphenyl-2,4,4',6-tetracarboxylic acid monohydrate","","- C16 H12 O9 -","- C16 H12 O9 -","- C64 H48 O36 -","4","1","LH5634","Wang, Ye-Nan; Zhao, Jun","Biphenyl-2,4,4',6-tetracarboxylic acid monohydrate","Acta Crystallographica Section E","2013","69","9","o1373","","10.1107/S1600536813019624","","","0.71073","MoKα","","0.0581","0.0524","","","0.1441","0.1522","","","","","","1.022","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238524","7.7347","0.0005","8.5151","0.0008","9.3913","0.0007","64.388","0.004","68.435","0.003","79.06","0.005","518.36","0.07","180","1","180","2","","","","","","","","5","P -1","-P 1","2","Bis(triethylammonium) chloranilate","Bis(triethylammonium) 2,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,4-diolate","","- C18 H32 Cl2 N2 O4 -","- C18 H32 Cl2 N2 O4 -","- C18 H32 Cl2 N2 O4 -","1","0.5","LH5635","Gotoh, Kazuma; Maruyama, Shinpei; Ishida, Hiroyuki","Bis(triethylammonium) chloranilate","Acta Crystallographica Section E","2013","69","9","o1400","","10.1107/S1600536813021405","","","0.71075","MoKα","","0.0503","0.0436","","","0.1158","0.121","","","","","","1.058","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238525","10.9292","0.0008","10.9332","0.0006","13.7002","0.0013","90","","107.939","0.009","90","","1557.5","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Amino-1<i>H</i>-pyrazol-2-ium trifluoroacetate","","- C5 H6 F3 N3 O2 -","- C5 H6 F3 N3 O2 -","- C40 H48 F24 N24 O16 -","8","2","LH5637","Yamuna, T. S.; Jasinski, Jerry P.; Scadova, Derek R.; Yathirajan, H. S.; Kaur, Manpreet","3-Amino-1<i>H</i>-pyrazol-2-ium trifluoroacetate","Acta Crystallographica Section E","2013","69","9","o1425","o1426","10.1107/S1600536813022204","","","1.5418","CuKα","","0.0668","0.048","","","0.1204","0.1358","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238526","6.569","0.0007","10.1342","0.001","16.9357","0.0019","90","","90","","90","","1127.4","0.2","150","2","150","2","","","","","","","","5","P 21 n b","P -2bc 2a","33","","2-Hydroxymethyl-1,3-dimethyl-1<i>H</i>-benzimidazol-3-ium iodide","","- C10 H13 I N2 O -","- C10 H13 I N2 O -","- C40 H52 I4 N8 O4 -","4","1","LH5638","Said, Mohamed El Hadi; Bouacida, Sofiane; Merazig, Hocine; Belfaitah, Ali; Chibani, Aissa; Bouraiou, Abdelmalek","2-Hydroxymethyl-1,3-dimethyl-1<i>H</i>-benzimidazol-3-ium iodide","Acta Crystallographica Section E","2013","69","9","o1429","o1430","10.1107/S1600536813022307","","","0.71073","MoKα","","0.0384","0.0267","","","0.0618","0.068","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238527","17.077","0.003","17.816","0.003","8.5107","0.0017","90","","96.01","0.003","90","","2575.1","0.8","98","2","98","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{[Ethyl(pyridin-4-ylmethyl)carbamothioyl]sulfanido-κ^2^<i>S</i>,<i>S</i>'}(1,4,7,10,13,16-hexaoxacyclooctadecane-κ^6^<i>O</i>)potassium","","- C21 H35 K N2 O6 S2 -","- C21 H35 K N2 O6 S2 -","- C84 H140 K4 N8 O24 S8 -","4","1","LH5639","Arman, Hadi D.; Poplaukhin, Pavel; Tiekink, Edward R. T.","{[Ethyl(pyridin-4-ylmethyl)carbamothioyl]sulfanido-κ^2^<i>S</i>,<i>S</i>'}(1,4,7,10,13,16-hexaoxacyclooctadecane-κ^6^<i>O</i>)potassium","Acta Crystallographica Section E","2013","69","9","m479","m480","10.1107/S1600536813021569","","","0.71069","MoKα","","0.0445","0.0397","","","0.0968","0.1002","","","","","","1.093","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238528","9.8347","0.0006","11.1775","0.0005","13.1287","0.0008","90","","110.614","0.007","90","","1350.8","0.15","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,5-Di-<i>tert</i>-butyl-2-hydroxybenzaldehyde","","- C15 H22 O2 -","- C15 H22 O2 -","- C60 H88 O8 -","4","1","LH5640","Ng, Seik Weng","A second monoclinic polymorph of 3,5-di-<i>tert</i>-butyl-2-hydroxybenzaldehyde","Acta Crystallographica Section E","2013","69","9","o1427","","10.1107/S1600536813022010","","","0.71073","MoKα","","0.0598","0.0457","","","0.1097","0.1189","","","","","","1.016","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238529","10.8734","0.0005","11.2416","0.0005","7.0822","0.0003","90","","75.601","0.002","90","","838.5","0.06","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H9 N5 O S -","- C5 H9 N5 O S -","- C20 H36 N20 O4 S4 -","4","1","LH5642","Houari, Benayad; Louhibi, Samira; Boukli-Hacene, Leila; Roisnel, Thierry; Taleb, Mustapha","(<i>E</i>)-2-[(1<i>H</i>-Imidazol-4-yl)methylidene]hydrazinecarbothioamide monohydrate","Acta Crystallographica Section E","2013","69","9","o1469","","10.1107/S1600536813022927","","","0.71073","MoKα","","0.0337","0.0304","","","","0.0831","","","","","","1.056","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238530","10.0877","0.0014","8.1922","0.001","20.57","0.002","90","","102.589","0.008","90","","1659","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[{μ-<i>N</i>'-[2-(carboxylatomethoxy)benzylidene]-2-hydroxybenzohydrazidato}(methanol-κ<i>O</i>)nickel(II)]","","- C17 H16 N2 Ni O6 -","- C17 H16 N2 Ni O6 -","- C68 H64 N8 Ni4 O24 -","4","1","LH5646","Luo, Feihua; Du, Huirong; Yang, Li; Zhang, Ping","<i>catena</i>-Poly[{μ-<i>N</i>'-[2-(carboxylatomethoxy)benzylidene]-2-hydroxybenzohydrazidato}(methanol-κ<i>O</i>)nickel(II)]","Acta Crystallographica Section E","2013","69","9","m523","","10.1107/S1600536813024161","","","0.71073","MoKα","","0.0336","0.0293","","","0.0693","0.073","","","","","","1.079","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238531","8.107","0.005","11.043","0.005","12.573","0.005","99.766","0.005","101.878","0.005","105.335","0.005","1031.9","0.9","150","","150","","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-2-phenylacetato-κ^2^<i>O</i>:<i>O</i>')bis{[4-(dimethylamino)pyridine-κ<i>N</i>^1^]cobalt(II)}","","- C46 H48 Co2 N4 O8 -","- C46 H48 Co2 N4 O8 -","- C46 H48 Co2 N4 O8 -","1","0.5","LR2113","Benslimane, Meriem; Redjel, Yasmine Kheira; Dénès, Georges; Merazig, Hocine","Tetrakis(μ-2-phenylacetato-κ^2^<i>O</i>:<i>O</i>')bis{[4-(dimethylamino)pyridine-κ<i>N</i>^1^]cobalt(II)}","Acta Crystallographica Section E","2013","69","9","m517","m518","10.1107/S1600536813023258","","","0.71073","MoKα","","0.0281","0.025","","","0.0585","0.0601","","","","","","1.054","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238532","18.572","0.003","11.025","0.002","14.975","0.003","90","","96.28","0.02","90","","3047.8","1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Amino-6-methylpyridinium <i>trans</i>-diaquadioxalatochromate(III) monohydrate","","- C10 H15 Cr N2 O11 -","- C10 H15 Cr N2 O11 -","- C80 H120 Cr8 N16 O88 -","8","1","MW2113","Dridi, Rihab; Namouchi Cherni, Saoussen; Zid, Mohamed Faouzi; Driss, Ahmed","2-Amino-6-methylpyridinium <i>trans</i>-diaquadioxalatochromate(III) monohydrate","Acta Crystallographica Section E","2013","69","9","m489","m490","10.1107/S1600536813022058","","","0.71073","MoKα","","0.0468","0.0398","","","0.1071","0.1122","","","","","","1.071","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238533","9.1621","0.0003","11.3598","0.0004","13.1879","0.0005","74.017","0.003","85.995","0.003","77.683","0.003","1289.07","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(2<i>E</i>)-3-(2-Chloro-7-methylquinolin-3-yl)-1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)prop-2-en-1-one ethanol monosolvate","","- C31 H26 Cl2 N2 O2 -","- C31 H26 Cl2 N2 O2 -","- C62 H52 Cl4 N4 O4 -","2","1","MW2114","Prasath, R.; Sarveswari, S.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-3-(2-Chloro-7-methylquinolin-3-yl)-1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)prop-2-en-1-one ethanol monosolvate","Acta Crystallographica Section E","2013","69","9","o1414","o1415","10.1107/S1600536813022022","","","1.54184","CuKα","","0.0465","0.0439","","","0.1192","0.1217","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238534","9.1536","0.0002","12.6562","0.0002","19.3939","0.0004","84.674","0.001","79.667","0.001","72.405","0.001","2105.15","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Cyclohexyl-2-(4-fluorophenyl)-3-phenylsulfinyl-1-benzofuran","","- C26 H23 F O2 S -","- C26 H23 F O2 S -","- C104 H92 F4 O8 S4 -","4","2","MW2115","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Cyclohexyl-2-(4-fluorophenyl)-3-phenylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2013","69","9","o1452","","10.1107/S1600536813022678","","","0.71073","MoKα","","0.0444","0.0371","","","0.0944","0.1001","","","","","","1.026","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238535","6.278","0.003","7.9","0.003","21.5","0.007","90","","90","","90","","1066.3","0.7","298","1","298","1","101","2","","","","","","4","P 2 21 21","P 2bc 2","18","","2,5-Bis{[(-)-(<i>S</i>)-1-(4-methylphenyl)ethyl]iminomethyl}thiophene","","- C24 H26 N2 S -","- C24 H26 N2 S -","- C48 H52 N4 S2 -","2","0.5","NC2315","Bernès, Sylvain; Hernández-Téllez, Guadalupe; Sharma, Manju; Portillo-Moreno, Oscar; Gutiérrez, René","2,5-Bis{[(‒)-(<i>S</i>)-1-(4-methylphenyl)ethyl]iminomethyl}thiophene","Acta Crystallographica Section E","2013","69","9","o1428","","10.1107/S1600536813021685","","","0.71073","MoKα","","0.0781","0.0519","","","0.1275","0.1554","","","","","","1.063","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238536","5.5384","0.0005","9.2717","0.0009","16.0483","0.0014","75.508","0.005","89.474","0.005","81.625","0.005","789.04","0.13","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3-Ethyl-<i>cis</i>-2,6-diphenylpiperidine","","- C19 H23 N -","- C19 H23 N -","- C38 H46 N2 -","2","1","NG5337","Maheshwaran, V.; Abdul Basheer, S.; Akila, A.; Ponnuswamy, S.; Ponnuswamy, M. N.","3-Ethyl-<i>cis</i>-2,6-diphenylpiperidine","Acta Crystallographica Section E","2013","69","9","o1441","","10.1107/S1600536813021417","","","0.71073","MoKα","","0.0547","0.0429","","","0.1133","0.1243","","","","","","1.031","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238537","19.053","0.001","8.0559","0.0005","16.1952","0.0009","90","","90","","90","","2485.8","0.2","293","","293","","","","","","","","","5","C m c a","-C 2ac 2","64","","<i>catena</i>-Poly[[bis(thiocyanato-κ<i>N</i>)iron(II)]-bis(μ-dipyrazin-2-yl disulfide-κ^2^<i>N</i>^4^:<i>N</i>^4'^)]","","- C18 H12 Fe N10 S6 -","- C18 H12 Fe N10 S6 -","- C72 H48 Fe4 N40 S24 -","4","","NR2047","Wöhlert, Susanne; Jess, Inke; Näther, Christian","<i>catena</i>-Poly[[bis(thiocyanato-κ<i>N</i>)iron(II)]-bis(μ-dipyrazin-2-yl disulfide-κ^2^<i>N</i>^4^:<i>N</i>^4'^)]","Acta Crystallographica Section E","2013","69","9","m487","","10.1107/S1600536813021958","","","0.71073","MoKα","","0.0607","0.0505","","","0.1079","0.1127","","","","","","1.152","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238538","6.043","0.002","11.716","0.004","12.217","0.005","117.99","0.02","92","0.02","97.42","0.02","752.9","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-(4-Chlorophenylsulfinyl)-2,4,7-trimethyl-1-benzofuran","","- C17 H15 Cl O2 S -","- C17 H15 Cl O2 S -","- C34 H30 Cl2 O4 S2 -","2","1","PK2491","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","3-(4-Chlorophenylsulfinyl)-2,4,7-trimethyl-1-benzofuran","Acta Crystallographica Section E","2013","69","9","o1383","","10.1107/S160053681302117X","","","0.71073","MoKα","","0.0549","0.0401","","","0.113","0.1278","","","","","","1.119","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238539","5.773","0.005","9.939","0.005","13.268","0.005","90","","95.876","0.005","90","","757.3","0.8","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2<i>E</i>,4<i>E</i>)-Ethyl 5-(2,4-dichlorophenylsulfonyl)penta-2,4-dienoate","","- C13 H12 Cl2 O4 S -","- C13 H12 Cl2 O4 S -","- C26 H24 Cl4 O8 S2 -","2","1","PV2638","Sankar, U.; Sabari, V.; Mahalakshmi, S.; Balasubramanian, K. K.; Aravindhan, S.","(2<i>E</i>,4<i>E</i>)-Ethyl 5-(2,4-dichlorophenylsulfonyl)penta-2,4-dienoate","Acta Crystallographica Section E","2013","69","9","o1387","","10.1107/S1600536813021429","","","0.71073","MoKα","","0.0332","0.0298","","","0.0709","0.074","","","","","","1.055","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238540","7.1354","0.0003","10.1627","0.0005","17.0127","0.0008","78.758","0.004","79.544","0.004","84.042","0.004","1186.91","0.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(2<i>E</i>)-3-(2-Chlorobenzo[<i>h</i>]quinolin-3-yl)-1-(2-methyl-4-phenylquinolin-3-yl)prop-2-en-1-one","","- C32 H21 Cl N2 O -","- C32 H21 Cl N2 O -","- C64 H42 Cl2 N4 O2 -","2","1","PV2642","Prasath, R.; Sarveswari, S.; Ng, Seik Weng; Tiekink, Edward R. T.","(2<i>E</i>)-3-(2-Chlorobenzo[<i>h</i>]quinolin-3-yl)-1-(2-methyl-4-phenylquinolin-3-yl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","9","o1393","","10.1107/S1600536813021545","","","1.54184","CuKα","","0.0372","0.034","","","0.0914","0.0947","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238541","9.3668","0.0003","9.9785","0.0003","18.6303","0.0005","89.724","0.001","75.967","0.001","63.236","0.001","1497.37","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2-(4-Bromobenzoyl)-1-ferrocenylspiro[11<i>H</i>-pyrrolidizine-3,11'-indeno[1,2-<i>b</i>]quinoxaline]","","- C38 H30 Br Fe N3 O -","- C38 H30 Br Fe N3 O -","- C76 H60 Br2 Fe2 N6 O2 -","2","1","PV2643","Suhitha, Sivasubramanian; Gunasekaran, Krishnaswamy; Sureshbabu, Adukamparai Rajukrishnan; Raghunathan, Raghavachary; Velmurugan, Devadasan","2-(4-Bromobenzoyl)-1-ferrocenylspiro[11<i>H</i>-pyrrolidizine-3,11'-indeno[1,2-<i>b</i>]quinoxaline]","Acta Crystallographica Section E","2013","69","9","m512","m513","10.1107/S1600536813023064","","","0.71073","MoKα","","0.0653","0.0529","","","0.1287","0.1371","","","","","","1.043","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238542","10.889","0.002","10.11","0.002","17.01","0.003","90","","90","","90","","1872.6","0.6","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","2,3-Xylidinium nitrate","2,3-Dimethylanilinium nitrate","","- C8 H12 N2 O3 -","- C8 H12 N2 O3 -","- C64 H96 N16 O24 -","8","1","PV2645","Kefi, Chourouk; Marouani, Houda; Rzaigui, Mohamed","2,3-Xylidinium nitrate","Acta Crystallographica Section E","2013","69","9","o1475","","10.1107/S1600536813023465","","","0.56083","AgKα","","0.3175","0.0597","","","0.1084","0.1782","","","","","","0.86","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238543","8.285","0.002","8.987","0.002","10.665","0.003","68.58","0.02","78.95","0.02","88.87","0.02","724.4","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","Lacinilene C 7-methyl ether","1-Hydroxy-7-methoxy-1,6-dimethyl-4-(propan-2-yl)naphthalen-2(1<i>H</i>)-one","","- C16 H20 O3 -","- C16 H20 O3 -","- C32 H40 O6 -","2","1","RK2406","Uzbekov, Vyacheslav V.; Talipov, Samat A.; Ibragimov, Bakhtiyar T.; Stipanovic, Robert D.; Bell, Alois A.","Lacinilene C 7-methyl ether","Acta Crystallographica Section E","2013","69","9","o1392","","10.1107/S1600536813021430","","","1.54184","CuKα","","0.0801","0.0513","","","0.1503","0.1708","","","","","","1.061","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238544","8.65","0.005","16.952","0.005","14.438","0.005","90","","97.161","0.005","90","","2100.6","1.5","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4'-(1<i>H</i>-Imidazol-2-yl)-3'-[(1<i>H</i>-indol-3-yl)carbonyl]-1'-methyl-2-oxospiro[indoline-3,2'-pyrrolidine]-3'-carbonitrile 0.15-hydrate","","- C25 H20.3 N6 O2.15 -","- C25 H20.3 N6 O2.15 -","- C100 H81.2 N24 O8.6 -","4","1","RK2411","Inglebert, S. Antony; Arun, Yuvaraj; Sethusankar, K.; Perumal, Paramasivam T.","4'-(1<i>H</i>-Imidazol-2-yl)-3'-[(1<i>H</i>-indol-3-yl)carbonyl]-1'-methyl-2-oxospiro[indoline-3,2'-pyrrolidine]-3'-carbonitrile 0.15-hydrate","Acta Crystallographica Section E","2013","69","9","o1481","","10.1107/S1600536813023246","","","0.71073","MoKα","","0.0549","0.0401","","","0.1002","0.1104","","","","","","1.026","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2238545","11.0114","0.0013","13.6647","0.0018","13.923","0.0018","61.554","0.003","80.252","0.003","89.782","0.004","1808.3","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","2-(Adamantan-1-yl)-<i>N</i>-(6-methoxy-1,3-benzothiazol-2-yl)acetamide","","- C20 H24 N2 O2 S -","- C20 H24 N2 O2 S -","- C80 H96 N8 O8 S4 -","4","2","RK2412","Bunev, Alexander S.; Sklyuev, Prokofij V.; Ostapenko, Gennady I.; Purygin, Petr P.; Khrustalev, Victor N.","2-(Adamantan-1-yl)-<i>N</i>-(6-methoxy-1,3-benzothiazol-2-yl)acetamide","Acta Crystallographica Section E","2013","69","9","o1472","","10.1107/S1600536813023313","","","0.71073","MoKα","","0.0983","0.0494","","","0.102","0.1151","","","","","","0.91","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238546","9.3555","0.0009","3.6432","0.0005","6.6887","0.0007","90","","111.669","0.006","90","","211.87","0.04","298","2","298","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Lithium vanado(V)molybdate(VI)","","- Li Mo O6 V -","- Li Mo O6 V -","- Li2 Mo2 O12 V2 -","2","0.25","RU2052","Ezzine Yahmed, Safa; Nasri, Rawia; Zid, Mohamed Faouzi; Driss, Ahmed","Lithium vanado(V)molybdate(VI), Li[VMoO~6~]","Acta Crystallographica Section E","2013","69","9","i57","i58","10.1107/S1600536813022411","","","0.71073","MoKα","","0.0179","0.0175","","","0.0519","0.052","","","","","","1.158","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238547","7.1986","0.0015","7.7611","0.0011","15.635","0.004","77.035","0.016","79.311","0.019","81.845","0.014","831.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(2,3-Dimethylphenyl)piperazine-1,4-diium tetrachloridocuprate(II)","","- C12 H20 Cl4 Cu N2 -","- C12 H20 Cl4 Cu N2 -","- C24 H40 Cl8 Cu2 N4 -","2","1","RU2053","Ben Mabrouk, Safa; Ameur, Iness; Abid, Sonia; Rzaigui, Mohamed","1-(2,3-Dimethylphenyl)piperazine-1,4-diium tetrachloridocuprate(II)","Acta Crystallographica Section E","2013","69","9","m485","","10.1107/S1600536813021454","","","0.56087","AgKα","","0.112","0.0495","","","0.1092","0.1293","","","","","","0.998","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238548","13.072","0.003","15.136","0.003","17.192","0.006","90","","125.14","0.02","90","","2781.6","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(4-aminopyridine){2,2'-[1,2-phenylenebis(nitrilomethanylylidene)]diphenolato}cobalt(III) nitrate","","- C30 H26 Co N7 O5 -","- C30 H26 Co N7 O5 -","- C120 H104 Co4 N28 O20 -","4","1","RZ5078","Dharmalingam, Sivanesan; Yoon, Sungho","Bis(4-aminopyridine){2,2'-[1,2-phenylenebis(nitrilomethanylylidene)]diphenolato}cobalt(III) nitrate","Acta Crystallographica Section E","2013","69","9","m495","m496","10.1107/S1600536813020953","","","0.71073","MoKα","","0.1646","0.0496","","","0.0592","0.0843","","","","","","0.707","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238549","9.36677","0.00018","15.8434","0.0003","16.1452","0.0003","90","","90","","90","","2395.97","0.08","291","2","291.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2-[2-(5-Bromothiophen-2-yl)-4,5-diphenyl-1<i>H</i>-imidazol-1-yl]-3-phenylpropan-1-ol","","- C28 H23 Br N2 O S -","- C28 H23 Br N2 O S -","- C112 H92 Br4 N8 O4 S4 -","4","1","RZ5079","Gao, Jie; Yang, Liangru; Mai, Wenpeng; Yuan, Jinwei; Mao, Pu","2-[2-(5-Bromothiophen-2-yl)-4,5-diphenyl-1<i>H</i>-imidazol-1-yl]-3-phenylpropan-1-ol","Acta Crystallographica Section E","2013","69","9","o1379","","10.1107/S1600536813021016","","","1.5418","CuKα","","0.0355","0.0332","","","0.0828","0.0849","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238550","9.2308","0.0003","12.5991","0.0004","14.3043","0.0004","89.954","0.002","89.052","0.002","79.233","0.002","1634.07","0.09","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","2-(3-Cyano-4-methyl-5,5-diphenyl-5<i>H</i>-furan-2-ylidene)malononitrile","","- C21 H13 N3 O -","- C21 H13 N3 O -","- C84 H52 N12 O4 -","4","2","RZ5081","Bhuiyan, M. Delower H.; Gainsford, Graeme J.; Kay, Andrew; Anderson, Jack","2-(3-Cyano-4-methyl-5,5-diphenyl-5<i>H</i>-furan-2-ylidene)malononitrile","Acta Crystallographica Section E","2013","69","9","o1365","o1366","10.1107/S1600536813020849","","","0.71073","MoKα","","0.0679","0.0454","","","0.1073","0.1189","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238551","5.0479","0.0008","19.738","0.003","9.2428","0.0015","90","","91.432","0.004","90","","920.6","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,6-Difluoro-<i>N</i>-(prop-2-ynyl)benzamide","","- C10 H7 F2 N O -","- C10 H7 F2 N O -","- C40 H28 F8 N4 O4 -","4","1","RZ5082","Hussain, Zahid; Hussain, Ejaz; Siddiqui, Hina; Choudhary, M. Iqbal; Yousuf, Sammer","2,6-Difluoro-<i>N</i>-(prop-2-ynyl)benzamide","Acta Crystallographica Section E","2013","69","9","o1440","","10.1107/S1600536813021120","","","0.71073","MoKα","","0.0547","0.0402","","","0.0895","0.0994","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238552","10.245","0.003","12.72","0.003","15.222","0.004","69.523","0.004","75.854","0.005","66.565","0.004","1692.2","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(4-Fluorophenyl)thiourea‒1,10-phenanthroline (1/1)","","- C19 H15 F N4 S -","- C19 H15 F N4 S -","- C76 H60 F4 N16 S4 -","4","2","SJ5347","Yamin, Bohari M.; Salem, Halima F.; Yusoff, Siti Fairus M.","(4-Fluorophenyl)thiourea‒1,10-phenanthroline (1/1)","Acta Crystallographica Section E","2013","69","9","o1468","","10.1107/S1600536813023222","","","0.71073","MoKα","","0.0565","0.0409","","","0.1083","0.1211","","","","","","1.027","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238553","9.8965","0.0002","15.2329","0.0003","20.1122","0.0004","90","","90","","90","","3031.96","0.1","100","","100","","","","","","","","","3","P b c a","-P 2ac 2ab","61","Pruniflorone N","3,6,11-Trihydroxy-1,1-dimethyl-2,3-dihydrochromeno[2,3-<i>f</i>]chromen-7-one monohydrate","","- C18 H18 O7 -","- C18 H18 O7 -","- C144 H144 O56 -","8","1","SJ5348","Boonnak, Nawong; Chantrapromma, Suchada; Fun, Hoong-Kun","Racemic 2'-hydroxy-4',4'-dimethylpyran-1,5-dihydroxyxanthone monohydrate","Acta Crystallographica Section E","2013","69","9","o1456","o1457","10.1107/S1600536813021223","","","0.71073","MoKα","","0.0581","0.0519","","","0.1405","0.1453","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238554","13.6267","0.0004","10.3769","0.0002","26.9387","0.0006","90","","91.361","0.002","90","","3808.14","0.16","291.15","","291.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1'-Methylenebis[3-(2,6-diisopropylphenyl)-3,4,5,6-tetrahydropyrimidin-1-ium] dibromide ethanol monosolvate monohydrate","","- C35 H58 Br2 N4 O2 -","- C35 H58 Br2 N4 O2 -","- C140 H232 Br8 N16 O8 -","4","1","SU2619","Bian, Huanyu; Yang, Liangru; Yuan, Jinwei; Mao, Pu; Xiao, Yongmei","1,1'-Methylenebis[3-(2,6-diisopropylphenyl)-3,4,5,6-tetrahydropyrimidin-1-ium] dibromide ethanol monosolvate monohydrate","Acta Crystallographica Section E","2013","69","9","o1377","o1378","10.1107/S1600536813021004","","","0.7107","MoKα","","0.0797","0.0468","","","0.0889","0.1004","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238555","24.9396","0.0006","6.9158","0.0002","16.2974","0.0005","90","","94.608","0.001","90","","2801.85","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(2-hydroxyethyl)ammonium picrate","","- C10 H14 N4 O9 -","- C10 H14 N4 O9 -","- C80 H112 N32 O72 -","8","2","SU2621","Nagapandiselvi, Perumal; Gopalakrishnan, Rengasamy","Bis(2-hydroxyethyl)ammonium picrate","Acta Crystallographica Section E","2013","69","9","o1455","","10.1107/S1600536813021697","","","0.71073","MoKα","","0.0678","0.045","","","0.113","0.1257","","","","","","1.033","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238556","8.533","0.005","24.952","0.005","17.641","0.005","90","0.005","101.277","0.005","90","0.005","3684","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>cis</i>-Diaquatetrakis(1-butyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) dichloride","","- C28 H52 Cl2 N8 Ni O2 -","- C28 H52 Cl2 N8 Ni O2 -","- C112 H208 Cl8 N32 Ni4 O8 -","4","1","SU2624","Kannan, P. S.; Ganeshraja, A. S.; Rajkumar, K.; Anbalagan, K.; SubbiahPandi, A.","<i>cis</i>-Diaquatetrakis(1-butyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) dichloride","Acta Crystallographica Section E","2013","69","9","m498","m499","10.1107/S1600536813022496","","","0.71073","MoKα","","0.1198","0.0767","","","0.1944","0.2327","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238557","8.2587","0.0003","8.7679","0.0004","10.9346","0.0005","101.616","0.002","90.426","0.002","91.93","0.002","775.05","0.06","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","(4<i>S</i>*)-2-Methylamino-3-nitro-4-(4-nitrophenyl)-5,6,7,8-tetrahydro-4<i>H</i>-chromen-5-one","","- C16 H15 N3 O6 -","- C16 H15 N3 O6 -","- C32 H30 N6 O12 -","2","1","SU2627","Narayanan, P.; Kamalraja, Jayabal; Perumal, Paramasivam T.; Sethusankar, K.","(4<i>S</i>*)-2-Methylamino-3-nitro-4-(4-nitrophenyl)-5,6,7,8-tetrahydro-4<i>H</i>-chromen-5-one","Acta Crystallographica Section E","2013","69","9","o1380","o1381","10.1107/S1600536813021181","","","0.71073","MoKα","","0.0525","0.0444","","","0.1178","0.1261","","","","","","1.038","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238558","7.5488","0.0006","9.9706","0.0007","12.9887","0.001","106.783","0.004","93.022","0.004","102.347","0.004","907.45","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-Chloro-1-(3,3-dimethyl-2,6-diphenylpiperidin-1-yl)ethanone","","- C21 H24 Cl N O -","- C21 H24 Cl N O -","- C42 H48 Cl2 N2 O2 -","2","1","SU2628","Prathebha, K.; Revathi, B. K.; Usha, G.; Ponnuswamy, S.; Abdul Basheer, S.","2-Chloro-1-(3,3-dimethyl-2,6-diphenylpiperidin-1-yl)ethanone","Acta Crystallographica Section E","2013","69","9","o1424","","10.1107/S1600536813022289","","","0.71073","MoKα","","0.054","0.0455","","","0.1228","0.1314","","","","","","1.016","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238559","10.772","0.0002","11.4243","0.0003","14.3507","0.0004","107.244","0.002","105.648","0.002","93.2742","0.0019","1606","0.07","150","2","150","","","","","","","","","7","P -1","-P 1","2","","Bis(triphenyl-λ^5^-phosphanylidene)ammonium chloride‒boric acid (1/1)","","- C36 H33 B Cl N O3 P2 -","- C36 H33 B Cl N O3 P2 -","- C72 H66 B2 Cl2 N2 O6 P4 -","2","1","SU2629","Correia Bicho, Bruno A.; Bolli, Christoph; Jenne, Carsten; Seeger, Helene","A second polymorph of bis(triphenyl-λ^5^-phosphanylidene)ammonium chloride‒boric acid adduct","Acta Crystallographica Section E","2013","69","9","o1435","o1436","10.1107/S1600536813020886","","","0.71073","MoKα","","0.0582","0.0405","","","0.0898","0.0984","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238560","9.5687","0.0003","10.0175","0.0003","17.1768","0.0005","80.367","0.002","75.43","0.001","65.293","0.001","1444.02","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","6-Ferrocenoyl-7-phenylspiro[hexahydropyrrolo[1,2-<i>c</i>][1,3]thiazole-5,11'-indeno[1,2-<i>b</i>]quinoxaline]","","- C37 H29 Fe N3 O S -","- C37 H29 Fe N3 O S -","- C74 H58 Fe2 N6 O2 S2 -","2","1","SU2630","Suhitha, Sivasubramanian; Gunasekaran, Krishnaswamy; Sureshbabu, Adukamparai Rajukrishnan; Raghunathan, Raghavachary; Velmurugan, Devadasan","6-Ferrocenoyl-7-phenylspiro[hexahydropyrrolo[1,2-<i>c</i>][1,3]thiazole-5,11'-indeno[1,2-<i>b</i>]quinoxaline]","Acta Crystallographica Section E","2013","69","9","m500","","10.1107/S1600536813022605","","","0.71073","MoKα","","0.0394","0.0336","","","0.0892","0.0937","","","","","","1.023","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238561","8.2409","0.0008","16.1702","0.0015","15.37","0.0015","90","","95.775","0.005","90","","2037.8","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-{2-[(<i>E</i>)-2-(2-Nitrophenyl)ethenyl]-1-phenylsulfonyl-1<i>H</i>-indol-3-yl}ethanone","","- C24 H18 N2 O5 S -","- C24 H18 N2 O5 S -","- C96 H72 N8 O20 S4 -","4","1","SU2631","Karthikeyan, S.; Sethusankar, K.; Saravanan, Velu; Mohanakrishnan, Arasambattu K.","1-{2-[(<i>E</i>)-2-(2-Nitrophenyl)ethenyl]-1-phenylsulfonyl-1<i>H</i>-indol-3-yl}ethanone","Acta Crystallographica Section E","2013","69","9","o1422","o1423","10.1107/S1600536813022241","","","0.71073","MoKα","","0.0549","0.041","","","0.1086","0.118","","","","","","1.02","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238562","8.1947","0.0015","14.384","0.003","18.795","0.003","90","","90.963","0.009","90","","2215.1","0.7","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(4-Chloro-2-nitrophenyl)-9-phenylsulfonyl-9<i>H</i>-carbazole-3-carbaldehyde","","- C25 H15 Cl N2 O6 S -","- C25 H15 Cl N2 O6 S -","- C100 H60 Cl4 N8 O24 S4 -","4","1","SU2632","Gopinath, S.; Sethusankar, K.; Ramalingam, Bose Muthu; Mohanakrishnan, Arasambattu K.","2-(4-Chloro-2-nitrophenyl)-9-phenylsulfonyl-9<i>H</i>-carbazole-3-carbaldehyde","Acta Crystallographica Section E","2013","69","9","o1420","o1421","10.1107/S1600536813022253","","","0.71073","MoKα","","0.0786","0.0534","","","0.1468","0.1721","","","","","","1.046","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238563","7.1767","0.0007","10.1743","0.001","17.115","0.0017","86.172","0.003","85.275","0.002","80.963","0.004","1228.2","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>'-[(<i>E</i>)-1-(2-Hydroxyphenyl)ethylidene]pyrazine-2-carbohydrazide","","- C13 H12 N4 O2 -","- C13 H12 N4 O2 -","- C52 H48 N16 O8 -","4","2","SU2634","Hameed, Shahid; Ahmad, Mushtaq; Tahir, M. Nawaz; Israr, Muhammad; Anwar, Muhammad","<i>N</i>'-[(<i>E</i>)-1-(2-Hydroxyphenyl)ethylidene]pyrazine-2-carbohydrazide","Acta Crystallographica Section E","2013","69","9","o1419","","10.1107/S1600536813022137","","","0.71073","MoKα","","0.1149","0.0502","","","0.1089","0.1383","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238564","8.7097","0.0002","12.6456","0.0003","13.5477","0.0004","83.865","0.001","79.008","0.001","86.776","0.001","1455.39","0.06","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","6-Ferrocenoyl-7-(4-fluorophenyl)spiro[hexahydropyrrolo[1,2-<i>c</i>][1,3]thiazole-5,11'-indeno[1,2-<i>b</i>]quinoxaline]","","- C37 H28 F Fe N3 O S -","- C37 H28 F Fe N3 O S -","- C74 H56 F2 Fe2 N6 O2 S2 -","2","1","SU2635","Suhitha, Sivasubramanian; Gunasekaran, Krishnaswamy; Gavaskar, Deivasigamani; Raghunathan, Raghavachary; Velmurugan, Devadasan","6-Ferrocenoyl-7-(4-fluorophenyl)spiro[hexahydropyrrolo[1,2-<i>c</i>][1,3]thiazole-5,11'-indeno[1,2-<i>b</i>]quinoxaline]","Acta Crystallographica Section E","2013","69","9","m501","","10.1107/S1600536813022617","","","0.71073","MoKα","","0.0425","0.035","","","0.0917","0.0965","","","","","","1.055","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238565","15.1363","0.0005","15.9252","0.0006","10.644","0.0006","90","","133.053","0.001","90","","1874.83","0.14","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","5-Cyclohexyl-3-ethylsulfinyl-2-(3-fluorophenyl)-1-benzofuran","","- C22 H23 F O2 S -","- C22 H23 F O2 S -","- C88 H92 F4 O8 S4 -","4","1","SU2636","Choi, Hong Dae; Seo, Pil Ja; Lee, Uk","5-Cyclohexyl-3-ethylsulfinyl-2-(3-fluorophenyl)-1-benzofuran","Acta Crystallographica Section E","2013","69","9","o1462","","10.1107/S1600536813023180","","","0.71073","MoKα","","0.0367","0.0321","","","0.071","0.0742","","","","","","1.035","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238566","10.3225","0.0005","16.3159","0.0005","15.4618","0.0008","90","","101.071","0.005","90","","2555.6","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(4-Hydroxyphenyl)-1<i>H</i>-benzimidazol-3-ium chloride monohydrate","","- C13 H13 Cl N2 O2 -","- C13 H13 Cl N2 O2 -","- C104 H104 Cl8 N16 O16 -","8","1","SU2637","González-Padilla, Jazmin E.; Rosales-Hernández, Martha Cecila; Padilla-Martínez, Itzia I.; García-Báez, Efren V.; Rojas-Lima, Susana","2-(4-Hydroxyphenyl)-1<i>H</i>-benzimidazol-3-ium chloride monohydrate","Acta Crystallographica Section E","2013","69","9","o1485","o1486","10.1107/S1600536813023441","","","0.71073","MoKα","","0.0549","0.0425","","","0.1168","0.124","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238567","12.8719","0.0009","12.5878","0.0008","7.4523","0.0005","90","","90.831","0.003","90","","1207.36","0.14","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","1-[2-(3-Methoxyphenyl)ethyl]pyrrolidine-2,5-dione","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C52 H60 N4 O12 -","4","1","SU2640","Fatima, Zeenat; Selvakumar, Jayaraman; Srinivasan, Thothadri; Velmurugan, Devadasan","1-[2-(3-Methoxyphenyl)ethyl]pyrrolidine-2,5-dione","Acta Crystallographica Section E","2013","69","9","o1489","","10.1107/S1600536813023751","","","0.71073","MoKα","","0.0398","0.0351","","","0.0921","0.0966","","","","","","1.019","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2238568","9.6472","0.0006","13.8194","0.0008","10.5384","0.0006","90","","114.355","0.003","90","","1279.93","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(4-Methoxyphenyl)-2,6-dimethyl-1,3-dioxan-4-amine","","- C13 H19 N O3 -","- C13 H19 N O3 -","- C52 H76 N4 O12 -","4","1","SU2641","Fatima, Zeenat; Gottimukkal, Rambabu; Reddy, Bandapalli Palakshi; Vijayakumar, Vijayaparthasarathi; Velmurugan, Devadasan","<i>N</i>-(4-Methoxyphenyl)-2,6-dimethyl-1,3-dioxan-4-amine","Acta Crystallographica Section E","2013","69","9","o1490","","10.1107/S1600536813023763","","","0.71073","MoKα","","0.0778","0.0527","","","0.1428","0.1621","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238569","13.447","0.0006","8.4557","0.0004","20.858","0.0009","90","","90.195","0.002","90","","2371.62","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1',1''-Dimethyl-4'-phenyldispiro[11<i>H</i>-indeno[1,2-<i>b</i>]quinoxaline-11,2'-pyrrolidine-3',3''-piperidin]-4''-one","","- C30 H28 N4 O -","- C30 H28 N4 O -","- C120 H112 N16 O4 -","4","1","TK5246","Suresh, J.; Nagalakshmi, R. A.; Malathi, K.; Kumar, R. R.; Lakshman, P. L. N.","1',1''-Dimethyl-4'-phenyldispiro[11<i>H</i>-indeno[1,2-<i>b</i>]quinoxaline-11,2'-pyrrolidine-3',3''-piperidin]-4''-one","Acta Crystallographica Section E","2013","69","9","o1433","","10.1107/S160053681302223X","","","0.71073","MoKα","","0.0829","0.0501","","","0.1195","0.1382","","","","","","1.024","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238570","22.3183","0.0007","14.4411","0.0005","17.2474","0.0006","90","","116.547","0.002","90","","4972.8","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1',1''-Dimethyl-4'-(4-methylphenyl)dispiro[11<i>H</i>-indeno[1,2-b]quinoxaline-11,2'-pyrrolidine-3',3''-piperidin]-4''-one","","- C31 H30 N4 O -","- C31 H30 N4 O -","- C248 H240 N32 O8 -","8","1","TK5247","Nagalakshmi, R. A.; Suresh, J.; Malathi, K.; Kumar, R. Ranjith; Lakshman, P. L. N.","1',1''-Dimethyl-4'-(4-methylphenyl)dispiro[11<i>H</i>-indeno[1,2-b]quinoxaline-11,2'-pyrrolidine-3',3''-piperidin]-4''-one","Acta Crystallographica Section E","2013","69","9","o1466","","10.1107/S1600536813022964","","","0.71073","MoKα","","0.0709","0.0421","","","0.1091","0.1244","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238571","9.569","0.0019","10.615","0.002","12.663","0.003","68.46","0.03","68.31","0.03","79.38","0.03","1109.9","0.5","99","2","99","2","","","","","","","","7","P -1","-P 1","2","","<i>trans</i>-Difluoridotetrakis(pyridine-κ<i>N</i>)chromium(III) perchlorate","","- C20 H20 Cl Cr F2 N4 O4 -","- C20 H20 Cl Cr F2 N4 O4 -","- C40 H40 Cl2 Cr2 F4 N8 O8 -","2","1","TK5248","Moon, Dohyun; Choi, Jong-Ha","<i>trans</i>-Difluoridotetrakis(pyridine-κ<i>N</i>)chromium(III) perchlorate from synchrotron radiation","Acta Crystallographica Section E","2013","69","9","m514","","10.1107/S1600536813023052","","","0.63001","synchrotron","","0.0444","0.036","","","0.0953","0.0988","","","","","","1.054","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238572","6.8555","0.0007","8.291","0.0009","9.576","0.0009","96.032","0.007","106.743","0.008","101.824","0.009","502.28","0.09","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Lithium aluminium dimagnesium tetrakismolybdate","","- Al0.5 Li0.5 Mg2 Mo3 O12 -","- Al0.5 Li0.5 Mg2 Mo3 O12 -","- Al Li Mg4 Mo6 O24 -","2","1","WM2760","Ennajeh, Ines; Zid, Mohamed Faouzi; Driss, Ahmed","Li~0.5~Al~0.5~Mg~2~(MoO~4~)~3~","Acta Crystallographica Section E","2013","69","9","i54","i55","10.1107/S1600536813022046","","","0.71073","MoKα","","0.0212","0.0208","","","0.0532","0.0534","","","","","","1.286","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238573","10.2373","0.001","13.8981","0.0015","6.623","0.0006","90","","90","","90","","942.31","0.16","296","2","296","2","","","","","","","","4","I m m a","-I 2b 2","74","","Strontium trimanganese tris(orthophosphate)","","- Mn3 O12 P3 Sr -","- Mn3 O12 P3 Sr -","- Mn12 O48 P12 Sr4 -","4","0.25","WM2761","Alhakmi, Ghaleb; Assani, Abderrazzak; Saadi, Mohamed; Follet, Claudine; El Ammari, Lahcen","SrMn^II^~2~Mn^III^(PO~4~)~3~","Acta Crystallographica Section E","2013","69","9","i56","","10.1107/S1600536813020977","","","0.71073","MoKα","","0.0326","0.0249","","","0.0628","0.0657","","","","","","1.042","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238574","20.7162","0.0003","10.159","0.0002","15.5574","0.0003","90","","107.315","0.001","90","","3125.77","0.1","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Di-μ-chlorido-dichloridobis{8-[2-(dimethylamino)ethylamino]quinoline}dicadmium monohydrate","","- C26 H36 Cd2 Cl4 N6 O -","- C26 H36 Cd2 Cl4 N6 O -","- C104 H144 Cd8 Cl16 N24 O4 -","4","0.5","WM2762","Al-Sudani, Abdul-Razak H.; Kariuki, Benson M.","Di-μ-chlorido-dichloridobis{8-[2-(dimethylamino)ethylamino]quinoline}dicadmium monohydrate","Acta Crystallographica Section E","2013","69","9","m491","m492","10.1107/S160053681302206X","","","0.71073","MoKα","","0.0237","0.0214","","","0.052","0.0533","","","","","","1.056","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238575","13.5059","0.0005","13.5059","0.0005","5.8903","0.0002","90","","90","","120","","930.5","0.06","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","Hexacopper(II) calcium/yttrium tris(arsenate/phosphate) hexahydroxide trihydrate","","- As2.48 Ca0.31 Cu5.7 H12 O21 P0.51 Y0.69 -","- As2.484 Ca0.31 Cu5.7 O20.9998 P0.516 Y0.69 -","- As4.968 Ca0.62 Cu11.4 O41.9996 P1.032 Y1.38 -","2","0.166667","WM2763","Morrison, Shaunna M.; Domanik, Kenneth J.; Origlieri, Marcus J.; Downs, Robert T.","Agardite-(Y), Cu^2+^~6~Y(AsO~4~)~3~(OH)~6~·3H~2~O","Acta Crystallographica Section E","2013","69","9","i61","i62","10.1107/S1600536813023477","","","0.71073","MoKα","","0.0416","0.032","","","0.0813","0.0858","","","","","","1.138","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238576","10.3038","0.0007","14.0163","0.0011","6.7126","0.0004","90","","90","","90","","969.44","0.12","296","2","296","2","","","","","","","","4","I m m a","-I 2b 2","74","","Barium trimanganese tris(orthophosphate)","","- Ba Mn3 O12 P3 -","- Ba Mn3 O12 P3 -","- Ba4 Mn12 O48 P12 -","4","0.25","WM2767","Assani, Abderrazzak; Saadi, Mohamed; Alhakmi, Ghaleb; Houmadi, Elham; El Ammari, Lahcen","BaMn^II^~2~Mn^III^(PO~4~)~3~","Acta Crystallographica Section E","2013","69","9","i60","","10.1107/S1600536813023106","","","0.71073","MoKα","","0.0244","0.0201","","","0.0527","0.0551","","","","","","1.086","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238577","10.976","0.005","18.029","0.005","9.697","0.005","90","","90.728","0.005","90","","1918.7","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-3-[5-(Diphenylamino)thiophen-2-yl]-1-(pyridin-3-yl)prop-2-en-1-one","","- C24 H18 N2 O S -","- C24 H18 N2 O S -","- C96 H72 N8 O4 S4 -","4","1","XU5725","Li, Rui; Li, Dan-Dan; Wu, Jie-Ying","(<i>E</i>)-3-[5-(Diphenylamino)thiophen-2-yl]-1-(pyridin-3-yl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","9","o1405","","10.1107/S1600536813021946","","","0.71069","MoKα","","0.0583","0.0388","","","0.117","0.1377","","","","","","0.947","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238578","8.3121","0.0008","10.3911","0.001","8.3128","0.0008","90","","118.639","0.003","90","","630.15","0.11","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Methyl 6-deoxy-6-iodo-2,3-<i>O</i>-isopropylidene-α-<i>D</i>-mannopyranoside","","- C10 H17 I O5 -","- C10 H17 I O5 -","- C20 H34 I2 O10 -","2","1","XU5727","Gültekin, Zeynep; Frey, Wolfgang; Çaylak Delibaş, Nagihan; Hökelek, Tuncer","Methyl 6-deoxy-6-iodo-2,3-<i>O</i>-isopropylidene-α-<small>D</small>-mannopyranoside","Acta Crystallographica Section E","2013","69","9","o1449","o1450","10.1107/S1600536813022629","","","0.71073","MoKα","","0.0163","0.0162","","","0.0424","0.0425","","","","","","1.242","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238579","10.6542","0.0003","11.5152","0.0004","11.6853","0.0004","87.01","0.003","83.703","0.003","71.572","0.002","1351.66","0.08","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","1-{2-(4-Chlorobenzyloxy)-2-[4-(morpholin-4-yl)phenyl]ethyl}-1<i>H</i>-benzimidazole propan-2-ol monosolvate","","- C29 H34 Cl N3 O3 -","- C29 H34 Cl N3 O3 -","- C58 H68 Cl2 N6 O6 -","2","1","XU5728","Özel Güven, Özden; Çapanlar, Seval; Adler, Philip D. F.; Coles, Simon J.; Hökelek, Tuncer","1-{2-(4-Chlorobenzyloxy)-2-[4-(morpholin-4-yl)phenyl]ethyl}-1<i>H</i>-benzimidazole propan-2-ol monosolvate","Acta Crystallographica Section E","2013","69","9","o1437","o1438","10.1107/S1600536813022599","","","0.71073","MoKα","","0.0938","0.0549","","","0.1419","0.1861","","","","","","1.105","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238580","9.374","0.002","17.834","0.005","8.926","0.002","90","","113.5","0.003","90","","1368.4","0.6","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[2-(1,3-thiazol-4-yl)-1<i>H</i>-benzimidazole]manganese(II)]-μ-oxalato]","","- C12 H7 Mn N3 O4 S -","- C12 H7 Mn N3 O4 S -","- C48 H28 Mn4 N12 O16 S4 -","4","1","XU5729","Liang, Peng; Huang, Li-Ning; Yin, Xian-Hong","<i>catena</i>-Poly[[[2-(1,3-thiazol-4-yl)-1<i>H</i>-benzimidazole]manganese(II)]-μ-oxalato]","Acta Crystallographica Section E","2013","69","9","m522","","10.1107/S1600536813023428","","","0.71073","MoKα","","0.0269","0.0242","","","0.0667","0.0685","","","","","","1.077","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238581","6.5043","0.0009","14.6915","0.0019","15.398","0.003","90","","90","","90","","1471.4","0.4","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-{[(<i>E</i>)-(2-Hydroxynaphthalen-1-yl)methylidene]amino}pyridinium perchlorate","","- C16 H13 Cl N2 O5 -","- C16 H13 Cl N2 O5 -","- C64 H52 Cl4 N8 O20 -","4","1","XU5730","Damous, Maamar; Dénès, George; Bouacida, Sofiane; Hamlaoui, Meriem; Merazig, Hocine; Daran, Jean-Claude","3-{[(<i>E</i>)-(2-Hydroxynaphthalen-1-yl)methylidene]amino}pyridinium perchlorate","Acta Crystallographica Section E","2013","69","9","o1460","o1461","10.1107/S1600536813023015","","","0.71073","MoKα","","0.1528","0.0586","","","0.1027","0.1269","","","","","","0.917","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238582","11.798","0.004","13.893","0.004","19.163","0.006","90","","92.216","0.005","90","","3138.7","1.7","98","2","98","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis(2,9-dimethyl-1,10-phenanthrolin-1-ium) 2,5-dicarboxybenzene-1,4-dicarboxylate‒2,9-dimethyl-1,10-phenanthroline‒benzene-1,2,4,5-tetracarboxylic acid (1/2/1)","","- C76 H60 N8 O16 -","- C76 H60 N8 O16 -","- C152 H120 N16 O32 -","2","0.5","XU5731","Arman, Hadi D.; Kaulgud, Trupta; Tiekink, Edward R. T.","Bis(2,9-dimethyl-1,10-phenanthrolin-1-ium) 2,5-dicarboxybenzene-1,4-dicarboxylate‒2,9-dimethyl-1,10-phenanthroline‒benzene-1,2,4,5-tetracarboxylic acid (1/2/1)","Acta Crystallographica Section E","2013","69","9","o1445","o1446","10.1107/S1600536813022691","","","0.71069","MoKα","","0.0755","0.0617","","","0.1392","0.1476","","","","","","1.114","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238583","10.926","0.005","18.38","0.005","10.345","0.005","90","","107.998","0.005","90","","1975.8","1.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Ethoxy-<i>N</i>-(4-ethoxyphenyl)-<i>N</i>-(4-nitrophenyl)aniline","","- C22 H22 N2 O4 -","- C22 H22 N2 O4 -","- C88 H88 N8 O16 -","4","1","XU5734","Kong, Ming; Hao, Fu-Ying; Li, Dan-Dan; Wu, Jie-Ying","4-Ethoxy-<i>N</i>-(4-ethoxyphenyl)-<i>N</i>-(4-nitrophenyl)aniline","Acta Crystallographica Section E","2013","69","9","o1470","","10.1107/S1600536813023386","","","0.71069","MoKα","","0.102","0.0536","","","0.1464","0.1778","","","","","","0.975","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238584","10.0914","0.0015","8.2388","0.0011","10.7592","0.001","90","","108.913","0.01","90","","846.24","0.19","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(3<i>R</i>,3a<i>R</i>,6<i>R</i>,6a<i>R</i>)-Hexahydrofuro[3,2-<i>b</i>]furan-3,6-diyl dibenzoate","","- C20 H18 O6 -","- C20 H18 O6 -","- C40 H36 O12 -","2","1","YK2098","Piccialli, Vincenzo; Zaccaria, Sabrina; Borbone, Nicola; Centore, Roberto; Tuzi, Angela","(3<i>R</i>,3a<i>R</i>,6<i>R</i>,6a<i>R</i>)-Hexahydrofuro[3,2-<i>b</i>]furan-3,6-diyl dibenzoate","Acta Crystallographica Section E","2013","69","9","o1396","o1397","10.1107/S1600536813021612","","","0.71073","MoKα","","0.0472","0.0346","","","0.0677","0.0726","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238585","8.6367","0.0014","31.515","0.005","12.696","0.002","90","","100.155","0.002","90","","3401.5","0.9","120","2","120","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","(2,2'-Bipyridine)chlorido[diethyl (2,2':6',2''-terpyridin-4-yl)phosphonate]ruthenium(II) hexafluoridophosphate acetonitrile/water solvate","","- C30.66 H31.17 Cl F6 N5.83 O3.34 P2 Ru -","- C30.662 H31.169 Cl F6 N5.831 O3.338 P2 Ru -","- C122.648 H124.676 Cl4 F24 N23.324 O13.352 P8 Ru4 -","4","1","ZL2555","Chen, Weizhong; Rein, Francisca N.; Scott, Brian L.; Rocha, Reginaldo C.","(2,2'-Bipyridine)chlorido[diethyl (2,2':6',2''-terpyridin-4-yl)phosphonate]ruthenium(II) hexafluoridophosphate acetonitrile/water solvate","Acta Crystallographica Section E","2013","69","9","m510","m511","10.1107/S1600536813022940","","","0.71073","MoKα","","0.0792","0.0623","","","0.1336","0.1409","","","","","","1.137","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238586","6.3596","0.0019","18.495","0.003","8.3875","0.0015","90","","92.521","0.018","90","","985.6","0.4","291","2","291","2","","","","","","","","4","P 1 21 1","P 2yb","4","Epibisdehydroneotuberostemonine J","(9<i>R</i>,10<i>R</i>,11<i>S</i>,14<i>S</i>,15<i>R</i>)-3-[(2<i>S</i>,5<i>S</i>)-4,5-dimethyloxolan-2-yl]-10-ethyl-14-methyl-12-oxa-4-azatetracyclo[7.6.1.0^4,16^.0^11,15^]hexadeca-1(16),2-dien-13-one","","- C22 H29 N O4 -","- C22 H29 N O4 -","- C44 H58 N2 O8 -","2","1","ZL2558","Jin, Lu; Zhang, Rong-Rong; Tian, Hai-Yan; But, Paul Pui-Hay; Jiang, Ren-Wang","Epibisdehydroneotuberostemonine J","Acta Crystallographica Section E","2013","69","9","o1369","o1370","10.1107/S1600536813021077","","","0.71073","MoKα","","0.0767","0.0448","","","0.0818","0.0932","","","","","","1.053","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238587","12.2098","0.00012","12.2098","0.00012","16.2811","0.0003","90","","90","","90","","2427.17","0.06","100.6","0.9","100.6","0.9","","","","","","","","4","P 42/n","-P 4bc","86","","Bis[bis(pentamethylcyclopentadienyl)cobalt(III)] tetrachloridocobaltate(II) dichloromethane disolvate","","- C42 H64 Cl8 Co3 -","- C42 H64 Cl8 Co3 -","- C84 H128 Cl16 Co6 -","2","","ZL2564","Merola, Joseph S.; Ngo, Mai; Karpin, George W.","Bis[bis(pentamethylcyclopentadienyl)cobalt(III)] tetrachloridocobaltate(II) dichloromethane disolvate","Acta Crystallographica Section E","2013","69","9","m504","","10.1107/S160053681302254X","","","0.7107","MoKα","","0.0501","0.0367","","","0.0835","0.0909","","","","","","1.04","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238588","5.314","0.001","13.745","0.002","18.58","0.004","90","","93.66","0.02","90","","1354.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,2-Ethylenediaminium bis(2-benzamidobenzoate)","","- C30 H30 N4 O6 -","- C30 H30 N4 O6 -","- C60 H60 N8 O12 -","2","0.5","ZQ2204","Ziyaev, Mavlonbek; Ashurov, Jamshid; Talipov, Samat; Ibragimov, Bakhtiyar","1,2-Ethylenediaminium bis(2-benzamidobenzoate)","Acta Crystallographica Section E","2013","69","9","o1388","","10.1107/S1600536813021028","","","1.54184","CuKα","","0.0663","0.0422","","","0.1071","0.1169","","","","","","0.945","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2238589","18.0277","0.001","13.0448","0.0005","12.807","0.0005","90","","121.738","0.005","90","","2561.4","0.2","223.15","","223.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ^2^<i>O</i>,<i>O</i>')nickel(II) propane-1,2-diol monosolvate","","- C27 H24 N4 Ni O6 S -","- C27 H24 N4 Ni O6 S -","- C108 H96 N16 Ni4 O24 S4 -","4","0.5","ZQ2207","Zhong, Kai-Long; Duan, Cheng-Xian","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ^2^<i>O</i>,<i>O</i>')nickel(II) propane-1,2-diol monosolvate","Acta Crystallographica Section E","2013","69","9","m506","m507","10.1107/S1600536813023027","","","0.71073","MoKα","","0.0404","0.0342","","","0.0799","0.0843","","","","","","1.008","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238590","12.3826","0.0006","11.0048","0.0004","14.4485","0.0006","90","","107.037","0.001","90","","1882.47","0.14","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diaquatetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)magnesium dichloride","","- C12 H20 Cl2 Mg N8 O2 -","- C12 H20 Cl2 Mg N8 O2 -","- C48 H80 Cl8 Mg4 N32 O8 -","4","0.5","ZS2271","Kayalvizhi, M.; Vasuki, G.; Kaabi, Kamel; Ben Nasr, Cherif","Diaquatetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)magnesium dichloride","Acta Crystallographica Section E","2013","69","9","m481","","10.1107/S1600536813021478","","","0.71073","MoKα","","0.0278","0.0248","","","0.0655","0.0678","","","","","","1.054","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238591","11.732","0.002","8.6513","0.0017","9.879","0.002","90","","90","","90","","1002.7","0.3","153","2","153","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","<i>tert</i>-Butyl <i>N</i>-(thiophen-2-yl)carbamate","","- C9 H13 N O2 S -","- C9 H13 N O2 S -","- C36 H52 N4 O8 S4 -","4","1","ZS2273","Hsu, Gene C.; Singer, Laci M.; Cordes, David B.; Findlater, Michael","<i>tert</i>-Butyl <i>N</i>-(thiophen-2-yl)carbamate","Acta Crystallographica Section E","2013","69","9","o1413","","10.1107/S160053681302196X","","","0.71073","MoKα","","0.0447","0.034","","","0.0731","0.0777","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238592","7.7005","0.0002","23.3452","0.0008","9.7016","0.0003","90","","110.349","0.002","90","","1635.21","0.09","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(7-Chloro-2-oxo-2<i>H</i>-chromen-4-yl)methyl diethylcarbamodithioate","","- C15 H16 Cl N O2 S2 -","- C15 H16 Cl N O2 S2 -","- C60 H64 Cl4 N4 O8 S8 -","4","1","ZS2274","Meenakshi, T. G.; Shylajakumari, J.; Devarajegowda, H. C.; Kumar, K. Mahesh; Kotresh, O.","(7-Chloro-2-oxo-2<i>H</i>-chromen-4-yl)methyl diethylcarbamodithioate","Acta Crystallographica Section E","2013","69","9","o1431","o1432","10.1107/S160053681302240X","","","0.71073","MoKα","","0.0477","0.0386","","","0.0877","0.0914","","","","","","1.082","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238593","10.782","0.005","10.998","0.005","8.951","0.004","90","","107.215","0.007","90","","1013.9","0.8","98","2","98","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Aminobenzoic acid‒4,4'-bipyridine (2/1)","","- C24 H22 N4 O4 -","- C24 H22 N4 O4 -","- C48 H44 N8 O8 -","2","0.5","ZS2276","Arman, Hadi D.; Tiekink, Edward R. T.","2-Aminobenzoic acid‒4,4'-bipyridine (2/1)","Acta Crystallographica Section E","2013","69","9","o1447","","10.1107/S160053681302271X","","","0.71069","MoKα","","0.0745","0.0606","","","0.1493","0.1585","","","","","","1.113","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238594","10.7471","0.0013","13.3261","0.0016","15.5792","0.0019","90","","95.735","0.002","90","","2220","0.5","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-5-methyl-3-(2-oxo-2-phenylethyl)-7-phenyl-4,5,6,7-tetrahydro-3<i>H</i>-[1,2,4]triazolo[1,5-<i>a</i>]pyrimidin-8-ium bromide ethanol monosolvate","","- C22 H28 Br N5 O2 -","- C22 H28 Br N5 O2 -","- C88 H112 Br4 N20 O8 -","4","1","AA2095","Chernyshev, Victor M.; Pyatakov, Dmitriy A.; Suponitsky, Kyrill Yu.","2-Amino-5-methyl-3-(2-oxo-2-phenylethyl)-7-phenyl-4,5,6,7-tetrahydro-3<i>H</i>-[1,2,4]triazolo[1,5-<i>a</i>]pyrimidin-8-ium bromide ethanol monosolvate","Acta Crystallographica Section E","2013","69","10","o1586","o1587","10.1107/S1600536813025853","","","0.71073","MoKα","","0.047","0.0319","","","0.0748","0.0821","","","","","","1.011","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238595","12.3802","0.0007","18.3516","0.001","17.3596","0.0009","90","","102.749","0.001","90","","3846.8","0.4","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","<i>rac</i>-Methyl (3a<i>R*</i>,4<i>S*</i>,5<i>R*</i>,7a<i>R*</i>)-5,7a-bis(acetyloxy)-3-oxo-2-phenyloctahydro-1<i>H</i>-isoindole-4-carboxylate","","- C20 H23 N O7 -","- C20 H23 N O7 -","- C160 H184 N8 O56 -","8","1","AA2096","Toze, Flavien A. A.; Nikitina, Eugeniya V.; Zaytsev, Vladimir P.; Zubkov, Fedor I.; Khrustalev, Victor N.","<i>rac</i>-Methyl (3a<i>R*</i>,4<i>S*</i>,5<i>R*</i>,7a<i>R*</i>)-5,7a-bis(acetyloxy)-3-oxo-2-phenyloctahydro-1<i>H</i>-isoindole-4-carboxylate","Acta Crystallographica Section E","2013","69","10","o1555","","10.1107/S1600536813025129","","","0.71073","MoKα","","0.0561","0.0412","","","0.1019","0.1083","","","","","","1.038","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238596","10.745","0.0002","10.1737","0.0002","21.6588","0.0004","90","","90","","90","","2367.66","0.08","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-(2-Methylbenzoyl)benzoic acid","","- C15 H12 O3 -","- C15 H12 O3 -","- C120 H96 O24 -","8","1","BG2513","Platosz, Natalia A.; Lalancette, Roger A.; Thompson, Hugh W.; Newman, Jacob M.; Schachter, Ari","2-(2-Methylbenzoyl)benzoic acid: catemeric hydrogen bonding in a γ-keto acid","Acta Crystallographica Section E","2013","69","10","o1547","o1548","10.1107/S1600536813025099","","","1.54178","CuKα","","0.031","0.03","","","0.075","0.076","","","","","","1.07","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238597","7.7319","0.0014","13.491","0.002","11.913","0.002","90","","102.625","0.003","90","","1212.6","0.3","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>-(2-Methylphenyl)-1,2-benzoselenazol-3(2<i>H</i>)-one","","- C14 H11 N O Se -","- C14 H11 N O Se -","- C56 H44 N4 O4 Se4 -","4","1","BG2515","Zhu, Xu; Xu, Ying; Han, Hongfei; Guo, Zhiqiang; Wei, Xuehong","<i>N</i>-(2-Methylphenyl)-1,2-benzoselenazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2013","69","10","o1538","","10.1107/S1600536813024744","","","0.71073","MoKα","","0.0494","0.0413","","","0.0914","0.0949","","","","","","1.103","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238598","7.286","0.004","15.148","0.008","25.84","0.014","90","","90","","90","","2852","3","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","3-Chloro-<i>N</i>-[<i>N</i>-(furan-2-carbonyl)hydrazinocarbothioyl]benzamide","","- C13 H10 Cl N3 O3 S -","- C13 H10 Cl N3 O3 S -","- C104 H80 Cl8 N24 O24 S8 -","8","1","BG2516","Yamin, Bohari M.; Yusof, Diyana; Hasbullah, Siti Aishah","3-Chloro-<i>N</i>-[<i>N</i>-(furan-2-carbonyl)hydrazinocarbothioyl]benzamide","Acta Crystallographica Section E","2013","69","10","o1567","","10.1107/S1600536813025440","","","0.71073","MoKα","","0.0733","0.0446","","","0.101","0.1165","","","","","","1.02","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238599","8.847","0.0003","20.5656","0.0008","20.6403","0.0009","90","","98.633","0.002","90","","3712.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,4-Bis(4-fluorophenyl)-1,5-dimethyl-3-azabicyclo[3.3.1]nonan-9-one","","- C22 H23 F2 N O -","- C22 H23 F2 N O -","- C176 H184 F16 N8 O8 -","8","2","BH2483","Rizwana Begum, S.; Hema, R.; Venkateswaramoorthi, R.; Krishnasamy, K.; Anitha, A. G.","2,4-Bis(4-fluorophenyl)-1,5-dimethyl-3-azabicyclo[3.3.1]nonan-9-one","Acta Crystallographica Section E","2013","69","10","o1525","","10.1107/S1600536813024689","","","0.71073","MoKα","","0.083","0.0433","","","0.1016","0.1251","","","","","","1.006","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238600","31.6964","0.0006","11.0325","0.0002","14.1965","0.0003","90","","96.503","0.001","90","","4932.44","0.17","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Methyl 9-hydroxy-15-methyl-2-oxo-11-(pyren-1-yl)-10-oxa-15-azatetracyclo[7.6.0.0^1,12^.0^3,8^]pentadeca-3(8),4,6-triene-12-carboxylate","","","- C32 H25 N O5 -","- C32 H25 N O5 -","- C256 H200 N8 O40 -","8","1","BT6925","Sharmila, P.; Jagadeesan, G.; Raju, Rajesh; Raghavachary, Raghunathan; Aravindhan, S.","Methyl 9-hydroxy-15-methyl-2-oxo-11-(pyren-1-yl)-10-oxa-15-azatetracyclo[7.6.0.0^1,12^.0^3,8^]pentadeca-3(8),4,6-triene-12-carboxylate","Acta Crystallographica Section E","2013","69","10","o1569","","10.1107/S1600536813024951","","","0.71073","MoKα","","0.0651","0.0413","","","0.1013","0.1142","","","","","","1.035","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238601","8.363","0.005","10.267","0.005","10.481","0.005","75.043","0.005","75.789","0.005","74.576","0.005","822.9","0.7","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","1-(3,5-Dimethoxyphenyl)-4,5-dimethyl-2-phenyl-1<i>H</i>-imidazole","","- C19 H20 N2 O2 -","- C19 H20 N2 O2 -","- C38 H40 N4 O4 -","2","1","BT6926","Divya, G.; Saravanan, K.; Santhiya, S.; Chandralekha, K.; Lakshmi, S.","1-(3,5-Dimethoxyphenyl)-4,5-dimethyl-2-phenyl-1<i>H</i>-imidazole","Acta Crystallographica Section E","2013","69","10","o1502","","10.1107/S1600536813023684","","","0.71073","MoKα","","0.0538","0.0416","","","0.1152","0.1262","","","","","","1.03","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238602","7.5193","0.0003","9.7278","0.0004","20.7616","0.0007","90","","93.659","0.003","90","","1515.54","0.1","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(3a<i>R</i>,6<i>S</i>,7a<i>R</i>)-7a-Chloro-2-[(4-nitrophenyl)sulfonyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole","(3a<i>R</i>,6<i>S</i>,7a<i>R</i>)-7a-Chloro-2-[(4-nitrophenyl)sulfonyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole","","- C14 H13 Cl N2 O5 S -","- C14 H13 Cl N2 O5 S -","- C56 H52 Cl4 N8 O20 S4 -","4","1","BT6932","Temel, Ersin; Demircan, Aydın; Kandemir, Muhammet Kasım; Çolak, Medine; Büyükgüngör, Orhan","(3a<i>R</i>,6<i>S</i>,7a<i>R</i>)-7a-Chloro-2-[(4-nitrophenyl)sulfonyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole","Acta Crystallographica Section E","2013","69","10","o1551","o1552","10.1107/S1600536813025336","","","0.71073","MoKα","","0.062","0.0364","","","0.1042","0.1104","","","","","","1.029","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238603","8.0294","0.0006","12.0187","0.0006","16.2151","0.0008","105.764","0.004","100.835","0.005","94.965","0.005","1463.34","0.16","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","{2-[1-(2-Methoxy-6-oxidophenyl-κ<i>O</i>^6^)ethylidene]-<i>N</i>-methylhydrazinecarbothioamidato-κ^2^<i>N</i>^2^,<i>S</i>}(triphenylphosphane-κ<i>P</i>)palladium(II) ethanol monosolvate","","- C31 H34 N3 O3 P Pd S -","- C31 H34 N3 O3 P Pd S -","- C62 H68 N6 O6 P2 Pd2 S2 -","2","1","BV2224","Anderson, Brian J.; O'Rourke, Kelly A.; Keeler, Alexander M.; Jasinski, Jerry P.","{2-[1-(2-Methoxy-6-oxidophenyl-κ<i>O</i>^6^)ethylidene]-<i>N</i>-methylhydrazinecarbothioamidato-κ^2^<i>N</i>^2^,<i>S</i>}(triphenylphosphane-κ<i>P</i>)palladium(II) ethanol monosolvate","Acta Crystallographica Section E","2013","69","10","m528","m529","10.1107/S1600536813023040","","","0.71073","MoKα","","0.0595","0.0488","","","0.1186","0.1281","","","","","","1.098","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238604","11.9706","0.0005","13.7518","0.0007","16.9887","0.0008","90","","109.396","0.002","90","","2637.9","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","μ-(2,6-Bis{[3-(dimethylamino)propyl]iminomethyl}-4-methylphenolato)-μ-hydroxido-bis[(thiocyanato-κ<i>N</i>)copper(II)]","","- C21 H32 Cu2 N6 O2 S2 -","- C21 H32 Cu2 N6 O2 S2 -","- C84 H128 Cu8 N24 O8 S8 -","4","1","BX2448","Meera, M. G.; Selvaraj, P. Kamatchi; Viswanathan, B.; Ramkumar, V.","μ-(2,6-Bis{[3-(dimethylamino)propyl]iminomethyl}-4-methylphenolato)-μ-hydroxido-bis[(thiocyanato-κ<i>N</i>)copper(II)]","Acta Crystallographica Section E","2013","69","10","m542","m543","10.1107/S1600536813024768","","","0.71073","MoKα","","0.0478","0.0355","","","0.0905","0.1006","","","","","","1.009","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238605","7.1932","0.0007","10.0572","0.001","13.8729","0.0013","90","","93.673","0.005","90","","1001.55","0.17","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5,6-dimethyl-1,10-phenanthroline","5,6-Dimethyl-1,10-phenanthroline","","- C14 H12 N2 -","- C14 H12 N2 -","- C56 H48 N8 -","4","1","BX2451","Rozenel, Sergio S.","5,6-Dimethyl-1,10-phenanthroline","Acta Crystallographica Section E","2013","69","10","o1560","","10.1107/S1600536813025087","","","0.71073","MoKα","","0.0404","0.0348","","","0.0957","0.1","","","","","","1.056","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238606","18.768","0.003","6.489","0.0009","18.681","0.003","90","","103.896","0.01","90","","2208.5","0.6","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis((<i>E</i>)-2-{3-[4-(1<i>H</i>-imidazol-1-yl-κ<i>N</i>^3^)styryl]-5,5-dimethylcyclohex-2-enylidene}malononitrile)diiodidomercury(II)","","- C44 H40 Hg I2 N8 -","- C44 H40 Hg I2 N8 -","- C88 H80 Hg2 I4 N16 -","2","0.5","CQ2006","Xi, Wen-Gang; Wu, Zhi-Chao; Zhou, Hong-Ping","Bis((<i>E</i>)-2-{3-[4-(1<i>H</i>-imidazol-1-yl-κ<i>N</i>^3^)styryl]-5,5-dimethylcyclohex-2-enylidene}malononitrile)diiodidomercury(II)","Acta Crystallographica Section E","2013","69","10","m548","","10.1107/S1600536813025191","","","0.71069","MoKα","","0.0384","0.036","","","0.0895","0.092","","","","","","1.035","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238607","9.0299","0.0006","11.4718","0.0008","17.9652","0.0013","92.946","0.003","95.521","0.004","91.204","0.003","1849.3","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2,2'-{[(1<i>E</i>,1'<i>E</i>)-(Cyclohexane-1,4-diyl)bis(azanylylidene)]bis(ethan-1-yl-1-ylidene)}diphenol","","- C22 H26 N2 O2 -","- C22 H26 N2 O2 -","- C88 H104 N8 O8 -","4","2","CV5426","Lakshmi, S. H. Anjana; Kandaswamy, M.; Ramkumar, V.","2,2'-{[(1<i>E</i>,1'<i>E</i>)-(Cyclohexane-1,4-diyl)bis(azanylylidene)]bis(ethan-1-yl-1-ylidene)}diphenol","Acta Crystallographica Section E","2013","69","10","o1593","","10.1107/S1600536813026123","","","0.71073","MoKα","","0.1121","0.0603","","","0.1699","0.2389","","","","","","1.019","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2238608","9.3113","0.0009","10.6511","0.001","15.3962","0.0015","95.242","0.002","103.085","0.002","95.492","0.002","1470.4","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","4,6-Di-<i>tert</i>-butyl-2,3-dihydroxybenzaldehyde","","","- C15 H22 O3 -","- C15 H22 O3 -","- C60 H88 O12 -","4","2","CV5427","Arsenyev, Max; Baranov, Eugene; Chesnokov, Sergey; Abakumov, Gleb","4,6-Di-<i>tert</i>-butyl-2,3-dihydroxybenzaldehyde","Acta Crystallographica Section E","2013","69","10","o1565","","10.1107/S1600536813025488","","","0.71073","MoKα","","0.0637","0.0463","","","","0.1299","","","","","","1.064","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238609","8.267","0.001","7.994","0.001","17.582","0.003","90","","98.98","0.02","90","","1147.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dipentyl 2,6-diaminobenzo[1,2-<i>b</i>:4,5-<i>b</i>']difuran-3,7-dicarboxylate","","- C22 H28 N2 O6 -","- C22 H28 N2 O6 -","- C44 H56 N4 O12 -","2","0.5","DS2234","Roviello, Giuseppina; Borbone, Fabio; Carella, Antonio; Roviello, Giovanni N.; Tuzi, Angela","Dipentyl 2,6-diaminobenzo[1,2-<i>b</i>:4,5-<i>b</i>']difuran-3,7-dicarboxylate","Acta Crystallographica Section E","2013","69","10","o1526","o1527","10.1107/S160053681302480X","","","0.71073","MoKα","","0.1598","0.0548","","","0.1065","0.1343","","","","","","0.931","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238610","12.43478","0.00012","12.43478","0.00012","3.93697","0.00006","90","","90","","90","","608.749","0.012","100","1","100","1","","","","","","","","4","P 4 b m","P 4 -2ab","100","SBN60","Strontium barium niobium oxide","","- Ba0.4 Nb2 O6 Sr0.6 -","- Ba0.4 Nb2 O6 Sr0.6 -","- Ba2 Nb10 O30 Sr3 -","5","0.625","FF2110","Stachowicz, Marcin; Gawryszewska, Olga; Swirkowicz, Marek A.; Lukasiewicz, Tadeusz","SBN60, strontium-barium niobate at 100K","Acta Crystallographica Section E","2013","69","10","i69","i70","10.1107/S1600536813025142","","","0.71073","MoKα","","0.0286","0.0274","","","0.0734","0.0741","","","","","","1.161","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2238611","6.2598","0.0004","9.2822","0.0006","16.0437","0.0012","84.387","0.006","88.957","0.006","79.358","0.006","911.79","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>tert</i>-Butyl <i>N</i>-{[5-(5-oxohexanamido)pyridin-2-yl]amino}carbamate","","- C16 H24 N4 O4 -","- C16 H24 N4 O4 -","- C32 H48 N8 O8 -","2","1","FF2115","Ronga, Luisa; Pinaud, Noel; Rimbault, Charlotte; Marchivie, Mathieu; Guillon, Jean","<i>tert</i>-Butyl <i>N</i>-{[5-(5-oxohexanamido)pyridin-2-yl]amino}carbamate","Acta Crystallographica Section E","2013","69","10","o1531","o1532","10.1107/S1600536813024598","","","0.71073","MoKα","","0.0915","0.0525","","","0.1255","0.1473","","","","","","1.04","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238612","8.058","0.001","8.2629","0.0011","12.0972","0.0014","74.956","0.002","73.868","0.001","72.311","0.001","723.54","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3,22-Dioxa-11,14-diazapentacyclo[12.8.0.0^2,11^.0^5,10^.0^15,20^]docosa-5(10),6,8,15(20),16,18-hexaene-4,21-dione","","- C18 H14 N2 O4 -","- C18 H14 N2 O4 -","- C36 H28 N4 O8 -","2","1","FF2118","Ren, Xiaolin; Feng, Jiao; Wang, Jinglin; Liu, Bin; Yang, Binsheng","3,22-Dioxa-11,14-diazapentacyclo[12.8.0.0^2,11^.0^5,10^.0^15,20^]docosa-5(10),6,8,15(20),16,18-hexaene-4,21-dione","Acta Crystallographica Section E","2013","69","10","o1535","","10.1107/S1600536813024537","","","0.71073","MoKα","","0.1086","0.051","","","0.0867","0.0979","","","","","","1.013","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238613","5.9686","0.0004","18.7567","0.0013","20.1089","0.0013","90","","100.932","0.0018","90","","2210.4","0.3","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9-[(<i>E</i>)-2-(4-Chlorophenyl)ethenyl]-3,3,6,6-tetramethyl-2,3,4,5,6,7,8,9-octahydro-1<i>H</i>-xanthene-1,8-dione","","- C25 H27 Cl O3 -","- C25 H27 Cl O3 -","- C100 H108 Cl4 O12 -","4","1","FF2119","Yu, Byung-Yong; Lee, Jae Kyun; Cho, Yong Seo; Min, Sun-Joon; Woo, Jae Chun","9-[(<i>E</i>)-2-(4-Chlorophenyl)ethenyl]-3,3,6,6-tetramethyl-2,3,4,5,6,7,8,9-octahydro-1<i>H</i>-xanthene-1,8-dione","Acta Crystallographica Section E","2013","69","10","o1542","","10.1107/S1600536813025026","","","0.71075","MoKα","","","0.0571","","","","0.1938","","","","","","1.114","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238614","12.5312","0.0005","7.4562","0.0003","13.8913","0.0005","90","","112.331","0.004","90","","1200.6","0.09","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>-(2-Bromophenyl)-1,3-selenazolo[5,4-<i>b</i>]pyridin-2-amine","","- C12 H8 Br N3 Se -","- C12 H8 Br N3 Se -","- C48 H32 Br4 N12 Se4 -","4","1","FJ2639","Bo, Zhou; Du Shu, Huang; Wei, Liu; Mei Yun, Zhou","<i>N</i>-(2-Bromophenyl)-1,3-selenazolo[5,4-<i>b</i>]pyridin-2-amine","Acta Crystallographica Section E","2013","69","10","o1537","","10.1107/S1600536813023969","","","1.54178","CuKα","","0.0541","0.052","","","0.1291","0.1319","","","","","","1.105","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238615","7.87","0.0016","10.09","0.002","10.25","0.002","81.36","0.03","73.13","0.03","74.64","0.03","748.7","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1-(3-Carboxylatophenyl)-4,4'-bipyridin-1-ium dihydrate","","- C17 H16 N2 O4 -","- C17 H16 N2 O4 -","- C34 H32 N4 O8 -","2","1","FJ2640","Fan, Mengchan; Yao, Zhenguo; Li, Chen; Fu, Zhiyong","1-(3-Carboxylatophenyl)-4,4'-bipyridin-1-ium dihydrate","Acta Crystallographica Section E","2013","69","10","o1503","","10.1107/S1600536813024197","","","0.71073","MoKα","","0.0548","0.0415","","","0.144","0.1723","","","","","","1.183","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238616","16.347","0.004","5.0859","0.001","18.408","0.005","90","","115.311","0.009","90","","1383.5","0.6","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-{(<i>E</i>)-[2-(Pyridin-3-ylcarbonyl)hydrazinylidene]methyl}phenyl acetate","","- C15 H13 N3 O3 -","- C15 H13 N3 O3 -","- C60 H52 N12 O12 -","4","1","FJ2641","Datta, Riya; Ramya, V.; Sithambaresan, M.; Kurup, M. R. Prathapachandra","4-{(<i>E</i>)-[2-(Pyridin-3-ylcarbonyl)hydrazinylidene]methyl}phenyl acetate","Acta Crystallographica Section E","2013","69","10","o1549","","10.1107/S1600536813025075","","","0.71073","MoKα","","0.0757","0.0485","","","0.1225","0.1403","","","","","","1.037","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238617","12.7407","0.0011","10.5126","0.0008","22.955","0.002","90","","100.461","0.003","90","","3023.4","0.4","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","6-Chloro-2-(thiophen-2-yl)-1-(thiophen-2-ylmethyl)-1H-benzimidazole (0.94/0.06)","5-Chloro-2-(thiophen-2-yl)-1-(thiophen-2-ylmethyl)-1<i>H</i>-benzimidazole‒\ 6-chloro-2-(thiophen-2-yl)-1-(thiophen-2-ylmethyl)-1<i>H</i>-benzimidazole (0.94/0.06)","","- C16 H11 Cl N2 S2 -","- C16 H11 Cl N2 S2 -","- C128 H88 Cl8 N16 S16 -","8","2","FJ2642","Geiger, David K.; Nellist, Michael R.","5-Chloro-2-(thiophen-2-yl)-1-(thiophen-2-ylmethyl)-1<i>H</i>-benzimidazole‒6-chloro-2-(thiophen-2-yl)-1-(thiophen-2-ylmethyl)-1<i>H</i>-benzimidazole (0.94/0.06)","Acta Crystallographica Section E","2013","69","10","o1539","o1540","10.1107/S1600536813024999","","","0.71073","MoKα","","0.0517","0.0381","","","0.0876","0.0926","","","","","","1.079","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238618","8.476","0.004","5.264","0.003","28.295","0.013","90","","93.589","0.009","90","","1260","1.1","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Benzyl-5-methoxyisoindoline-1,3-dione","","- C16 H13 N O3 -","- C16 H13 N O3 -","- C64 H52 N4 O12 -","4","1","FY2100","Vila, Noemi; Costas-Lago, María Carmen; Besada, Pedro; Terán, Carmen","2-Benzyl-5-methoxyisoindoline-1,3-dione","Acta Crystallographica Section E","2013","69","10","o1594","o1595","10.1107/S160053681302638X","","","0.71073","MoKα","","0.0952","0.0533","","","0.1174","0.1374","","","","","","1.002","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238619","15.127","0.003","11.067","0.002","15.821","0.003","90","","115.71","0.03","90","","2386.4","1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Di-μ-methanolato-bis[(2-<i>tert</i>-butyl-6-methylphenolato-κ<i>O</i>)methyltitanium(IV)]","","- C48 H72 O6 Ti2 -","- C48 H72 O6 Ti2 -","- C96 H144 O12 Ti4 -","2","0.5","GG2122","Nielson, Alastair J.; Shen, Chaohong; Waters, Joyce M.","Di-μ-methanolato-bis[(2-<i>tert</i>-butyl-6-methylphenolato-κ<i>O</i>)methyltitanium(IV)]","Acta Crystallographica Section E","2013","69","10","m554","m555","10.1107/S1600536813025634","","","0.71073","MoKα","","0.0435","0.0344","","","0.084","0.0889","","","","","","1.044","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238620","4.3198","0.0009","7.4921","0.0017","13.225","0.003","93.612","0.012","93.912","0.012","103.769","0.012","413.36","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","2,3,4,5,6-Pentafluoro-<i>trans</i>-cinnamic acid","(<i>E</i>)-3-(2,3,4,5,6-Pentafluorophenyl)prop-2-enoic acid","","- C9 H3 F5 O2 -","- C9 H3 F5 O2 -","- C18 H6 F10 O4 -","2","1","GG2124","Navarrete, Angélica; Somanathan, Ratnasamy; Aguirre, Gerardo","2,3,4,5,6-Pentafluoro-<i>trans</i>-cinnamic acid","Acta Crystallographica Section E","2013","69","10","o1519","","10.1107/S1600536813024513","","","0.71073","MoKα","","0.0397","0.0311","","","0.0933","0.1041","","","","","","0.702","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238621","17.5488","0.0014","11.936","0.0011","13.0663","0.0009","90","","120.664","0.005","90","","2354.2","0.4","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ<i>O</i>)copper(II) ethanol monosolvate","","- C26 H20 Cu N4 O5 S -","- C26 H20 Cu N4 O5 S -","- C104 H80 Cu4 N16 O20 S4 -","4","1","GG2128","Meundaeng, Natthaya; Prior, Timothy J.; Rujiwatra, Apinpus","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ<i>O</i>)copper(II) ethanol monosolvate","Acta Crystallographica Section E","2013","69","10","m568","m569","10.1107/S1600536813026093","","","0.71073","MoKα","","0.0777","0.0578","","","0.1489","0.1595","","","","","","1.01","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238622","7.038","0.0005","12.8072","0.0009","11.3701","0.0009","90","","97.819","0.006","90","","1015.34","0.13","123","","123","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(2-nitrophenyl)-2-furancarboxamide","<i>N</i>-(2-Nitrophenyl)furan-2-carboxamide","","- C11 H8 N2 O4 -","- C11 H8 N2 O4 -","- C44 H32 N8 O16 -","4","1","GG2129","Moreno-Fuquen, Rodolfo; Azcárate, Alexis; Kennedy, Alan R.; Gilmour, Denise; De Almeida Santos, Regina H.","<i>N</i>-(2-Nitrophenyl)furan-2-carboxamide","Acta Crystallographica Section E","2013","69","10","o1592","","10.1107/S1600536813026202","","","0.71073","MoKα","","0.0498","0.0392","","","0.0906","0.0986","","","","","","1.04","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238623","8.2099","0.0007","13.8928","0.0012","15.0495","0.0014","90","","92.327","0.003","90","","1715.1","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>-(1-Allyl-1<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide hemihydrate","","- C34 H36 N6 O7 S2 -","- C34 H36 N6 O7 S2 -","- C68 H72 N12 O14 S4 -","2","0.5","GK2590","Chicha, Hakima; Rakib, El Mostapha; Geffken, Detlef; Saadi, Mohamed; El Ammari, Lahcen","<i>N</i>-(1-Allyl-1<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide hemihydrate","Acta Crystallographica Section E","2013","69","10","o1589","o1590","10.1107/S1600536813025543","","","0.71073","MoKα","","0.069","0.0422","","","0.1034","0.119","","","","","","1.009","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238624","8.617","0.004","20.438","0.005","15.038","0.005","90","","106.27","0.02","90","","2542.3","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(4-Acetyl-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5-yl)-<i>N</i>-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide","","- C29 H25 N5 O3 -","- C29 H25 N5 O3 -","- C116 H100 N20 O12 -","4","1","HB7092","Meneghetti, Fiorella; Maggio, Benedetta","<i>N</i>-(4-Acetyl-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5-yl)-<i>N</i>-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide","Acta Crystallographica Section E","2013","69","10","o1582","","10.1107/S1600536813025683","","","0.71073","MoKα","","0.2675","0.0472","","","0.0787","0.1196","","","","","","0.92","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238625","19.6219","0.0013","8.1603","0.0006","15.2396","0.001","90","","95.95","0.003","90","","2427","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>N</i>-(2-Fluorophenyl)-2,6-dimethyl-1,3-dioxan-4-amine","","- C12 H16 F N O2 -","- C12 H16 F N O2 -","- C96 H128 F8 N8 O16 -","8","1","HB7132","Fatima, Zeenat; Rambabu, Gottimukkala; Reddy, Bandapalli Palakshi; Vijayakumar, Vijayaparthasarathi; Velmurugan, Devadasan","<i>N</i>-(2-Fluorophenyl)-2,6-dimethyl-1,3-dioxan-4-amine","Acta Crystallographica Section E","2013","69","10","o1524","","10.1107/S1600536813024732","","","0.71073","MoKα","","0.0685","0.0437","","","0.1181","0.137","","","","","","1.032","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238626","8.2925","0.0001","13.5841","0.0002","19.2995","0.0003","90","","98.797","0.001","90","","2148.44","0.05","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Dihydrocyclam dimaleate","1,4,8,11-Tetraazacyclotetradecane-1,8-diium bis(3-carboxyprop-2-enoate)","","- C18 H32 N4 O8 -","- C18 H32 N4 O8 -","- C72 H128 N16 O32 -","4","1","HB7135","Mireille Ninon, Mbonzi Ombenga; Fahim, Mohammed; Lachkar, Mohammed; Marco Contelles, José Luis; Perles, Josefina; El Bali, Brahim","Dihydrocyclam dimaleate [H~2~(cyclam)(maleate)~2~]","Acta Crystallographica Section E","2013","69","10","o1574","o1575","10.1107/S1600536813025580","","","1.54178","CuKα","","0.033","0.0317","","","0.0819","0.083","","","","","","1.043","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238627","16.643","0.002","7.1118","0.001","6.9618","0.0011","90","","98.903","0.007","90","","814.1","0.2","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Methyl 4-(trifluoromethyl)-1<i>H</i>-pyrrole-3-carboxylate","","- C7 H6 F3 N O2 -","- C7 H6 F3 N O2 -","- C28 H24 F12 N4 O8 -","4","0.5","HB7136","Suchetan, P. A.; Sreenivasa, S.; Palakshamurthy, B. S.; ManojKumar, K. E.; Madan Kumar, S.; Lokanath, N. K.","Methyl 4-(trifluoromethyl)-1<i>H</i>-pyrrole-3-carboxylate","Acta Crystallographica Section E","2013","69","10","o1566","","10.1107/S160053681302549X","","","0.71073","MoKα","","0.0854","0.0649","","","0.1728","0.1797","","","","","","1.088","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238628","12.779","0.001","10.1894","0.0008","14.3953","0.0012","90","","113.744","0.002","90","","1715.8","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>'-Bis(3-bromo-2-hydroxybenzylidene)propane-1,3-diamine","","- C17 H16 Br2 N2 O2 -","- C17 H16 Br2 N2 O2 -","- C68 H64 Br8 N8 O8 -","4","1","HB7137","Wang, Xiao-Zhen","<i>N</i>,<i>N</i>'-Bis(3-bromo-2-hydroxybenzylidene)propane-1,3-diamine","Acta Crystallographica Section E","2013","69","10","o1584","","10.1107/S1600536813025403","","","0.71073","MoKα","","0.0835","0.0537","","","0.125","0.1409","","","","","","1.069","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238629","7.6456","0.0007","21.4096","0.0018","9.7404","0.0012","90","","100.278","0.001","90","","1568.8","0.3","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","Pyridinium <i>trans</i>-diaquabis[oxalato(2-)-κ^2^<i>O</i>^1^,<i>O</i>^2^]chromate(III) urea monosolvate","","- C10 H14 Cr N3 O11 -","- C10 H14 Cr N3 O11 -","- C40 H56 Cr4 N12 O44 -","4","0.5","HB7141","Bebga, Gouet; Signé, Martin; Nenwa, Justin; Mbarki, Mohammed; Fokwa, Boniface P. T.","Pyridinium <i>trans</i>-diaquabis[oxalato(2{-})-κ^2^<i>O</i>^1^,<i>O</i>^2^]chromate(III) urea monosolvate","Acta Crystallographica Section E","2013","69","10","m567","","10.1107/S1600536813026135","","","0.71073","MoKα","","0.0498","0.0407","","","0.1031","0.1108","","","","","","1.102","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238630","12.8969","0.001","28.001","0.002","4.533","0.0004","90","","90","","90","","1637","0.2","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","<i>N</i>,<i>N</i>'-(2-Hydroxypropane-1,3-diyl)bis(2-hydroxybenzamide) monohydrate","","- C17 H20 N2 O6 -","- C17 H20 N2 O6 -","- C68 H80 N8 O24 -","4","0.5","HB7142","Yebedri, Sihem; Louhibi, Samira; Bouacida, Sofiane; Ourari, Ali; Roisnel, Thierry","<i>N</i>,<i>N</i>'-(2-Hydroxypropane-1,3-diyl)bis(2-hydroxybenzamide) monohydrate","Acta Crystallographica Section E","2013","69","10","o1591","","10.1107/S1600536813026184","","","0.71073","MoKα","","0.0906","0.0478","","","0.1058","0.1231","","","","","","1.038","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238631","10.1889","0.0012","15.2033","0.0005","21.6254","0.0009","90","","90","","90","","3349.9","0.4","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis{μ-2-methoxy-6-[(methylimino)methyl]phenolato}bis({2-methoxy-6-[(methylimino)methyl]phenolato}copper(II))","","- C36 H40 Cu2 N4 O8 -","- C36 H40 Cu2 N4 O8 -","- C144 H160 Cu8 N16 O32 -","4","0.5","HG5344","Sydoruk, Tetyana V.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Vassilyeva, Olga Yu.; Skelton, Brian W.","Bis{μ-2-methoxy-6-[(methylimino)methyl]phenolato}bis({2-methoxy-6-[(methylimino)methyl]phenolato}copper(II))","Acta Crystallographica Section E","2013","69","10","m551","m552","10.1107/S1600536813025105","","","0.71073","MoKα","","0.0449","0.0313","","","0.0789","0.0835","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238632","11.1738","0.0002","9.39846","0.00016","13.6046","0.0002","90","","105.109","0.002","90","","1379.32","0.04","123","2","123.3","0.3","","","","","","","","5","P 1 n 1","P -2yac","7","","[2-(1-Hydroxycyclohexyl)-2-(4-hydroxyphenyl)ethyl]dimethylammonium chloranilate ethyl acetate","","- C26 H35 Cl2 N O8 -","- C26 H35 Cl2 N O8 -","- C52 H70 Cl4 N2 O16 -","2","1","HG5346","Kaur, Manpreet; Jasinski, Jerry P.; Butcher, Ray J.; Yathirajan, H. S.; Byrappa, K.","Desvenlafaxinium chloranilate ethyl acetate solvate","Acta Crystallographica Section E","2013","69","10","o1556","o1557","10.1107/S1600536813025312","","","0.7107","MoKα","","0.0629","0.0571","","","0.1511","0.1576","","","","","","1.053","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238633","6.1925","0.0002","8.2636","0.0002","40.7287","0.0011","90","","93.513","0.002","90","","2080.27","0.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>tert</i>-Butyl 4-{[2-amino-4-(2-hydroxyphenyl)pyrimidin-5-yl]methyl}piperazine-1-carboxylate","","- C20 H27 N5 O3 -","- C20 H27 N5 O3 -","- C80 H108 N20 O12 -","4","1","HG5347","Gajera, Nilesh N.; Patel, Mukesh C.; Jotani, Mukesh M.; Tiekink, Edward R. T.","<i>tert</i>-Butyl 4-{[2-amino-4-(2-hydroxyphenyl)pyrimidin-5-yl]methyl}piperazine-1-carboxylate","Acta Crystallographica Section E","2013","69","10","o1577","o1578","10.1107/S1600536813025774","","","0.71073","MoKα","","0.0778","0.0497","","","0.1258","0.1413","","","","","","1.035","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238634","15.387","0.0014","9.8771","0.0009","21.3246","0.0019","90","","99.306","0.001","90","","3198.2","0.5","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","{9-Hexyl-2-[2-phenyl-6-(pyridin-2-yl)pyridin-4-yl]-9<i>H</i>-carbazole}diiodidozinc","","- C34 H31 I2 N3 Zn -","- C34 H31 I2 N3 Zn -","- C136 H124 I8 N12 Zn4 -","4","1","HP2061","Wang, Hui; Zhao, Xue-Song; Luo, Jun-Shan; Tian, Yu-Peng","{9-Hexyl-2-[2-phenyl-6-(pyridin-2-yl)pyridin-4-yl]-9<i>H</i>-carbazole}diiodidozinc","Acta Crystallographica Section E","2013","69","10","m553","","10.1107/S1600536813025464","","","0.71073","MoKα","","0.0463","0.0392","","","0.1151","0.1217","","","","","","1.037","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238635","38.9622","0.0016","5.5684","0.0012","21.9564","0.0014","90","","117.738","0.002","90","","4216.2","1","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis((<i>E</i>)-2-{5,5-dimethyl-3-[4-(1<i>H</i>-1,2,4-triazol-1-yl-κ<i>N</i>^4^)styryl]cyclohex-2-enylidene}malononitrile)diiodidomercury(II)","","- C42 H38 Hg I2 N10 -","- C42 H38 Hg I2 N10 -","- C168 H152 Hg4 I8 N40 -","4","0.5","HY2634","Wang, Lian-Ke; Zhu, Wei-Ju; Zhou, Hong-Ping","Bis((<i>E</i>)-2-{5,5-dimethyl-3-[4-(1<i>H</i>-1,2,4-triazol-1-yl-κ<i>N</i>^4^)styryl]cyclohex-2-enylidene}malononitrile)diiodidomercury(II)","Acta Crystallographica Section E","2013","69","10","m556","m557","10.1107/S160053681302518X","","","0.71073","MoKα","","0.0379","0.0274","","","0.0667","0.0714","","","","","","1.01","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238636","15.3862","0.0019","8.2397","0.001","27.198","0.004","90","","90","","90","","3448.1","0.8","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis[μ-1-(3,5-dichloropyridin-2-yl)-2-(pyridin-3-ylmethylidene)hydrazine]bis[(nitrato-κ<i>O</i>)silver(I)] acetonitrile disolvate","","- C26 H22 Ag2 Cl4 N12 O6 -","- C26 H22 Ag2 Cl4 N12 O6 -","- C104 H88 Ag8 Cl16 N48 O24 -","4","0.5","HY2636","Guo, Ying; Cai, Hua","Bis[μ-1-(3,5-dichloropyridin-2-yl)-2-(pyridin-3-ylmethylidene)hydrazine]bis[(nitrato-κ<i>O</i>)silver(I)] acetonitrile disolvate","Acta Crystallographica Section E","2013","69","10","m525","","10.1107/S1600536813024021","","","0.71073","MoKα","","0.0493","0.0389","","","0.1049","0.1129","","","","","","1.076","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238637","7.207","0.0014","7.62","0.0015","15.109","0.003","92.62","0.03","90.19","0.03","92.15","0.03","828.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-(3-Methylphenyl)-5-(quinolin-8-ylmethoxy)-1,2,4-oxadiazole monohydrate","","- C19 H17 N3 O3 -","- C19 H17 N3 O3 -","- C38 H34 N6 O6 -","2","1","IM2428","Yang, Lu; Liu, Wei; Wang, Han; Chen, Xing-Wei; Wang, Hai-Bo","3-(3-Methylphenyl)-5-(quinolin-8-ylmethoxy)-1,2,4-oxadiazole monohydrate","Acta Crystallographica Section E","2013","69","10","o1541","","10.1107/S160053681302477X","","","0.71073","MoKα","","0.0922","0.054","","","0.137","0.1618","","","","","","1.002","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238638","42.892","0.009","13.335","0.003","14.234","0.003","90","","90","","90","","8141","3","295","2","295","2","","","","","","","","6","F d d 2","F 2 -2d","43","","2-Dichloromethyl-<i>N</i>-ethyl-5-(1-phenylsilolan-1-yl)cyclopent-3-enecarboxamide","","- C19 H25 Cl2 N O Si -","- C19 H25 Cl2 N O Si -","- C304 H400 Cl32 N16 O16 Si16 -","16","1","IM2436","Xiao, Han; Yang, Wan-Qiu; Shen, Liang","2-Dichloromethyl-<i>N</i>-ethyl-5-(1-phenylsilolan-1-yl)cyclopent-3-enecarboxamide","Acta Crystallographica Section E","2013","69","10","o1530","","10.1107/S160053681302446X","","","0.71073","MoKα","","0.0766","0.0476","","","0.0953","0.106","","","","","","1.029","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238639","4.7082","0.0005","12.2988","0.0008","10.0418","0.0007","90","","91.303","0.007","90","","581.32","0.08","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Hydroxy-6-methylpyridin-2(1<i>H</i>)-one","","- C6 H7 N O2 -","- C6 H7 N O2 -","- C24 H28 N4 O8 -","4","1","IM2437","Reyes, Héctor; Aguirre, Gerardo; Chávez, Daniel","4-Hydroxy-6-methylpyridin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2013","69","10","o1534","","10.1107/S1600536813024240","","","0.71073","MoKα","","0.0723","0.0502","","","0.1424","0.1602","","","","","","1.056","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238640","9.8813","0.0003","9.9921","0.0003","11.1587","0.0003","94.125","0.002","92.196","0.002","101.5","0.002","1075.27","0.05","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","8-Bromo-3-(4-ethylphenyl)-1-phenyl-3,3a,4,9b-tetrahydro-1<i>H</i>- chromeno[4,3-<i>c</i>]isoxazole-3a-carbonitrile","","- C25 H21 Br N2 O2 -","- C25 H21 Br N2 O2 -","- C50 H42 Br2 N4 O4 -","2","1","IS5299","Kanchanadevi, J.; Anbalagan, G.; Srinivasan, J.; Bakthadoss, M.; Gunasekaran, B.; Manivannan, V.","8-Bromo-3-(4-ethylphenyl)-1-phenyl-3,3a,4,9b-tetrahydro-1<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carbonitrile","Acta Crystallographica Section E","2013","69","10","o1533","","10.1107/S1600536813023982","","","0.71073","MoKα","","0.0806","0.0441","","","0.1081","0.1232","","","","","","1.016","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238641","9.111","0.002","14.753","0.003","14.427","0.002","90","","100.785","0.014","90","","1904.9","0.6","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6-[(4'-Ethoxycarbonyl-[1,1'-biphenyl]-4-yl)oxy]hexanoic acid","","- C21 H24 O5 -","- C21 H24 O5 -","- C84 H96 O20 -","4","1","IS5302","López-Velázquez, Delia; Mendoza, Angel","6-[(4'-Ethoxycarbonyl-[1,1'-biphenyl]-4-yl)oxy]hexanoic acid","Acta Crystallographica Section E","2013","69","10","o1588","","10.1107/S1600536813025877","","","0.71073","MoKα","","0.1272","0.0586","","","","0.171","","","","","","1.059","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238642","15.4821","0.0018","7.3938","0.0009","15.7137","0.0018","90","","91.477","0.004","90","","1798.2","0.4","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Azido(η^5^-pentamethylcyclopentadienyl)[2-(pyridin-2-yl)phenyl]iridium(III)","","- C21 H23 Ir N4 -","- C21 H23 Ir N4 -","- C84 H92 Ir4 N16 -","4","1","IS5306","Ariyoshi, Keita; Suzuki, Takayoshi","Azido(η^5^-pentamethylcyclopentadienyl)[2-(pyridin-2-yl)phenyl]iridium(III)","Acta Crystallographica Section E","2013","69","10","m566","","10.1107/S1600536813026159","","","0.71075","MoKα","","0.0177","0.0172","","","0.0421","0.0424","","","","","","1.129","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238643","10.007","0.009","14.747","0.012","12.399","0.011","90","","93.088","0.014","90","","1827","3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dibromidobis(2-methyl-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cadmium","","- C16 H16 Br2 Cd N4 -","- C16 H16 Br2 Cd N4 -","- C64 H64 Br8 Cd4 N16 -","4","1","KQ2008","Liu, Bao-Cheng; Jin, Yan-Ling; Liu, Fa-Qian","Dibromidobis(2-methyl-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cadmium","Acta Crystallographica Section E","2013","69","10","m536","","10.1107/S1600536813024549","","","0.71073","MoKα","","0.0494","0.0328","","","0.0729","0.0767","","","","","","1.001","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238644","13.148","0.005","28.64","0.007","9.757","0.004","90","","100.19","0.02","90","","3616","2","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","(<i>E</i>)-2-{[1-(3,11-Dimethyl-4-methylene-10-oxo-1-phenyl-4,5,10,11-tetrahydro-1<i>H</i>-benzo[<i>b</i>]pyrazolo[3,4-<i>f</i>][1,5]diazocin-5-yl)ethylidene]amino}-<i>N</i>-methyl-<i>N</i>-(3-methyl-1-phenyl-1<i>H</i>-pyrazol-5-yl)benzamide","","- C40 H36 N8 O2 -","- C40 H36 N8 O2 -","- C160 H144 N32 O8 -","4","1","LD2108","Meneghetti, Fiorella; Maggio, Benedetta","(<i>E</i>)-2-{[1-(3,11-Dimethyl-4-methylene-10-oxo-1-phenyl-4,5,10,11-tetrahydro-1<i>H</i>-benzo[<i>b</i>]pyrazolo[3,4-<i>f</i>][1,5]diazocin-5-yl)ethylidene]amino}-<i>N</i>-methyl-<i>N</i>-(3-methyl-1-phenyl-1<i>H</i>-pyrazol-5-yl)benzamide","Acta Crystallographica Section E","2013","69","10","o1583","","10.1107/S1600536813025671","","","0.71073","MoKα","","0.1212","0.0378","","","0.0826","0.0971","","","","","","0.905","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238645","8.4392","0.0006","10.6683","0.0007","11.0755","0.0008","100.623","0.006","103.867","0.006","110.55","0.006","866.05","0.12","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","3-(4-Hydroxyphenyl)-1,5-bis(pyridin-2-yl)pentane-1,5-dione","","- C21 H18 N2 O3 -","- C21 H18 N2 O3 -","- C42 H36 N4 O6 -","2","1","LD2113","Pan, Lixia; Shi, Huaduan; Ma, Zhen","3-(4-Hydroxyphenyl)-1,5-bis(pyridin-2-yl)pentane-1,5-dione","Acta Crystallographica Section E","2013","69","10","o1580","","10.1107/S1600536813025518","","","0.71073","MoKα","","0.062","0.0425","","","0.1029","0.1186","","","","","","1.034","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238646","14.9967","0.0003","7.4039","0.0002","17.5795","0.0004","90","","114.08","0.001","90","","1782.06","0.07","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Methoxy-4-(2,4,5-trimethoxyphenyl)-2,2'-bipyridine-5-carbonitrile","","- C21 H19 N3 O4 -","- C21 H19 N3 O4 -","- C84 H76 N12 O16 -","4","1","LH5641","Chantrapromma, Suchada; Suwunwong, Thitipone; Ruanwas, Pumsak; Quah, Ching Kheng; Fun, Hoong-Kun","6-Methoxy-4-(2,4,5-trimethoxyphenyl)-2,2'-bipyridine-5-carbonitrile","Acta Crystallographica Section E","2013","69","10","o1500","o1501","10.1107/S1600536813023891","","","0.71073","MoKα","","0.0501","0.0423","","","0.1091","0.1157","","","","","","1.029","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238647","13.366","0.002","10.2326","0.0017","19.891","0.003","90","","113.004","0.008","90","","2504.1","0.7","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-2-[4-(Diethylamino)styryl]-1-methylquinolinium 4-fluorobenzenesulfonate monohydrate","","- C28 H31 F N2 O4 S -","- C28 H31 F N2 O4 S -","- C112 H124 F4 N8 O16 S4 -","4","1","LH5643","Fun, Hoong-Kun; Kaewmanee, Narissara; Chanawanno, Kullapa; Boonnak, Nawong; Chantrapromma, Suchada","(<i>E</i>)-2-[4-(Diethylamino)styryl]-1-methylquinolinium 4-fluorobenzenesulfonate monohydrate","Acta Crystallographica Section E","2013","69","10","o1510","o1511","10.1107/S1600536813023532","","","0.71073","MoKα","","0.0763","0.0584","","","0.1569","0.1724","","","","","","1.043","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238648","12.1162","0.0005","11.9638","0.0005","24.9181","0.0009","90","","90","","90","","3612","0.2","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tricarbonylchlorido(6',7'-dihydro-5'<i>H</i>-spiro[cyclopentane-1,6'-dipyrido[3,2-<i>d</i>:2',3'-<i>f</i>][1,3]diazepine]-κ^2^<i>N</i>^1^,<i>N</i>^11^)rhenium(I)","","- C18 H16 Cl N4 O3 Re -","- C18 H16 Cl N4 O3 Re -","- C144 H128 Cl8 N32 O24 Re8 -","8","1","LH5644","Clegg, Oliver R.; Harding, Lindsay P.; Miller, John W.; Rice, Craig R.","Tricarbonylchlorido(6',7'-dihydro-5'<i>H</i>-spiro[cyclopentane-1,6'-dipyrido[3,2-<i>d</i>:2',3'-<i>f</i>][1,3]diazepine]-κ^2^<i>N</i>^1^,<i>N</i>^11^)rhenium(I)","Acta Crystallographica Section E","2013","69","10","m526","","10.1107/S1600536813023076","","","0.71073","MoKα","","0.0611","0.0372","","","0.0676","0.0749","","","","","","1.041","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238649","12.6794","0.0006","11.904","0.0006","12.7732","0.0006","90","","97.066","0.001","90","","1913.29","0.16","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tricarbonylchlorido(6',7'-dihydro-5'<i>H</i>-spiro[cyclohexane-1,6'-dipyrido[3,2-<i>d</i>:2',3'-<i>f</i>][1,3]diazepine]-κ^2^<i>N</i>^1^,<i>N</i>^11^)rhenium(I)","","- C19 H18 Cl N4 O3 Re -","- C19 H18 Cl N4 O3 Re -","- C76 H72 Cl4 N16 O12 Re4 -","4","1","LH5645","Clegg, Oliver R.; Harding, Lindsay P.; Miller, John W.; Rice, Craig R.","Tricarbonylchlorido(6',7'-dihydro-5'<i>H</i>-spiro[cyclohexane-1,6'-dipyrido[3,2-<i>d</i>:2',3'-<i>f</i>][1,3]diazepine]-κ^2^<i>N</i>^1^,<i>N</i>^11^)rhenium(I)","Acta Crystallographica Section E","2013","69","10","m527","","10.1107/S1600536813024288","","","0.71073","MoKα","","0.0408","0.0265","","","0.0479","0.0509","","","","","","1.044","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238650","9.0025","0.0002","9.5921","0.0002","11.9914","0.0002","105.268","0.0008","103.48","0.0008","102.26","0.0008","929.15","0.03","90","0.2","90","0.2","","","","","","","","7","P -1","-P 1","2","","Bis[1-methoxy-2,2,2-tris(pyrazol-1-yl-κ<i>N</i>^2^)ethane]nickel(II) bis(trifluoromethanesulfonate) methanol disolvate","","- C28 H36 F6 N12 Ni O10 S2 -","- C28 H36 F6 N12 Ni O10 S2 -","- C28 H36 F6 N12 Ni O10 S2 -","1","0.5","LH5647","Lyubartseva, Ganna; Parkin, Sean; Mallik, Uma Prasad","Bis[1-methoxy-2,2,2-tris(pyrazol-1-yl-κ<i>N</i>^2^)ethane]nickel(II) bis(trifluoromethanesulfonate) methanol disolvate","Acta Crystallographica Section E","2013","69","10","m537","","10.1107/S1600536813024653","","","0.71073","MoKα","","0.0639","0.0428","","","0.0953","0.1052","","","","","","1.095","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238651","8.3121","0.0008","6.0287","0.0006","35.93","0.003","90","","90","","90","","1800.5","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Poly[μ~5~-(4-methoxybenzenesulfonato)-sodium]","","- C7 H7 Na O4 S -","- C7 H7 Na O4 S -","- C56 H56 Na8 O32 S8 -","8","1","LH5648","Chantrapromma, Suchada; Boonnak, Nawong; Fun, Hoong-Kun","Poly[μ~5~-(4-methoxybenzenesulfonato)-sodium]","Acta Crystallographica Section E","2013","69","10","m558","","10.1107/S1600536813025919","","","0.71073","MoKα","","0.0375","0.0369","","","0.1003","0.1007","","","","","","1.202","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238652","9.5637","0.0004","5.567","0.0002","32.0682","0.0012","90","","92.901","0.002","90","","1705.16","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Tetrakis(acetonitrile)copper(I) hydrogen oxalate","Tetrakis(acetonitrile)copper(I) hydrogen oxalate‒oxalic acid‒acetonitrile (1/0.5/0.5)","","- C12 H15.5 Cu N4.5 O6 -","- C12 H15.5 Cu N4.5 O6 -","- C48 H62 Cu4 N18 O24 -","4","1","LH5649","Royappa, A. Timothy; Stepherson, Jacob R.; Vu, Oliver D.; Royappa, Andrew D.; Stern, Charlotte L.; Müller, Peter","Tetrakis(acetonitrile)copper(I) hydrogen oxalate‒oxalic acid‒acetonitrile (1/0.5/0.5)","Acta Crystallographica Section E","2013","69","10","m544","","10.1107/S1600536813024914","","","1.54184","CuKα","","0.0382","0.0362","","","0.0964","0.0976","","","","","","1.121","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238653","11.933","0.002","9.132","0.004","21.441","0.003","90","","101.2","0.02","90","","2292","1.1","293","2","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>m</i>-Xylylenediaminium diaquabis[dihydrogen diphosphato(2-)]cobaltate(II) dihydrate","","- C8 H26 Co N2 O18 P4 -","- C8 H26 Co N2 O18 P4 -","- C32 H104 Co4 N8 O72 P16 -","4","0.5","LH5650","Elboulali, Adel; Akriche, Samah; Rzaigui, Mohamed","<i>m</i>-Xylylenediaminium diaquabis[dihydrogen diphosphato(2{-})]cobaltate(II) dihydrate","Acta Crystallographica Section E","2013","69","10","m545","m546","10.1107/S160053681302535X","","","0.56087","AgKα","","0.0604","0.0354","","","0.0816","0.0897","","","","","","1.058","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238654","17.3913","0.001","12.9247","0.0007","13.2214","0.0007","90","","123.248","0.005","90","","2485.4","0.3","223.15","","223.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ<i>O</i>)zinc(II) propane-1,2-diol monosolvate","","- C27 H24 N4 O6 S Zn -","- C27 H24 N4 O6 S Zn -","- C108 H96 N16 O24 S4 Zn4 -","4","0.5","LH5651","Zhong, Kai-Long","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ<i>O</i>)zinc(II) propane-1,2-diol monosolvate","Acta Crystallographica Section E","2013","69","10","m561","","10.1107/S160053681302610X","","","0.71073","MoKα","","0.0504","0.0409","","","0.0958","0.1024","","","","","","1.056","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238655","8.201","0.001","17.887","0.003","11.863","0.002","90","","92.444","0.003","90","","1738.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","{5,5'-Dihydroxy-2,2'-[(2-hydroxypropane-1,3-diyl)bis(nitrilomethanylylidene)]diphenolato}nickel(II) dihydrate","","- C17 H20 N2 Ni O7 -","- C17 H20 N2 Ni O7 -","- C68 H80 N8 Ni4 O28 -","4","1","MW2116","Datta, Amitabha; Huang, Jui-Hsien; Sheu, Shiann-Cherng","{5,5'-Dihydroxy-2,2'-[(2-hydroxypropane-1,3-diyl)bis(nitrilomethanylylidene)]diphenolato}nickel(II) dihydrate","Acta Crystallographica Section E","2013","69","10","m559","m560","10.1107/S1600536813026007","","","0.71069","MoKα","","0.0611","0.0373","","","0.0834","0.0934","","","","","","1.037","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238656","12.1005","0.0009","12.5711","0.0009","15.7032","0.0011","80.047","0.001","75.377","0.001","71.449","0.001","2180.1","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","Tris[4-(dimethylamino)pyridine][tris(pyrazol-1-yl)methane]ruthenium(II) bis(hexafluoridophosphate) diethyl ether monosolvate","","- C35 H50 F12 N12 O P2 Ru -","- C35 H50 F12 N12 O P2 Ru -","- C70 H100 F24 N24 O2 P4 Ru2 -","2","1","NC2317","Coe, Benjamin J.; Raftery, James; Rusanova, Daniela","Tris[4-(dimethylamino)pyridine][tris(pyrazol-1-yl)methane]ruthenium(II) bis(hexafluoridophosphate) diethyl ether monosolvate","Acta Crystallographica Section E","2013","69","10","m549","m550","10.1107/S1600536813025245","","","0.71073","MoKα","","0.0799","0.0574","","","0.1039","0.1135","","","","","","0.945","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238657","10.294","0.003","15.617","0.005","16.082","0.005","90.984","0.007","103.01","0.008","103.869","0.008","2438.6","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(2,3,5,6-Tetrafluorophenolato)[5,10,15,20-tetrakis(4-methoxyphenyl)porphyrinato]iron(III) cyclohexane monosolvate","","- C60 H49 F4 Fe N4 O5 -","- C60 H49 F4 Fe N4 O5 -","- C120 H98 F8 Fe2 N8 O10 -","2","1","NG5339","Xu, Nan; Powell, Douglas R.; Richter-Addo, George B.","(2,3,5,6-Tetrafluorophenolato)[5,10,15,20-tetrakis(4-methoxyphenyl)porphyrinato]iron(III) cyclohexane monosolvate","Acta Crystallographica Section E","2013","69","10","m530","m531","10.1107/S1600536813021880","","","0.71073","MoKα","","0.0964","0.06","","","0.1419","0.159","","","","","","1.038","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238658","18.2954","0.0009","11.6004","0.0006","15.3351","0.0006","90","","104.963","0.003","90","","3144.3","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[μ-3,3'-Bis(trihydroboryl)[3]ferrocenophane]bis(chloridozirconocene)","","- C33 H38 B2 Cl2 Fe Zr2 -","- C33 H38 B2 Cl2 Fe Zr2 -","- C132 H152 B8 Cl8 Fe4 Zr8 -","4","1","NG5341","Reichert, Adelina; Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael","[μ-3,3'-Bis(trihydroboryl)[3]ferrocenophane]bis(chloridozirconocene)","Acta Crystallographica Section E","2013","69","10","m534","m535","10.1107/S1600536813023933","","","0.71073","MoKα","","0.0866","0.0476","","","0.0998","0.1118","","","","","","0.936","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238659","7.3847","0.0003","25.2814","0.0015","6.1097","0.0003","90","","94.85","0.02","90","","1136.57","0.1","295","2","295","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Tamarugite","Sodium aluminium bis(sulfate) hexahydrate","","- Al H12 Na O14 S2 -","- Al H12 Na O14 S2 -","- Al4 H48 Na4 O56 S8 -","4","1","PJ2005","Mereiter, Kurt","Redetermination of tamarugite, NaAl(SO~4~)~2~·6H~2~O","Acta Crystallographica Section E","2013","69","10","i63","i64","10.1107/S1600536813025154","","","0.71073","MoKα","","0.0339","0.025","","","0.0582","0.0612","","","","","","1.141","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238660","5.503","0.004","8.113","0.001","9.122","0.002","99.65","0.02","103.69","0.03","98.86","0.02","382","0.3","293","2","293","2","","","","","","","","3","P 1","P 1","1","3methyl-DAG","1,2:5,6-Di-<i>O</i>-isopropylidene-3-<i>C</i>-methyl-α-<i>D</i>-allofuranose","","- C13 H22 O6 -","- C13 H22 O6 -","- C13 H22 O6 -","1","1","PK2484","da Forezi, Luana; Silva, Marcos Moitrel Pequeno; da Santos, Fernanda; Ferreira, Vitor Francisco; Souza, Maria Cecília Bastos Vieira de","1,2:5,6-Di-<i>O</i>-isopropylidene-3-<i>C</i>-methyl-α-<small>D</small>-allofuranose","Acta Crystallographica Section E","2013","69","10","o1512","","10.1107/S1600536813022447","","","0.71073","MoKα","","0.0687","0.046","","","","0.1304","","","","","","1.042","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238661","22.287","0.004","12.676","0.002","13.339","0.002","90","","98.51","0.004","90","","3726.9","1.1","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","(2,3,5,6-Tetrafluorophenolato-κ<i>O</i>)(5,10,15,20-tetraphenylporphyrinato)iron(III)","","- C50 H29 F4 Fe N4 O -","- C50 H29 F4 Fe N4 O -","- C200 H116 F16 Fe4 N16 O4 -","4","1","PK2492","Xu, Nan; Powell, Douglas R.; Richter-Addo, George B.","(2,3,5,6-Tetrafluorophenolato-κ<i>O</i>)(5,10,15,20-tetraphenylporphyrinato)iron(III)","Acta Crystallographica Section E","2013","69","10","m564","m565","10.1107/S160053681302607X","","","0.71073","MoKα","","0.0961","0.0558","","","0.1026","0.1155","","","","","","1.009","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238662","16.251","0.003","10.473","0.002","19.973","0.004","90","","90","","90","","3399.3","1.1","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(6,6-Dimethyl-1-phenyl-6,7-dihydro-5<i>H</i>-pyrrolizin-2-yl)(thiophen-2-yl)methanone","","- C20 H19 N O S -","- C20 H19 N O S -","- C160 H152 N8 O8 S8 -","8","1","PK2493","Liu, Yu-min; Zhong, Jia-liang; Sun, Wen-xia; Zhang, Fu-li; Liu, He","(6,6-Dimethyl-1-phenyl-6,7-dihydro-5<i>H</i>-pyrrolizin-2-yl)(thiophen-2-yl)methanone","Acta Crystallographica Section E","2013","69","10","o1513","","10.1107/S1600536813023489","","","0.71073","MoKα","","0.0698","0.0462","","","0.1194","0.1314","","","","","","1.032","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238663","7.73182","0.00011","10.77708","0.00013","25.6818","0.0005","90","","98.4034","0.0015","90","","2117","0.06","100","1","100","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","indenyliridiumbisethylene","Bis(η^2^-ethylene)(η^5^-indenyl)iridium(I)","","- C13 H15 Ir -","- C13 H15 Ir -","- C104 H120 Ir8 -","8","2","PK2496","Merola, Joseph S.","Bis(η^2^-ethylene)(η^5^-indenyl)iridium(I)","Acta Crystallographica Section E","2013","69","10","m547","","10.1107/S1600536813025300","","","0.7107","MoKα","","0.0254","0.0243","","","0.0544","0.0548","","","","","","1.46","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238664","10.522","0.0015","11.8295","0.0016","11.987","0.003","112.871","0.011","97.939","0.011","110.123","0.008","1225.4","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","[(4<i>E</i>)-3-Ethyl-1-methyl-2,6-diphenylpiperidin-4-ylidene]amino 3-methylbenzoate","","- C28 H30 N2 O2 -","- C28 H30 N2 O2 -","- C56 H60 N4 O4 -","2","1","PV2635","Vinuchakkaravarthy, T.; Sivakumar, R.; Srinivasan, T.; Thanikachalam, V.; Velmurugan, D.","[(4<i>E</i>)-3-Ethyl-1-methyl-2,6-diphenylpiperidin-4-ylidene]amino 3-methylbenzoate","Acta Crystallographica Section E","2013","69","10","o1545","","10.1107/S1600536813024276","","","0.71073","MoKα","","0.0655","0.0457","","","0.1238","0.139","","","","","","1.03","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238665","17.3582","0.0015","18.5489","0.0013","8.9213","0.0008","90","","90","","90","","2872.4","0.4","293","2","293","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","Ethyl 1'-methyl-2-oxo-4'-[(3a<i>R</i>,5<i>R</i>,5a<i>S</i>,8a<i>S</i>,8b<i>R</i>)-2,2,7,7-tetramethyltetrahydro-3a<i>H</i>-bis[1,3]dioxolo[4,5-<i>b</i>:4',5'-<i>d</i>]pyran-5-yl]-2<i>H</i>-spiro[acenaphthylene-1,2'-pyrrolidine]-3'-carboxylate","","- C30 H35 N O8 -","- C30 H35 N O8 -","- C120 H140 N4 O32 -","4","1","PV2644","Jagadeesan, G.; Sethusankar, K.; Prasanna, R.; Raghunathan, R.","Ethyl 1'-methyl-2-oxo-4'-[(3a<i>R</i>,5<i>R</i>,5a<i>S</i>,8a<i>S</i>,8b<i>R</i>)-2,2,7,7-tetramethyltetrahydro-3a<i>H</i>-bis[1,3]dioxolo[4,5-<i>b</i>:4',5'-<i>d</i>]pyran-5-yl]-2<i>H</i>-spiro[acenaphthylene-1,2'-pyrrolidine]-3'-carboxylate","Acta Crystallographica Section E","2013","69","10","o1517","o1518","10.1107/S1600536813024586","","","0.71073","MoKα","","0.0635","0.0388","","","0.0872","0.0987","","","","","","1.033","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238666","5.5582","0.0006","12.8881","0.0015","14.8377","0.0011","90","","98.782","0.008","90","","1050.43","0.19","150","0.1","150","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,6-Dibromo-<i>N</i>-{3-[(4,6-dibromo-2,3-dimethylphenyl)imino]butan-2-ylidene}-2,3-dimethylaniline","","- C20 H20 Br4 N2 -","- C20 H20 Br4 N2 -","- C40 H40 Br8 N4 -","2","0.5","RK2409","Huang, Lina; Du, Zhengyin; Liu, Wei; Che, Fushou","4,6-Dibromo-<i>N</i>-{3-[(4,6-dibromo-2,3-dimethylphenyl)imino]butan-2-ylidene}-2,3-dimethylaniline","Acta Crystallographica Section E","2013","69","10","o1496","","10.1107/S1600536813023921","","","1.5418","CuKα","","0.0474","0.0442","","","0.1311","0.1345","","","","","","1.113","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238667","11.2292","0.0003","12.4823","0.0003","24.444","0.0005","76.07","0.001","78.08","0.001","66.917","0.001","3034.98","0.13","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","3,3''-Bis(9-hydroxyfluoren-9-yl)-1,1':3',1''-terphenyl","","- C44 H30 O2 -","- C44 H30 O2 -","- C176 H120 O8 -","4","2","RK2410","Skobridis, Konstantinos; Theodorou, Vassiliki; Paraskevopoulos, Georgios; Seichter, Wilhelm; Weber, Edwin","3,3''-Bis(9-hydroxyfluoren-9-yl)-1,1':3',1''-terphenyl","Acta Crystallographica Section E","2013","69","10","o1514","o1515","10.1107/S1600536813024033","","","0.71073","MoKα","","0.0705","0.0439","","","0.0965","0.1088","","","","","","1.028","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238668","5.392","0.002","9.204","0.002","15.841","0.006","81.58","0.02","81.98","0.02","89.13","0.03","770.1","0.4","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Ethyl <i>N</i>-(2-acetyl-3-oxo-1-phenylbutyl)carbamate","","- C15 H19 N O4 -","- C15 H19 N O4 -","- C30 H38 N2 O8 -","2","1","RK2414","Volov, Alexander N.; Zamilatskov, Ilia A.","Ethyl <i>N</i>-(2-acetyl-3-oxo-1-phenylbutyl)carbamate","Acta Crystallographica Section E","2013","69","10","o1529","","10.1107/S1600536813024884","","","1.54184","CuKα","","0.0998","0.0677","","","0.1991","0.2308","","","","","","1.044","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238669","13.076","0.004","20.581","0.005","6.725","0.003","90","","104.1","0.03","90","","1755.3","1.1","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4'-Acetyl-3''-carbamoyl-[1,1':3',1''-terphenyl]-2-carboxylic acid","","- C22 H17 N O4 -","- C22 H17 N O4 -","- C88 H68 N4 O16 -","4","1","RN2118","Ishikawa, Yoshinobu; Yoshida, Nanako; Suzuki, Takafumi","4'-Acetyl-3''-carbamoyl-[1,1':3',1''-terphenyl]-2-carboxylic acid","Acta Crystallographica Section E","2013","69","10","o1596","","10.1107/S1600536813026482","","","0.71069","MoKα","","","0.0498","","","","0.1324","","","","","","1.011","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238670","9.8647","0.0001","9.8647","0.0001","19.5957","0.0003","90","","90","","120","","1651.43","0.03","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","Tetrasodium pentadecamolybdenum nonadecaselenide","","- Mo15 Na3.88 Se19 -","- Mo15 Na3.884 Se19 -","- Mo30 Na7.768 Se38 -","2","0.166667","RU2054","Salloum, Diala; Gougeon, Patrick; Gall, Philippe","Na~3.88~Mo~15~Se~19~: a novel ternary reduced molybdenum selenide containing Mo~6~ and Mo~9~ clusters","Acta Crystallographica Section E","2013","69","10","i67","i68","10.1107/S1600536813025907","","","0.71069","MoKα","","0.0427","0.0326","","","0.0787","0.0836","","","","","","1.056","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238671","7.5319","0.0008","12.9302","0.0014","32.3268","0.0018","90","","90","","90","","3148.3","0.5","200","1","200","1","","","","","","","","5","C 2 2 21","C 2c 2","20","4-methoxyanilinium hydrogen 4,5-dichlorophthalate","4-Methoxyanilinium 2-carboxy-4,5-dichlorobenzoate","","- C15 H13 Cl2 N O5 -","- C15 H13 Cl2 N O5 -","- C120 H104 Cl16 N8 O40 -","8","1","SJ5350","Smith, Graham; Wermuth, Urs D.","4-Methoxyanilinium 2-carboxy-4,5-dichlorobenzoate","Acta Crystallographica Section E","2013","69","10","o1546","","10.1107/S1600536813025014","","","0.71073","MoKα","","0.0696","0.0668","","","0.1165","0.1173","","","","","","1.423","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238672","11.98275","0.00018","38.5234","0.0006","16.4239","0.0002","90","","94.197","0.0014","90","","7561.21","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","3-(1<i>H</i>-Imidazol-1-yl)propanaminium picrate","3-(1<i>H</i>-Imidazol-1-yl)propanaminium 2,4,6-trinitrophenolate","","- C12 H14 N6 O7 -","- C12 H14 N6 O7 -","- C240 H280 N120 O140 -","20","5","SJ5352","Yamuna, T. S.; Jasinski, Jerry P.; Duff, Courtney E.; Yathirajan, H. S.; Kaur, Manpreet","3-(1<i>H</i>-Imidazol-1-yl)propanaminium picrate","Acta Crystallographica Section E","2013","69","10","o1572","o1573","10.1107/S1600536813025646","","","1.54184","CuKα","","0.053","0.0422","","","0.1082","0.1163","","","","","","1.021","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238673","11.6215","0.0006","17.105","0.0011","12.3381","0.0008","90","","114.431","0.002","90","","2233","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3'-[(1<i>H</i>-Indol-3-yl)carbonyl]-1'-methyl-2-oxo-4'-(thiophen-\ 2-yl)spiro[indoline-3,2'-pyrrolidine]-3'-carbonitrile","","- C26 H20 N4 O2 S -","- C26 H20 N4 O2 S -","- C104 H80 N16 O8 S4 -","4","1","SU2642","Inglebert, S. Antony; Arun, Yuvaraj; Sethusankar, K.; Perumal, Paramasivam T.","3'-[(1<i>H</i>-Indol-3-yl)carbonyl]-1'-methyl-2-oxo-4'-(thiophen-2-yl)spiro[indoline-3,2'-pyrrolidine]-3'-carbonitrile","Acta Crystallographica Section E","2013","69","10","o1585","","10.1107/S1600536813025890","","","0.71073","MoKα","","0.1036","0.0733","","","0.222","0.2523","","","","","","1.073","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238674","8.0209","0.0002","7.8762","0.0002","20.4293","0.0005","90","","99.066","0.002","90","","1274.48","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Dimethyl-<i>N</i>-(2-methylphenyl)-1,3-dioxan-4-amine","","- C13 H19 N O2 -","- C13 H19 N O2 -","- C52 H76 N4 O8 -","4","1","SU2643","Fatima, Zeenat; Rambabu, Gottimukkala; Reddy, Bandapalli Palakshi; Vijayakumar, Vijayaparthasarathi; Velmurugan, Devadasan","2,6-Dimethyl-<i>N</i>-(2-methylphenyl)-1,3-dioxan-4-amine","Acta Crystallographica Section E","2013","69","10","o1561","","10.1107/S1600536813025294","","","0.71073","MoKα","","0.0517","0.0399","","","0.1089","0.1186","","","","","","1.032","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238675","5.2466","0.0007","17.973","0.002","14.8785","0.0018","90","","94.018","0.003","90","","1399.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","methyl 4-(benzyloxy)-3-methoxybenzoate","Methyl 4-(benzyloxy)-3-methoxybenzoate","","- C16 H16 O4 -","- C16 H16 O4 -","- C64 H64 O16 -","4","1","SU2645","Wang, Kai; Ju, ChaoFan; Xiao, Jian; Chen, Qiang","Methyl 4-(benzyloxy)-3-methoxybenzoate","Acta Crystallographica Section E","2013","69","10","o1562","","10.1107/S1600536813025415","","","0.71073","MoKα","","0.073","0.0452","","","0.12","0.1377","","","","","","0.909","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238676","9.9367","0.0005","13.566","0.0006","10.3206","0.0005","90","","115.543","0.003","90","","1255.25","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(4-Bromophenyl)-2,6-dimethyl-1,3-dioxan-4-amine","","- C12 H16 Br N O2 -","- C12 H16 Br N O2 -","- C48 H64 Br4 N4 O8 -","4","1","SU2646","Fatima, Zeenat; Rambabu, Gottimukkala; Reddy, Bandapalli Palakshi; Vijayakumar, Vijayaparthasarathi; Velmurugan, Devadasan","<i>N</i>-(4-Bromophenyl)-2,6-dimethyl-1,3-dioxan-4-amine","Acta Crystallographica Section E","2013","69","10","o1579","","10.1107/S1600536813025750","","","0.71073","MoKα","","0.0853","0.0366","","","0.0794","0.0917","","","","","","1.013","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238677","14.8688","0.0002","6.895","0.00012","16.3546","0.0003","90","","99.5834","0.0016","90","","1653.28","0.05","120","2","120","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","1-(4-{[(1,3,3-Trimethylindolin-2-ylidene)methyl]diazenyl}phenyl)ethanone","","- C20 H21 N3 O -","- C20 H21 N3 O -","- C80 H84 N12 O4 -","4","0.5","TK5249","Gainsford, Graeme J.; Ashraf, Mohamed; Bhuiyan, M. Delower H.; Kay, Andrew J.","1-(4-{[(1,3,3-Trimethylindolin-2-ylidene)methyl]diazenyl}phenyl)ethanone","Acta Crystallographica Section E","2013","69","10","o1499","","10.1107/S1600536813024124","","","1.5418","CuKα","","0.0395","0.0357","","","0.0947","0.0982","","","","","","1.067","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238678","8.5582","0.0002","9.6515","0.0002","12.2347","0.0002","110.399","0.001","103.665","0.001","97.317","0.001","895.66","0.03","90","0.2","90","0.2","","","","","","","","7","P -1","-P 1","2","","Bis[1-methoxy-2,2,2-tris(pyrazol-1-yl-κ<i>N</i>^2^)ethane]nickel(II) bis(trifluoromethanesulfonate) dihydrate","","- C26 H32 F6 N12 Ni O10 S2 -","- C26 H32 F6 N12 Ni O10 S2 -","- C26 H32 F6 N12 Ni O10 S2 -","1","0.5","TK5252","Lyubartseva, Ganna; Parkin, Sean; Mallik, Uma Prasad","Bis[1-methoxy-2,2,2-tris(pyrazol-1-yl-κ<i>N</i>^2^)ethane]nickel(II) bis(trifluoromethanesulfonate) dihydrate","Acta Crystallographica Section E","2013","69","10","m532","m533","10.1107/S1600536813024252","","","0.71073","MoKα","","0.0329","0.0291","","","0.0701","0.0719","","","","","","1.066","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238679","16.8684","0.0006","8.3754","0.0003","15.993","0.0006","90","","96.658","0.001","90","","2244.25","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","14a-Hydroxy-12-methyl-10-(4-methylphenyl)-8,9,9a,10,12,13,14,14a-octahydro-10a,14-methano-5<i>H</i>-indeno[2',1':4,5]azepino[3,4-<i>b</i>]pyrrolizine-5,15(7<i>H</i>,11<i>H</i>)-dione","","- C27 H28 N2 O3 -","- C27 H28 N2 O3 -","- C108 H112 N8 O12 -","4","1","TK5254","Nagalakshmi, R. A.; Suresh, J.; Malathi, K.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","14a-Hydroxy-12-methyl-10-(4-methylphenyl)-8,9,9a,10,12,13,14,14a-octahydro-10a,14-methano-5<i>H</i>-indeno[2',1':4,5]azepino[3,4-<i>b</i>]pyrrolizine-5,15(7<i>H</i>,11<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","10","o1581","","10.1107/S1600536813025592","","","0.71073","MoKα","","0.0847","0.0531","","","0.1396","0.1606","","","","","","1.021","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238680","10.7444","0.0009","14.847","0.002","6.7223","0.0008","90","","105.51","0.02","90","","1033.3","0.2","298","2","298","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Tetrasodium lithium cobalt aluminium hexa(orthoarsenate)","","- Al0.71 As6 Co5.67 Li0.62 Na4 O24 -","- Al0.714 As6 Co5.666 Li0.62 Na4 O24 -","- Al1.428 As12 Co11.332 Li1.24 Na8 O48 -","2","0.25","VN2076","Marzouki, Riadh; Frigui, Wafa; Guesmi, Abderrahmen; Zid, Mohamed Faouzi; Driss, Ahmed","β-Xenophyllite-type Na~4~Li~0.62~Co~5.67~Al~0.71~(AsO~4~)~6~","Acta Crystallographica Section E","2013","69","10","i65","i66","10.1107/S1600536813025233","","","0.71073","MoKα","","0.0316","0.0261","","","0.0659","0.0683","","","","","","1.126","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238681","14.6401","0.0002","14.6401","0.0002","17.7899","0.0003","90","","90","","90","","3812.95","0.1","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Dichloridodiphenylbis(thiourea-κ<i>S</i>)tin(IV)","","- C14 H18 Cl2 N4 S2 Sn -","- C14 H18 Cl2 N4 S2 Sn -","- C112 H144 Cl16 N32 S16 Sn8 -","8","0.5","WM2764","Sow, Yaya; Diop, Libasse; Molloy, Kieran C.; Kociok-Köhn, Gabriele","Dichloridodiphenylbis(thiourea-κ<i>S</i>)tin(IV)","Acta Crystallographica Section E","2013","69","10","m539","m540","10.1107/S1600536813024343","","","0.71073","MoKα","","0.0259","0.0193","","","0.0476","0.0513","","","","","","1.059","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238682","11.6933","0.0005","11.7463","0.0005","12.2301","0.0006","114.236","0.005","101.68","0.004","104.123","0.004","1395.8","0.14","175","","175","","","","","","","","","5","P -1","-P 1","2","","Tetrabutylammonium butyltetrachloridostannate(IV)","","- C20 H45 Cl4 N Sn -","- C20 H45 Cl4 N Sn -","- C40 H90 Cl8 N2 Sn2 -","2","1","WM2766","Diop, Tidiane; van der Lee, Arie; Diop, Libasse","Tetrabutylammonium butyltetrachloridostannate(IV)","Acta Crystallographica Section E","2013","69","10","m562","m563","10.1107/S1600536813026172","","","0.71073","MoKα","","0.0638","0.0494","","0.0879","0.0757","0.0876","","","","","","0.9686","","","","has coordinates","209451","2020-10-21","18:00:00",""
"2238683","6.4987","0.0005","6.6196","0.0005","13.2978","0.0009","87.418","0.004","85.702","0.004","60.854","0.003","498.19","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","yttrium fluoride disilicate ortho-silicate","Tetrayttrium difluoride disilicate orthosilicate","","- F2 O11 Si3 Y4 -","- F2 O11 Si3 Y4 -","- F4 O22 Si6 Y8 -","2","1","WM2768","Schäfer, Marion C.; Hartenbach, Ingo; Schleid, Thomas","Tetrayttrium difluoride disilicate orthosilicate, Y~4~F~2~[Si~2~O~7~][SiO~4~]","Acta Crystallographica Section E","2013","69","10","i71","","10.1107/S1600536813026391","","","0.71073","MoKα","","0.121","0.0549","","","0.0884","0.1067","","","","","","0.982","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238684","8.4625","0.0004","8.556","0.0003","14.5344","0.0005","90","","125.186","0.002","90","","860.08","0.06","290","1","290","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Trilithium dichromium(III) tris(orthophosphate)","","- Cr2 Li3 O12 P3 -","- Cr2 Li2.99 O12 P3 -","- Cr8 Li11.96 O48 P12 -","4","1","WM2772","Sun, Joobin; Kim, Pilsoo; Yun, Hoseop","The monoclinic form of trilithium dichromium(III) tris(orthophosphate)","Acta Crystallographica Section E","2013","69","10","i72","","10.1107/S1600536813026433","","","0.71073","MoKα","","0.027","0.0257","","","","0.0679","","","","","","1.138","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2238685","13.604","0.003","15.56","0.003","11.274","0.002","90","","112.66","0.03","90","","2202.2","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 3,3'-(phenylmethylene)bis(1<i>H</i>-indole-2-carboxylate)","","- C27 H22 N2 O4 -","- C27 H22 N2 O4 -","- C108 H88 N8 O16 -","4","1","XU5723","Sun, Hong-Shun; Li, Yu-Long; Xu, Ning; Xu, Hong; Zhang, Ji-Dong","Dimethyl 3,3'-(phenylmethylene)bis(1<i>H</i>-indole-2-carboxylate)","Acta Crystallographica Section E","2013","69","10","o1516","","10.1107/S1600536813024471","","","0.71073","MoKα","","0.1213","0.0617","","","0.1473","0.1809","","","","","","1.001","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238686","13.024","0.003","8.411","0.0017","23.143","0.005","90","","90","","90","","2535.2","1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","2-(Benzylcarbamoyl)nicotinic acid","2-(Benzylcarbamoyl)pyridine-3-carboxylic acid","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C112 H96 N16 O24 -","8","1","XU5724","Mao, Yan-Cao; Wu, Hao; Shan, Jin-Jun; Yan, Ke","2-(Benzylcarbamoyl)nicotinic acid","Acta Crystallographica Section E","2013","69","10","o1520","","10.1107/S1600536813024483","","","0.71073","MoKα","","0.1133","0.0569","","","0.1434","0.1671","","","","","","1.002","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238687","11.157","0.002","11.524","0.003","14.967","0.004","79.601","0.018","72.859","0.017","61.237","0.012","1610.3","0.7","98","2","98","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>,<i>N</i>'-Bis[(pyridin-1-ium-2-yl)methyl]ethanedithioamide bis(2,6-dinitrobenzoate)‒2,6-dinitrobenzoic acid (1/4)","","- C56 H38 N16 O36 S2 -","- C56 H38 N16 O36 S2 -","- C56 H38 N16 O36 S2 -","1","0.5","XU5732","Arman, Hadi D.; Miller, Tyler; Poplaukhin, Pavel; Tiekink, Edward R. T.","The co-crystal <i>N</i>,<i>N</i>'-bis[(pyridin-1-ium-2-yl)methyl]ethanedithioamide bis(2,6-dinitrobenzoate)‒2,6-dinitrobenzoic acid (1/4)","Acta Crystallographica Section E","2013","69","10","o1506","o1507","10.1107/S1600536813023490","","","0.71069","MoKα","","0.0855","0.0645","","","0.1502","0.1655","","","","","","1.064","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238688","5.601","0.004","7.78","0.005","29.7","0.02","90","","94.624","0.016","90","","1290","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-1-(3-Formylphenyl)-2-(2-oxidonaphthalen-1-yl)diazen-1-ium","","- C17 H12 N2 O2 -","- C17 H12 N2 O2 -","- C68 H48 N8 O8 -","4","1","XU5735","Mili, Assia; Benosmane, Ali; Benaouida, Mohamed Amine; Bouchoul, Abdelkader; Bouaoud, Salah Eddine","(<i>E</i>)-1-(3-Formylphenyl)-2-(2-oxidonaphthalen-1-yl)diazen-1-ium","Acta Crystallographica Section E","2013","69","10","o1498","","10.1107/S1600536813024112","","","0.71073","MoKα","","0.1272","0.0573","","","0.1249","0.1543","","","","","","1.007","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238689","6.8551","0.0014","18.892","0.004","10.716","0.003","90","","126.87","0.02","90","","1110.2","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[triaquacopper(II)]-μ-5-carboxybenzene-1,3-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^]","","- C9 H10 Cu O9 -","- C9 H10 Cu O9 -","- C36 H40 Cu4 O36 -","4","1","XU5736","Ma, Yu-Hong; Ma, Pi-Zhuang; Yao, Ting; Hao, Jing-Tuan","<i>catena</i>-Poly[[triaquacopper(II)]-μ-5-carboxybenzene-1,3-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^]","Acta Crystallographica Section E","2013","69","10","m538","","10.1107/S1600536813024781","","","0.71073","MoKα","","0.0476","0.0396","","","0.0793","0.083","","","","","","1.012","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238690","6.8028","0.0012","8.4263","0.0013","11.868","0.002","89.774","0.009","83.113","0.009","70.356","0.008","635.6","0.19","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","2-{(<i>E</i>)-[(2<i>Z</i>)-2-(1,2-Dihydrophthalazin-1-ylidene)hydrazinylidene]methyl}phenol","","- C15 H12 N4 O -","- C15 H12 N4 O -","- C30 H24 N8 O2 -","2","1","ZL2563","Prasanna, M. K.; Sithambaresan, M.; Pradeepkumar, K.; Kurup, M. R. Prathapachandra","2-{(<i>E</i>)-[(2<i>Z</i>)-2-(1,2-Dihydrophthalazin-1-ylidene)hydrazinylidene]methyl}phenol","Acta Crystallographica Section E","2013","69","10","o1522","o1523","10.1107/S1600536813024203","","","0.71073","MoKα","","0.0611","0.0411","","","0.1006","0.1174","","","","","","1.029","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238691","7.487","0.0007","10.205","0.0014","22.232","0.002","90","","90","","90","","1698.6","0.3","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3<i>S</i>,3a<i>S</i>,6<i>R</i>,6a<i>R</i>)-2-Oxohexahydrofuro[3,2-<i>b</i>]furan-3,6-diyl dibenzoate","","- C20 H16 O7 -","- C20 H16 O7 -","- C80 H64 O28 -","4","1","ZP2007","Piccialli, Vincenzo; Oliviero, Giorgia; Zaccaria, Sabrina; Centore, Roberto; Tuzi, Angela","(3<i>S</i>,3a<i>S</i>,6<i>R</i>,6a<i>R</i>)-2-Oxohexahydrofuro[3,2-<i>b</i>]furan-3,6-diyl dibenzoate","Acta Crystallographica Section E","2013","69","10","o1494","o1495","10.1107/S160053681302391X","","","0.71073","MoKα","","0.0469","0.0344","","","0.0729","0.0782","","","","","","1.069","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238692","10.904","0.005","10.765","0.005","11.405","0.005","90","","91.681","0.005","90","","1338.2","1.1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Methyl 8-bromo-3-[1-(4-methoxyphenyl)-4-oxo-3-phenylazetidin-2-yl]-1-methyl-1,2,3,3a,4,9b-hexahydrochromeno[4,3-<i>b</i>]pyrrole-3a-carboxylate","","","- C30 H29 Br N2 O5 -","- C30 H29 Br N2 O5 -","- C60 H58 Br2 N4 O10 -","2","1","ZS2268","Sharmila, P.; Jagadeesan, G.; Raju, Rajesh; Raghavachary, Raghunathan; Aravindhan, S.","Methyl 8-bromo-3-[1-(4-methoxyphenyl)-4-oxo-3-phenylazetidin-2-yl]-1-methyl-1,2,3,3a,4,9b-hexahydrochromeno[4,3-<i>b</i>]pyrrole-3a-carboxylate","Acta Crystallographica Section E","2013","69","10","o1570","","10.1107/S1600536813024963","","","0.71073","MoKα","","0.0429","0.0297","","","0.0617","0.0652","","","","","","0.96","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238693","8.926","0.004","12.767","0.006","9.196","0.004","90","","90","","90","","1048","0.8","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Poly[tetramethylammonium [tri-μ~2~-formato-κ^6^<i>O</i>:<i>O</i>'-manganate(II)]]","","- C7 H15 Mn N O6 -","- C7 H15 Mn N O6 -","- C28 H60 Mn4 N4 O24 -","4","0.5","ZS2272","Han, Cai-Yun; Liu, Min-Min; Dang, Qin-Qin","Poly[tetramethylammonium [tri-μ~2~-formato-κ^6^<i>O</i>:<i>O</i>'-manganate(II)]]","Acta Crystallographica Section E","2013","69","10","m541","","10.1107/S1600536813024045","","","0.71073","MoKα","","0.0317","0.0265","","","0.0691","0.0747","","","","","","0.981","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238694","13.138","0.002","10.0323","0.0019","17.838","0.003","90","","90","","90","","2351.1","0.7","153","2","153","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","<i>N</i>-<i>p</i>-Tolyl-1,3-selenazolo[5,4-<i>b</i>]pyridin-2-amine","","- C13 H11 N3 Se -","- C13 H11 N3 Se -","- C104 H88 N24 Se8 -","8","1","ZS2275","Wu, Zhaojun; Li, Yiqun; Zhou, Hua; Zhou, Meiyun","<i>N</i>-<i>p</i>-Tolyl-1,3-selenazolo[5,4-<i>b</i>]pyridin-2-amine","Acta Crystallographica Section E","2013","69","10","o1497","","10.1107/S1600536813023659","","","1.54178","CuKα","","0.1245","0.0939","","","0.2853","0.3141","","","","","","1.279","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238695","6.2076","0.0003","6.2076","0.0003","29.8731","0.0013","90","","90","","120","","996.92","0.08","100","","100","","","","","","","","","4","P 61","P 61","169","(<i>R</i>)-(-)-1-Azabicyclo[2.2.2]octan-3-ol","(<i>R</i>)-(-)-Quinuclidin-3-ol","","- C7 H13 N O -","- C7 H13 N O -","- C42 H78 N6 O6 -","6","1","BG2517","Rousselin, Yoann; Clavel, Alexandre; Bonnaventure, Isabelle","(<i>R</i>)-({-})-Quinuclidin-3-ol","Acta Crystallographica Section E","2013","69","11","o1672","","10.1107/S1600536813026998","","","1.54178","CuKα~1~","","0.0234","0.0234","","","0.0642","0.0642","","","","","","1.153","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238696","17.8654","0.0012","6.9444","0.0005","21.1462","0.0016","90","","90.122","0.007","90","","2623.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 1-allyl-4-hydroxy-2,2-dioxo-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxylate","","- C13 H13 N O5 S -","- C13 H13 N O5 S -","- C104 H104 N8 O40 S8 -","8","2","BG2518","Shishkina, Svitlana V.; Ukrainets, Igor V.; Petrushova, Lidiya A.","Methyl 1-allyl-4-hydroxy-2,2-dioxo-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxylate","Acta Crystallographica Section E","2013","69","11","o1698","","10.1107/S1600536813028572","","","0.71073","MoKα","","0.0873","0.0692","","","0.2072","0.2182","","","","","","1.148","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238697","8.6925","0.0004","5.9266","0.0002","22.6456","0.0009","90","","95.423","0.004","90","","1161.41","0.08","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-3-(4-Fluorophenyl)-1-phenylprop-2-en-1-one","","- C15 H11 F O -","- C15 H11 F O -","- C60 H44 F4 O4 -","4","1","BH2484","Arias-Ruiz, Saira N.; Romero, Nancy; Lobato-García, Carlos E.; Gómez-Rivera, Abraham; Mendoza, Angel","Second monoclinic form of (<i>E</i>)-3-(4-fluorophenyl)-1-phenylprop-2-en-1-one","Acta Crystallographica Section E","2013","69","11","o1694","o1695","10.1107/S1600536813028079","","","0.71073","MoKα","","0.0749","0.0454","","","","0.1312","","","","","","1.011","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238698","7.2248","0.0004","8.7718","0.0005","10.1549","0.0005","85.504","0.003","71.087","0.002","68.659","0.002","566.5","0.05","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Uronium 3-carboxy-4-hydroxybenzenesulfonate","","- C8 H10 N2 O7 S -","- C8 H10 N2 O7 S -","- C16 H20 N4 O14 S2 -","2","1","BH2485","Silambarasan, A.; Kumar, M. Krishna; Chakkaravarthi, G.; Kumar, R. Mohan; Umarani, P. R.","Uronium 3-carboxy-4-hydroxybenzenesulfonate","Acta Crystallographica Section E","2013","69","11","o1725","","10.1107/S1600536813029474","","","0.71073","MoKα","","0.0447","0.0367","","","0.1035","0.1099","","","","","","1.047","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238699","12.375","0.0008","12.1901","0.0008","14.1713","0.0009","90","","115.023","0.001","90","","1937.1","0.2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[4-(dimethylamino)pyridinium] tetrachloridocuprate(II)","","- C14 H22 Cl4 Cu N4 -","- C14 H22 Cl4 Cu N4 -","- C56 H88 Cl16 Cu4 N16 -","4","0.5","BQ2389","Bouacida, Sofiane; Bouchene, Rafika; Khadri, Amina; Belhouas, Ratiba; Merazig, Hocine","Bis[4-(dimethylamino)pyridinium] tetrachloridocuprate(II)","Acta Crystallographica Section E","2013","69","11","m610","m611","10.1107/S1600536813028006","","","0.71073","MoKα","","0.0277","0.0213","","","0.0565","0.0594","","","","","","1.054","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238700","28.7522","0.0009","11.1809","0.0004","16.5584","0.0005","90","","115.303","0.002","90","","4812.4","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-Isopropyl-1-{2-[(1-methyl-1<i>H</i>-tetrazol-5-yl)sulfanyl]acetyl}-2,6-diphenylpiperidin-4-one hemihydrate","","- C24 H28 N5 O2.5 S -","- C24 H28 N5 O2.5 S -","- C192 H224 N40 O20 S8 -","8","1","BT6930","Ganesan, S.; Sugumar, P.; Ananthan, S.; Ponnuswamy, M. N.","3-Isopropyl-1-{2-[(1-methyl-1<i>H</i>-tetrazol-5-yl)sulfanyl]acetyl}-2,6-diphenylpiperidin-4-one hemihydrate","Acta Crystallographica Section E","2013","69","11","o1598","","10.1107/S1600536813026500","","","0.71073","MoKα","","0.0729","0.0455","","","0.1238","0.1464","","","","","","1.041","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2238701","7.0994","0.0014","25.014","0.005","9.4083","0.0019","90","","90","","90","","1670.8","0.6","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","2,3-Bis(furan-2-yl)pyrazino[2,3-<i>f</i>][1,10]phenanthroline","","- C22 H12 N4 O2 -","- C22 H12 N4 O2 -","- C88 H48 N16 O8 -","4","0.5","BT6933","Dong, Wen-xian; Tong, Rong-rong; Zheng, Chang-ge","2,3-Bis(furan-2-yl)pyrazino[2,3-<i>f</i>][1,10]phenanthroline","Acta Crystallographica Section E","2013","69","11","o1613","","10.1107/S160053681302641X","","","0.71073","MoKα","","0.0616","0.051","","","0.1089","0.1144","","","","","","1.184","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238702","11.2088","0.0004","13.471","0.0005","18.9133","0.0007","69.648","0.001","80.124","0.001","68.521","0.001","2488.37","0.16","185","2","185","2","","","","","","","","5","P -1","-P 1","2","","Poly[[(μ~2~-benzene-1,3-dicarboxylato){μ~2~-1,4-bis[(1<i>H</i>-imidazol-1-yl)methyl]benzene}cadmium] dimethylformamide monosolvate]","","- C25 H25 Cd N5 O5 -","- C25 H25 Cd N5 O5 -","- C100 H100 Cd4 N20 O20 -","4","2","BT6934","Chen, Yan; Wang, Daguang; He, Liang; Li, Wei; Suo, Jian","Poly[[(μ~2~-benzene-1,3-dicarboxylato){μ~2~-1,4-bis[(1<i>H</i>-imidazol-1-yl)methyl]benzene}cadmium] dimethylformamide monosolvate]","Acta Crystallographica Section E","2013","69","11","m616","m617","10.1107/S1600536813028298","","","0.71073","MoKα","","0.058","0.0337","","","0.0824","0.0952","","","","","","1.045","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2238703","8.6049","0.0005","7.1949","0.0003","26.8195","0.0015","90","","101.186","0.004","90","","1628.89","0.15","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(3a<i>R</i>,6<i>S</i>,7a<i>R</i>)-7a-Chloro-6-methyl-2-(4-nitrophenylsulfonyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole","","- C15 H15 Cl N2 O5 S -","- C15 H15 Cl N2 O5 S -","- C60 H60 Cl4 N8 O20 S4 -","4","1","BT6935","Demircan, Aydın; Temel, Ersin; Kandemir, Muhammet Kasım; Çolak, Medine; Büyükgüngör, Orhan","(3a<i>R</i>,6<i>S</i>,7a<i>R</i>)-7a-Chloro-6-methyl-2-(4-nitrophenylsulfonyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole","Acta Crystallographica Section E","2013","69","11","o1628","o1629","10.1107/S1600536813026329","","","0.71073","MoKα","","0.1448","0.0675","","","0.1637","0.1916","","","","","","0.89","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238704","13.8922","0.0007","10.4531","0.0009","7.8696","0.0005","90","","101.682","0.006","90","","1119.12","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Dichloromethyl-4-methyl-5-(nitromethyl)cyclohex-2-enone","","- C9 H11 Cl2 N O3 -","- C9 H11 Cl2 N O3 -","- C36 H44 Cl8 N4 O12 -","4","1","BT6936","Novaković, Sladjana B.; Rodić, Marko V.; Jaćimović, Željko K.; Ratković, Zoran; Sukdolak, Slobodan","4-Dichloromethyl-4-methyl-5-(nitromethyl)cyclohex-2-enone","Acta Crystallographica Section E","2013","69","11","o1638","","10.1107/S1600536813027517","","","1.5418","CuKα","","0.086","0.0725","","","0.2016","0.2144","","","","","","1.131","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238705","6.5835","0.0002","9.2584","0.0003","12.8428","0.0005","85.14","0.003","84.795","0.003","89.067","0.003","776.74","0.05","180","2","180","2","","","","","","","","4","P 1","P 1","1","","(1<i>R</i>,4<i>R</i>,6<i>S</i>,7<i>S</i>)-5,5-Dichloro-1,4,8,8-tetramethyltricyclo[5.4.1^1,7^.0^4,6^]dodecan-12-one","","- C16 H24 Cl2 O -","- C16 H24 Cl2 O -","- C32 H48 Cl4 O2 -","2","2","BT6937","Benharref, Ahmed; EL Karroumi, Jamal; Daran, Jean-Claude; Berraho, Moha","(1<i>R</i>,4<i>R</i>,6<i>S</i>,7<i>S</i>)-5,5-Dichloro-1,4,8,8-tetramethyltricyclo[5.4.1^1,7^.0^4,6^]dodecan-12-one","Acta Crystallographica Section E","2013","69","11","o1703","","10.1107/S1600536813028791","","","0.71073","MoKα","","0.0366","0.0303","","","0.0685","0.0702","","","","","","1.045","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238706","13.6014","0.0012","15.2064","0.0013","6.2738","0.0006","90","","113.587","0.003","90","","1189.19","0.19","295","2","295","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Di-μ-hydroxido-κ^4^<i>O</i>:<i>O</i>-di-μ-perchlorato-κ^4^<i>O</i>:<i>O</i>'-bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(II)]","","- C20 H18 Cl2 Cu2 N4 O10 -","- C20 H18 Cl2 Cu2 N4 O10 -","- C40 H36 Cl4 Cu4 N8 O20 -","2","0.25","BT6938","Saravanan, B.; Jayamani, A.; Sengottuvelan, N.; Chakkaravarthi, G.; Manivannan, V.","Di-μ-hydroxido-κ^4^<i>O</i>:<i>O</i>-di-μ-perchlorato-κ^4^<i>O</i>:<i>O</i>'-bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(II)]","Acta Crystallographica Section E","2013","69","11","m600","","10.1107/S1600536813027852","","","0.71073","MoKα","","0.0321","0.0263","","","0.0728","0.077","","","","","","1.026","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238707","6.5865","0.0002","17.2263","0.0006","14.7778","0.0006","90","","90","","90","","1676.7","0.1","100","2","100","2","","","","","","","","4","P b c m","-P 2c 2b","57","Natrium selenite pentahydrate","Disodium selenate(IV) pentahydrate","","- H10 Na2 O8 Se -","- H10 Na2 O8 Se -","- H80 Na16 O64 Se8 -","8","1","BT6939","Mereiter, Kurt","Sodium selenite pentahydrate, Na~2~SeO~3~·5H~2~O","Acta Crystallographica Section E","2013","69","11","i77","i78","10.1107/S1600536813028602","","","0.71073","MoKα","","0.0161","0.0154","","","0.0389","0.0391","","","","","","1.068","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238708","9.5817","0.0003","13.9439","0.0003","12.4804","0.0004","90","","109.832","0.003","90","","1568.57","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Hydroxy-5-(2-methoxyphenoxy)-2,2'-bipyrimidin-6(5<i>H</i>)-one dihydrate","","- C15 H16 N4 O6 -","- C15 H16 N4 O6 -","- C60 H64 N16 O24 -","4","1","BT6940","Yamuna, Thammarse S.; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H.S.; Kaur, Manpreet","4-Hydroxy-5-(2-methoxyphenoxy)-2,2'-bipyrimidin-6(5<i>H</i>)-one dihydrate","Acta Crystallographica Section E","2013","69","11","o1707","o1708","10.1107/S1600536813028900","","","1.54184","CuKα","","0.0442","0.0409","","","0.1107","0.1146","","","","","","1.034","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238709","17.235","0.003","6.736","0.001","23.074","0.005","90","","108.61","0.03","90","","2538.7","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ^2^<i>N</i>^3^,<i>O</i>^4^]barium tetrahydrate","","- C14 H30 Ba N4 O20 -","- C14 H30 Ba N4 O20 -","- C56 H120 Ba4 N16 O80 -","4","0.5","BV2225","Dinh Do, Nguyen; Kovalchukova, Olga; Stash, Adam; Strashnova, Svetlana","Hexaaquabis[3,5-bis(hydroxyimino)-1-methyl-2,4,6-trioxocyclohexanido-κ^2^<i>N</i>^3^,<i>O</i>^4^]barium tetrahydrate","Acta Crystallographica Section E","2013","69","11","m602","m603","10.1107/S1600536813027761","","","0.71073","MoKα","","0.0656","0.0178","","","0.0458","0.0481","","","","","","0.976","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238710","7.7126","0.0002","18.2039","0.0005","16.3534","0.0004","90","","99.371","0.003","90","","2265.37","0.1","293","2","293.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[2,6-Difluoro-3-(pyridin-2-yl-κ<i>N</i>)pyridin-4-yl-κ<i>C</i>^4^](pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')iridium(III)","","- C25 H17 F4 Ir N4 O2 -","- C25 H17 F4 Ir N4 O2 -","- C100 H68 F16 Ir4 N16 O8 -","4","1","BX2449","Luo, Kaijun; Zhang, Chenyang; Jia, Juan; Luo, Daibing","[2,6-Difluoro-3-(pyridin-2-yl-κ<i>N</i>)pyridin-4-yl-κ<i>C</i>^4^](pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')iridium(III)","Acta Crystallographica Section E","2013","69","11","m590","","10.1107/S1600536813026160","","","0.7107","MoKα","","0.0467","0.0322","","","0.0607","0.0661","","","","","","1.031","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238711","18.082","0.006","11.129","0.004","10.617","0.003","90","","95.33","0.006","90","","2127.3","1.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,5-Bis(4-isopropylbenzylidene)thiocarbonohydrazide","","- C21 H26 N4 S -","- C21 H26 N4 S -","- C84 H104 N16 S4 -","4","1","CV5428","Han, Yan-Hua; Zhao, Qiao; Wang, Yong","1,5-Bis(4-isopropylbenzylidene)thiocarbonohydrazide","Acta Crystallographica Section E","2013","69","11","o1663","","10.1107/S1600536813027293","","","0.71073","MoKα","","0.1603","0.0775","","","0.1892","0.2362","","","","","","1.076","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238712","13.8594","0.0017","13.8594","0.0017","8.01","0.0014","90","","90","","120","","1332.5","0.3","153","2","153","2","","","","","","","","5","P -3","-P 3","147","","Poly[(μ~6~-benzene-1,3,5-tricarboxylato-κ^6^<i>O</i>^1^:<i>O</i>^1'^:<i>O</i>^3^:<i>O</i>^3'^:<i>O</i>^5^:<i>O</i>^5'^)tris(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)tris(μ~3~-formato-κ^3^<i>O</i>:<i>O</i>:<i>O</i>')trizinc(II)]","","- C21 H27 N3 O15 Zn3 -","- C21 H27 N3 O15 Zn3 -","- C42 H54 N6 O30 Zn6 -","2","0.333333","CV5429","Sim, Jaeung; Kim, Taemin; Yang, Jin Kuk","Poly[(μ~6~-benzene-1,3,5-tricarboxylato-κ^6^<i>O</i>^1^:<i>O</i>^1'^:<i>O</i>^3^:<i>O</i>^3'^:<i>O</i>^5^:<i>O</i>^5'^)tris(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)tris(μ~3~-formato-κ^3^<i>O</i>:<i>O</i>:<i>O</i>')trizinc(II)]","Acta Crystallographica Section E","2013","69","11","m619","","10.1107/S1600536813028687","","","0.71073","MoKα","","0.0543","0.0398","","","0.078","0.0893","","","0.809","","","0.809","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238713","11.1397","0.0006","15.6579","0.0008","7.3952","0.0004","90","","101.332","0.001","90","","1264.76","0.12","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Methyl-4-(2-phenyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-7-yl)furazan","","- C14 H10 N6 O -","- C14 H10 N6 O -","- C56 H40 N24 O4 -","4","1","CV5430","Suponitsky, Kyrill Yu.; Chernyshev, Victor M.; Palysaeva, Nadezhda V.; Sheremetev, Aleksei B.","3-Methyl-4-(2-phenyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-7-yl)furazan","Acta Crystallographica Section E","2013","69","11","o1648","o1649","10.1107/S1600536813027700","","","0.71073","MoKα","","0.0498","0.0419","","","0.111","0.1176","","","","","","1.024","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238714","10.6055","0.0005","12.2181","0.0006","14.9774","0.0007","88.06","0.003","73.093","0.004","74.179","0.003","1784.35","0.16","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>-[2-(2,2-Dimethylpropanamido)pyrimidin-4-yl]-2,2-dimethylpropanamide <i>n</i>-hexane 0.25-solvate hemihydrate","","- C31 H53 N8 O5 -","- C31 H53 N8 O5 -","- C62 H106 N16 O10 -","2","1","CV5431","Ośmiałowski, Borys; Valkonen, Arto; Checińska, Lilianna","<i>N</i>-[2-(2,2-Dimethylpropanamido)pyrimidin-4-yl]-2,2-dimethylpropanamide <i>n</i>-hexane 0.25-solvate hemihydrate","Acta Crystallographica Section E","2013","69","11","o1617","o1618","10.1107/S160053681302713X","","","0.71073","MoKα","","0.1609","0.0786","","","0.1319","0.1636","","","","","","1.043","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238715","18.853","0.012","7.512","0.005","6.364","0.004","90","","95.674","0.01","90","","896.9","1","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(hexyloxy)benzene","","- C18 H30 O2 -","- C18 H30 O2 -","- C36 H60 O4 -","2","0.5","CV5434","Cheng, Hua","1,4-Bis(hexyloxy)benzene","Acta Crystallographica Section E","2013","69","11","o1721","","10.1107/S1600536813029024","","","0.71073","MoKα","","0.1327","0.0665","","","0.1824","0.2384","","","","","","0.985","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238716","16.0285","0.0011","4.3862","0.0004","14.3684","0.001","90","","90","","90","","1010.16","0.14","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Thulium nickel/lithium distannide","","- Li0.035 Ni0.965 Sn2 Tm -","- Li0.035 Ni0.965 Sn2 Tm -","- Li0.42 Ni11.58 Sn24 Tm12 -","12","1.5","FF2120","Stetskiv, Andrij; Tarasiuk, Ivan; Misztal, Renata; Pavlyuk, Volodymyr","Thulium nickel/lithium distannide, TmNi~1{-~<i>x</i>}Li~<i>x~</i>Sn~2~ (<i>x</i> = 0.035)","Acta Crystallographica Section E","2013","69","11","i76","","10.1107/S1600536813027335","","","0.71073","MoKα","","0.0381","0.0264","","","0.0522","0.0598","","","","","","1.184","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238717","12.7397","0.0018","11.361","0.0016","15.611","0.002","90","","101.405","0.004","90","","2214.9","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","4,4'-Oxybis(2,6-dimethylpyridinium) bis(trifluoromethanesulfonate)","","- C16 H18 F6 N2 O7 S2 -","- C16 H18 F6 N2 O7 S2 -","- C64 H72 F24 N8 O28 S8 -","4","1","FF2121","Stubbs, Amanda W.; Golen, James A.; Rheingold, Arnold L.; Manke, David R.","4,4'-Oxybis(2,6-dimethylpyridinium) bis(trifluoromethanesulfonate)","Acta Crystallographica Section E","2013","69","11","o1633","o1634","10.1107/S1600536813027505","","","0.71073","MoKα","","0.0621","0.049","","","0.1171","0.1252","","","","","","1.091","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238718","11.8399","0.0007","11.8399","0.0007","19.711","0.0012","90","","90","","120","","2393","0.2","298","2","298","2","","","","","","","","6","R -3 :H","-R 3","148","","Hexakis(dimethyl sulfoxide-κ<i>O</i>)zinc(II) polyiodide","","- C12 H36 I4 O6 S6 Zn -","- C12 H36 I4 O6 S6 Zn -","- C36 H108 I12 O18 S18 Zn3 -","3","0.166667","FJ2643","Garzón-Tovar, Luis; Duarte-Ruiz, Álvaro; Fanwick, Phillip E.","Hexakis(dimethyl sulfoxide-κ<i>O</i>)zinc(II) polyiodide","Acta Crystallographica Section E","2013","69","11","m618","","10.1107/S1600536813028377","","","0.71073","MoKα","","0.066","0.047","","","0.09","0.104","","","","","","1.174","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2238719","9.4483","0.0005","9.8197","0.0003","11.5307","0.0004","104.067","0.001","103.026","0.001","100.475","0.001","978.83","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dichlorido{2-[(<i>E</i>)-phenyl(pyridin-2-yl-κ<i>N</i>)methylidene]-<i>N</i>-phenylhydrazinecarboxamide-κ^2^<i>N</i>^2^,<i>O</i>}copper(II)","","- C19 H16 Cl2 Cu N4 O -","- C19 H16 Cl2 Cu N4 O -","- C38 H32 Cl4 Cu2 N8 O2 -","2","1","FJ2644","Aiswarya, N.; Sithambaresan, M.; Kurup, M. R. Prathapachandra; Ng, Seik Weng","Dichlorido{2-[(<i>E</i>)-phenyl(pyridin-2-yl-κ<i>N</i>)methylidene]-<i>N</i>-phenylhydrazinecarboxamide-κ^2^<i>N</i>^2^,<i>O</i>}copper(II)","Acta Crystallographica Section E","2013","69","11","m588","m589","10.1107/S1600536813026883","","","0.71073","MoKα","","0.047","0.0344","","","0.084","0.0917","","","","","","1.008","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238720","38.8025","0.001","9.7675","0.0002","6.09571","0.00013","90","","90","","90","","2310.29","0.09","173","2","173","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","Bis-[1-(benzo[1,3]dioxol-5-yl-methyl)piperazinyl]methane","Bis{4-[(1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methane","","- C25 H32 N4 O4 -","- C25 H32 N4 O4 -","- C100 H128 N16 O16 -","4","1","FJ2646","Kavitha, Channappa N.; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H. S.; Kaur, Manpreet","Bis{4-[(1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methane","Acta Crystallographica Section E","2013","69","11","o1669","","10.1107/S1600536813028109","","","1.54184","CuKα","","0.0454","0.0411","","","0.104","0.1077","","","","","","1.022","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238721","3.8146","0.0008","11.2571","0.0018","16.904","0.003","72.456","0.016","85.03","0.018","84.468","0.016","687.6","0.2","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","Dimethyl 4,4'-(diazenediyl)dibenzoate","","- C16 H14 N2 O4 -","- C16 H14 N2 O4 -","- C32 H28 N4 O8 -","2","1","FK2074","Gajda, Katarzyna; Zarychta, Bartosz; Domański, Andrzej A.; Ejsmont, Krzysztof","Dimethyl 4,4'-(diazenediyl)dibenzoate at 100K","Acta Crystallographica Section E","2013","69","11","o1607","","10.1107/S1600536813026846","","","0.71073","MoKα","","0.0725","0.048","","","0.1367","0.1474","","","","","","1.05","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238722","9.8741","0.0013","13.0544","0.0018","13.365","0.002","90","","100.878","0.004","90","","1691.8","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(3-Nitrophenyl)-3-phenyl-2,3-dihydro-4<i>H</i>-1,3-benzothiazin-4-one","","- C20 H14 N2 O3 S -","- C20 H14 N2 O3 S -","- C80 H56 N8 O12 S4 -","4","1","FY2105","Yennawar, Hemant P.; Silverberg, Lee J.; Minehan, Michael J.; Tierney, John","2-(3-Nitrophenyl)-3-phenyl-2,3-dihydro-4<i>H</i>-1,3-benzothiazin-4-one","Acta Crystallographica Section E","2013","69","11","o1679","","10.1107/S1600536813028389","","","0.71073","MoKα","","0.0379","0.0335","","","0.0848","0.0882","","","","","","1.041","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238723","11.353","0.003","8.093","0.002","14.607","0.004","90","","112.582","0.004","90","","1239.2","0.6","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-Acetyl-3-[2-(ethoxycarbonyl)phenyl]sydnone","4-Acetyl-3-[2-(ethoxycarbonyl)phenyl]-1,2,3-oxadiazol-3-ylium-5-olate","","- C13 H12 N2 O5 -","- C13 H12 N2 O5 -","- C52 H48 N8 O20 -","4","1","GG2123","Grossie, David; Harrison, Leanna; Turnbull, Kenneth","4-Acetyl-3-[2-(ethoxycarbonyl)phenyl]sydnone","Acta Crystallographica Section E","2013","69","11","o1662","","10.1107/S1600536813027207","","","0.71073","MoKα","","0.0731","0.0504","","0.1213","0.1121","0.1213","","","","","","0.9597","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238724","5.1524","0.0002","11.1467","0.0004","12.4478","0.0005","90","","99.967","0.004","90","","704.12","0.05","90","2","90","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Bis(<i>L</i>-serinium) oxalate dihydrate","","- C8 H20 N2 O12 -","- C8 H20 N2 O12 -","- C16 H40 N4 O24 -","2","1","GK2581","Kulik, Marta; Pazio, Aleksandra; Wozniak, Krzysztof","Bis(<small>L</small>-serinium) oxalate dihydrate: polymorph II","Acta Crystallographica Section E","2013","69","11","o1667","o1668","10.1107/S160053681302727X","","","0.71073","MoKα","","0.0445","0.0316","","","0.0621","0.0653","","","","","","1.009","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238725","10.8411","0.0005","11.5923","0.0004","34.8078","0.0012","90","","90","","90","","4374.4","0.3","183","","183","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Rubidium pentaaqua(<i>L</i>-serine)cobalt(II) hexahydrogenhexamolybdocobaltate(III) <i>L</i>-serine monosolvate decahydrate","","- C6 H50 Co2 Mo6 N2 O45 Rb -","- C6 H14 Co2 Mo6 N2 O45 Rb -","- C24 H56 Co8 Mo24 N8 O180 Rb4 -","4","1","HB7134","Iijima, Jun; Naruke, Haruo; Takiyama, Hiroshi","Rubidium pentaaqua(<small>L</small>-serine)cobalt(II) hexahydrogenhexamolybdocobaltate(III) <small>L</small>-serine monosolvate decahydrate","Acta Crystallographica Section E","2013","69","11","m612","m613","10.1107/S1600536813028304","","","0.71075","MoKα","","","0.0362","","","","0.0987","","","","","","1.038","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238726","10.4924","0.001","10.0614","0.001","11.0379","0.0011","90","","90.136","0.002","90","","1165.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>-(4-Fluorophenyl)-2,6-dimethyl-1,3-dioxan-4-amine","","- C12 H16 F N O2 -","- C12 H16 F N O2 -","- C48 H64 F4 N4 O8 -","4","1","HB7138","Rambabu, Gottimukkala; Fatima, Zeenat; Reddy, Bandapalli Palakshi; Vijayakumar, Vijayaparthasarathi; Velmurugan, Devadasan","<i>N</i>-(4-Fluorophenyl)-2,6-dimethyl-1,3-dioxan-4-amine","Acta Crystallographica Section E","2013","69","11","o1602","","10.1107/S1600536813026561","","","0.71073","MoKα","","0.0558","0.0407","","","0.1141","0.1293","","","","","","1.014","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238727","18.891","0.005","9.9619","0.0005","9.5029","0.0008","90","","90.799","0.013","90","","1788.2","0.5","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Pimobendan B form","(<i>RS</i>)-6-[2-(4-Methoxyphenyl)-1<i>H</i>-benzimidazol-5-yl]-5-methyl-4,5-dihydropyridazin-3(2<i>H</i>)-one","","- C19 H18 N4 O2 -","- C19 H18 N4 O2 -","- C76 H72 N16 O8 -","4","1","HB7139","Zvirgzdins, Alvis; Delina, Mara; Mishnev, Anatoly; Actins, Andris","Pimobendan B from powder diffraction data","Acta Crystallographica Section E","2013","69","11","o1677","","10.1107/S1600536813028353","powder diffraction","","1.54184","CuKα","","","","","","","","","","1.3","","","","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238728","7.1943","0.0008","7.3259","0.0008","13.2263","0.0015","85.124","0.002","85.542","0.002","72.938","0.002","662.98","0.13","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","1-(5,5-Dimethoxypentyl)-3-methylimidazolium-2-carboxylate","","- C12 H20 N2 O4 -","- C12 H20 N2 O4 -","- C24 H40 N4 O8 -","2","1","HB7143","Walter, Olaf","1-(5,5-Dimethoxypentyl)-3-methylimidazolium-2-carboxylate","Acta Crystallographica Section E","2013","69","11","o1611","","10.1107/S1600536813027013","","","0.71073","MoKα","","0.09","0.0539","","","0.1598","0.1783","","","","","","1.034","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238729","11.1852","0.0004","7.4037","0.0004","20.9189","0.0008","90","","94.408","0.003","90","","1727.21","0.13","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","<i>N</i>-(1,3-Benzothiazol-2-yl)acetamide","<i>N</i>-(1,3-Benzothiazol-2-yl)acetamide","","- C9 H8 N2 O S -","- C9 H8 N2 O S -","- C72 H64 N16 O8 S8 -","8","2","HB7144","Nayak, Prakash S.; Narayana, B.; Jasinski, Jerry P.; Yathirajan, H. S.; Kaur, Manpreet","<i>N</i>-(1,3-Benzothiazol-2-yl)acetamide","Acta Crystallographica Section E","2013","69","11","o1622","","10.1107/S160053681302730X","","","0.71073","MoKα","","0.0624","0.0439","","","0.1001","0.1093","","","","","","1.08","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238730","10.907","0.003","11.302","0.003","13.169","0.002","106.45","0.04","107.71","0.04","105.34","0.04","1369.5","1","295","","295","","","","","","","","","6","P -1","-P 1","2","","Tetraquinolinium ditelluro(VI)octavanadate(V) octahydrate","","- C36 H48 N4 O36 Te2 V8 -","- C36 H48 N4 O36 Te2 V8 -","- C36 H48 N4 O36 Te2 V8 -","1","0.5","HB7146","Toumi, Sirine; Toumi, Samah Akriche; Rzaigui, Mohamed","Tetraquinolinium ditelluro(VI)octavanadate(V) octahydrate","Acta Crystallographica Section E","2013","69","11","m595","m596","10.1107/S1600536813027347","","","0.56087","AgKα","","0.2169","0.115","","","0.2635","0.3079","","","","","","1.047","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238731","14.4115","0.0008","6.2128","0.0003","27.5992","0.0015","90","","104.379","0.002","90","","2393.7","0.2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>N</i>'-[(<i>E</i>)-3-Bromobenzylidene]pyrazine-2-carbohydrazide","","- C12 H9 Br N4 O -","- C12 H9 Br N4 O -","- C96 H72 Br8 N32 O8 -","8","1","HB7147","Ahmad, Mushtaq; Hameed, Shahid; Tahir, M. Nawaz; Anwar, Muhammad; Israr, Muhammad","<i>N</i>'-[(<i>E</i>)-3-Bromobenzylidene]pyrazine-2-carbohydrazide","Acta Crystallographica Section E","2013","69","11","o1635","","10.1107/S1600536813027426","","","0.71073","MoKα","","0.0544","0.0292","","","0.0666","0.0747","","","","","","1.021","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238732","11.753","0.002","13.086","0.003","13.165","0.003","77.69","0.03","66.05","0.03","81.73","0.03","1804.2","0.8","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Triphenyltelluronium(IV) bromide acetone hemisolvate","","- C39 H36 Br2 O Te2 -","- C39 H36 Br2 O Te2 -","- C78 H72 Br4 O2 Te4 -","2","1","HB7149","Närhi, Sari M.; Oilunkaniemi, Raija; Laitinen, Risto S.","Triphenyltelluronium(IV) bromide acetone hemisolvate","Acta Crystallographica Section E","2013","69","11","o1666","","10.1107/S160053681302816X","","","0.71073","MoKα","","0.0458","0.0374","","","0.0996","0.1061","","","","","","1.006","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238733","7.3071","0.0005","8.079","0.0007","11.3878","0.0011","82.678","0.008","83.642","0.007","72.309","0.007","633.41","0.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","2-[4-(Trifluoromethyl)phenylsulfanyl]benzoic acid","","- C14 H9 F3 O2 S -","- C14 H9 F3 O2 S -","- C28 H18 F6 O4 S2 -","2","1","HB7150","Yamuna, Thammarse S.; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H.S.; Kaur, Manpreet","2-[4-(Trifluoromethyl)phenylsulfanyl]benzoic acid","Acta Crystallographica Section E","2013","69","11","o1704","","10.1107/S1600536813028778","","","1.54184","CuKα","","0.0622","0.054","","","0.1449","0.1554","","","","","","1.038","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238734","12.393","0.004","13.433","0.005","12.877","0.005","90","","112.49","0.02","90","","1980.7","1.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-(3,5-Difluorophenyl)-4,4,4-trifluorobutane-1,3-dione","","- C10 H5 F5 O2 -","- C10 H5 F5 O2 -","- C80 H40 F40 O16 -","8","1","HB7151","Manoj Kumar, K.E.; Palakshamurthy, B. S.; Suchetan, P. A.; Madan Kumar, S.; Lokanath, N.K.; Sreenivasa, S.","1-(3,5-Difluorophenyl)-4,4,4-trifluorobutane-1,3-dione","Acta Crystallographica Section E","2013","69","11","o1705","","10.1107/S1600536813028535","","","0.71073","MoKα","","0.0888","0.0743","","","0.2195","0.2389","","","","","","1.082","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238735","6.9731","0.0002","10.231","0.0003","11.9955","0.0003","92.024","0.001","90.176","0.001","106.497","0.001","819.96","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(6-Methoxy-2-oxo-2<i>H</i>-chromen-4-yl)methyl piperidine-1-carbodithioate","","- C17 H19 N O3 S2 -","- C17 H19 N O3 S2 -","- C34 H38 N2 O6 S4 -","2","1","HB7152","Kumar, K. Mahesh; Vinduvahini, M.; Mahabhaleshwaraiah, N. M.; Kotresh, O.; Devarajegowda, H. C.","(6-Methoxy-2-oxo-2<i>H</i>-chromen-4-yl)methyl piperidine-1-carbodithioate","Acta Crystallographica Section E","2013","69","11","o1683","","10.1107/S1600536813028432","","","0.71073","MoKα","","0.0462","0.0371","","","0.1015","0.1091","","","","","","1.037","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238736","8.5289","0.0005","8.363","0.0005","15.5645","0.0009","90","","105.298","0.0006","90","","1070.83","0.11","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","3,8-Dibromobenzocyclo-octateraene","(5<i>Z</i>,7<i>Z</i>,9<i>Z</i>)-5,10-Dibromobenzo[8]annulene","","- C12 H8 Br2 -","- C12 H8 Br2 -","- C48 H32 Br8 -","4","1","HG5345","Bender, Christopher O.; Boeré, René T.","(5<i>Z</i>,7<i>Z</i>,9<i>Z</i>)-5,10-Dibromobenzo[8]annulene","Acta Crystallographica Section E","2013","69","11","o1641","","10.1107/S1600536813027797","","","0.71073","MoKα","","0.0207","0.0174","","","0.0385","0.0394","","","","","","1.039","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238737","6.938","0.004","14.694","0.008","10.379","0.006","90","","108.598","0.009","90","","1002.9","1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,6-Dimethyl-1<i>H</i>-benzimidazol-3-ium nitrate","","- C9 H11 N3 O3 -","- C9 H11 N3 O3 -","- C36 H44 N12 O12 -","4","1","HG5349","Liu, Bao-Cheng; Zhu, Shou-Jin; Liu, Fa-Qian","5,6-Dimethyl-1<i>H</i>-benzimidazol-3-ium nitrate","Acta Crystallographica Section E","2013","69","11","o1645","","10.1107/S1600536813027578","","","0.71073","MoKα","","0.0538","0.0446","","","0.1278","0.1356","","","","","","1.05","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238738","6.6916","0.0012","8.369","0.0017","12.358","0.003","88.809","0.012","76.322","0.008","72.193","0.009","639.2","0.2","98","2","98","2","","","","","","","","4","P -1","-P 1","2","","4-[2-(Pyridin-1-ium-4-yl)ethyl]pyridin-1-ium bis(2,6-dinitrobenzoate)","","- C26 H20 N6 O12 -","- C26 H20 N6 O12 -","- C26 H20 N6 O12 -","1","0.5","HG5351","Arman, Hadi D.; Miller, Tyler; Tiekink, Edward R. T.","4-[2-(Pyridin-1-ium-4-yl)ethyl]pyridin-1-ium bis(2,6-dinitrobenzoate)","Acta Crystallographica Section E","2013","69","11","o1606","","10.1107/S1600536813026810","","","0.71069","MoKα","","0.0583","0.0497","","","0.1171","0.1241","","","","","","1.068","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2238739","11.58","0.003","24.999","0.007","8.995","0.003","90","","106.891","0.006","90","","2491.6","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6,6'-Diethoxy-2,2'-[4-methyl-1,2-phenylenebis(nitrilomethanylylidene)]diphenol acetonitrile monosolvate","","- C27 H29 N3 O4 -","- C27 H29 N3 O4 -","- C108 H116 N12 O16 -","4","1","HG5352","Li, Lei; Zeng, Suyuan","6,6'-Diethoxy-2,2'-[4-methyl-1,2-phenylenebis(nitrilomethanylylidene)]diphenol acetonitrile monosolvate","Acta Crystallographica Section E","2013","69","11","o1714","","10.1107/S1600536813028845","","","0.71073","MoKα","","0.2566","0.0609","","","0.1096","0.1708","","","","","","0.906","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238740","14.4553","0.0013","8.7501","0.0009","16.863","0.0016","90","","119.696","0.006","90","","1852.8","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2-Chloro-8-methylquinolin-3-yl)-4-phenyl-1,2-dihydroquinazoline","","- C24 H18 Cl N3 -","- C24 H18 Cl N3 -","- C96 H72 Cl4 N12 -","4","1","HG5353","Derabli, Chamseddine; Boulcina, Raouf; Bouacida, Sofiane; Merazig, Hocine; Debache, Abdelmadjid","2-(2-Chloro-8-methylquinolin-3-yl)-4-phenyl-1,2-dihydroquinazoline","Acta Crystallographica Section E","2013","69","11","o1719","o1720","10.1107/S1600536813029334","","","0.71073","MoKα","","0.037","0.0312","","","0.0787","0.0823","","","","","","1.061","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238741","7.563","0.0005","6.5593","0.0004","13.2319","0.0009","90","","100.072","0.006","90","","646.29","0.07","173","2","173","2","","","","","","","","3","P 1 n 1","P -2yac","7","","<i>N</i>-(1<i>H</i>-Indol-3-ylmethylidene)-4-methylpiperazin-1-amine","","- C14 H18 N4 -","- C14 H18 N4 -","- C28 H36 N8 -","2","1","HG5354","Kavitha, Channappa N.; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H. S.; Kaur, Manpreet","<i>N</i>-(1<i>H</i>-Indol-3-ylmethylidene)-4-methylpiperazin-1-amine","Acta Crystallographica Section E","2013","69","11","o1706","","10.1107/S1600536813028523","","","0.71073","MoKα","","0.0718","0.0582","","","0.1442","0.1628","","","","","","1.057","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238742","8.4883","0.0003","9.3677","0.0005","10.9029","0.0005","109.516","0.005","95.868","0.003","90.242","0.004","812.18","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-iodido-bis(iodido{methyl 4-[(pyridin-2-ylmethylidene)amino]benzoate-κ^2^<i>N</i>,<i>N</i>'}cadmium)","","- C28 H24 Cd2 I4 N4 O4 -","- C28 H24 Cd2 I4 N4 O4 -","- C28 H24 Cd2 I4 N4 O4 -","1","0.5","HG5357","Basu Baul, Tushar S.; Kundu, Sajal; Ng, Seik Weng; Tiekink, Edward R. T.","Di-μ-iodido-bis(iodido{methyl 4-[(pyridin-2-ylmethylidene)amino]benzoate-κ^2^<i>N</i>,<i>N</i>'}cadmium)","Acta Crystallographica Section E","2013","69","11","m623","m624","10.1107/S160053681302905X","","","0.71073","MoKα","","0.0266","0.0217","","","0.047","0.0495","","","","","","1.002","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238743","9.6624","0.0014","10.9179","0.0015","15.768","0.002","90","","100.565","0.002","90","","1635.2","0.4","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[2,2',2''-nitrilotris(ethanaminium) [tri-μ-oxido-tris[dioxidovanadate(V)]] monohydrate]","","- C6 H23 N4 O10 V3 -","- C6 H23 N4 O10 V3 -","- C24 H92 N16 O40 V12 -","4","1","HP2060","Chang, Kelvin B.; Smith, Matthew D.; Zeller, Matthias; Norquist, Alexander J.","<i>catena</i>-Poly[2,2',2''-nitrilotris(ethanaminium) [tri-μ-oxido-tris[dioxidovanadate(V)]] monohydrate]","Acta Crystallographica Section E","2013","69","11","m570","m571","10.1107/S1600536813026056","","","0.71073","MoKα","","0.0877","0.0523","","0.11","0.0997","0.0938","","","","","","1.0022","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238744","10.231","0.0006","11.8118","0.0006","14.3588","0.0009","91.191","0.007","107.481","0.005","106.074","0.006","1580.1","0.18","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","Poly[[μ-chlorido-μ-[2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol-κ^2^<i>N</i>^4^:<i>N</i>^4'^]-zinc] chloride dihydrate]","","- C26 H28 Cl2 F4 N12 O4 Zn -","- C26 H28 Cl2 F4 N12 O4 Zn -","- C52 H56 Cl4 F8 N24 O8 Zn2 -","2","1","HY2637","Pan, Gang-Hong; Tang, Jin-Niu; Xu, Shi-Hua; Huang, Zhong-Jing; Mo, Bo-Fa","Poly[[μ-chlorido-μ-[2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol-κ^2^<i>N</i>^4^:<i>N</i>^4'^]-zinc] chloride dihydrate]","Acta Crystallographica Section E","2013","69","11","m573","","10.1107/S1600536813026524","","","0.71073","MoKα","","0.1498","0.0804","","","0.2282","0.3064","","","","","","1.071","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238745","14.481","0.005","22.052","0.007","14.482","0.005","90","","92.937","0.002","90","","4619","3","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[1,1'-Bis(diphenylphosphanyl)cobaltocenium-κ^2^<i>P</i>,<i>P</i>'](η^5^-cyclopentadienyl){2-[4-(4-ethynylphenyl)phenyl]ethynyl-κ<i>C</i>}ruthenium(II) hexafluoridophosphate","","- C55 H42 Co F6 P3 Ru -","- C55 H42 Co F6 P3 Ru -","- C220 H168 Co4 F24 P12 Ru4 -","4","1","HY2638","Zeng, Ling-Zhen; Wu, Yun-Ying; Tian, Guang-Xuan; Li, Zhen","[1,1'-Bis(diphenylphosphanyl)cobaltocenium-κ^2^<i>P</i>,<i>P</i>'](η^5^-cyclopentadienyl){2-[4-(4-ethynylphenyl)phenyl]ethynyl-κ<i>C</i>}ruthenium(II) hexafluoridophosphate","Acta Crystallographica Section E","2013","69","11","m607","","10.1107/S1600536813028195","","","0.71073","MoKα","","0.0948","0.057","","","0.1305","0.1404","","","","","","0.968","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238746","16.1229","0.0005","10.0562","0.0003","9.7955","0.0002","90","","105.388","0.001","90","","1531.26","0.07","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(3-Chloro-1<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide","","- C14 H12 Cl N3 O3 S -","- C14 H12 Cl N3 O3 S -","- C56 H48 Cl4 N12 O12 S4 -","4","1","IM2442","Chicha, Hakima; Rakib, El Mostapha; Bouissane, Latifa; Saadi, Mohamed; El Ammari, Lahcen","<i>N</i>-(3-Chloro-1<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide","Acta Crystallographica Section E","2013","69","11","o1632","","10.1107/S160053681302744X","","","0.71073","MoKα","","0.0474","0.0399","","","0.1092","0.1166","","","","","","1.034","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238747","8.9996","0.0004","7.1999","0.0003","21.3728","0.001","90","","91.794","0.003","90","","1384.2","0.11","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(1<i>H</i>-Indazol-5-yl)-4-methoxybenzenesulfonamide","","- C14 H13 N3 O3 S -","- C14 H13 N3 O3 S -","- C56 H52 N12 O12 S4 -","4","1","IM2443","Chicha, Hakima; Rakib, El Mostapha; Bouissane, Latifa; Saadi, Mohamed; El Ammari, Lahcen","<i>N</i>-(1<i>H</i>-Indazol-5-yl)-4-methoxybenzenesulfonamide","Acta Crystallographica Section E","2013","69","11","o1702","","10.1107/S1600536813028912","","","0.71073","MoKα","","0.0637","0.0421","","","0.1067","0.1185","","","","","","1.05","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238748","18.18","0.004","14.857","0.003","10.53","0.003","90","","94.646","0.003","90","","2834.8","1.2","110","","110","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[μ-3,5-bis(pyridin-2-yl)-1<i>H</i>-pyrazole]bis[dibromidoiron(III)]","","- C26 H18 Br4 Fe2 N8 -","- C26 H18 Br4 Fe2 N8 -","- C104 H72 Br16 Fe8 N32 -","4","0.5","IS5304","Katsuta, Nagisa; Mishima, Akio; Fuyuhiro, Akira; Hayami, Shinya; Kawata, Satoshi","Bis[μ-3,5-bis(pyridin-2-yl)-1<i>H</i>-pyrazole]bis[dibromidoiron(III)]","Acta Crystallographica Section E","2013","69","11","m574","","10.1107/S1600536813026573","","","0.71075","MoKα","","","0.0233","","","","0.0601","","","","","","1.05","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238749","13.223","0.0014","4.8903","0.0005","13.2638","0.0015","90","","106.897","0.001","90","","820.67","0.15","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>S</i>,<i>S</i>'-Butane-1,4-diyl bis(benzenecarbothioate)","","- C18 H18 O2 S2 -","- C18 H18 O2 S2 -","- C36 H36 O4 S4 -","2","0.5","IS5305","Abe, Daisuke; Sasanuma, Yuji","<i>S</i>,<i>S</i>'-Butane-1,4-diyl bis(benzenecarbothioate)","Acta Crystallographica Section E","2013","69","11","o1612","","10.1107/S1600536813026822","","","0.71073","MoKα","","0.0344","0.0296","","","0.0792","0.0828","","","","","","1.046","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238750","13.2676","0.0003","13.5572","0.0003","17.1246","0.0004","90","","90","","90","","3080.23","0.12","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-Nitrobenzeneaminium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","","- C13 H14 N2 O9 S -","- C13 H14 N2 O9 S -","- C104 H112 N16 O72 S8 -","8","1","IS5308","Sivakumar, P. K.; Kumar, M. Krishna; Chakkaravarthi, G.; Kumar, R. Mohan; Kanagadurai, R.","4-Nitroanilinium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","Acta Crystallographica Section E","2013","69","11","o1609","","10.1107/S1600536813026779","","","0.71073","MoKα","","0.0456","0.0375","","","0.1019","0.1074","","","","","","1.032","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238751","9.273","0.005","10.983","0.005","20.096","0.005","90","","90.038","0.005","90","","2046.7","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,15-Dioxa-7,18,19,20,23-pentaazaheptacyclo[21.6.1.1^17,20^.0^1,8^.0^3,7^.0^9,14^.0^24,29^]hentriaconta-9,11,13,17(31),18,24,26,28-octaen-30-one","","- C24 H23 N5 O3 -","- C24 H23 N5 O3 -","- C96 H92 N20 O12 -","4","1","IS5309","Subhashree, Govindarajulu Rangabashyam; Purushothaman, Santhanagopalan; Raghunathan, Raghavachary; Velmurugan, Devadasan; Gayathri, Dasararaju","2,15-Dioxa-7,18,19,20,23-pentaazaheptacyclo[21.6.1.1^17,20^.0^1,8^.0^3,7^.0^9,14^.0^24,29^]hentriaconta-9,11,13,17(31),18,24,26,28-octaen-30-one","Acta Crystallographica Section E","2013","69","11","o1637","","10.1107/S1600536813027396","","","0.71073","MoKα","","0.067","0.0499","","","0.133","0.1455","","","","","","1.006","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238752","11.0205","0.0006","7.2535","0.0005","11.309","0.0007","90","","110.805","0.002","90","","845.06","0.09","173","","173","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Butane-1,4-diyl bis(benzenecarbodithioate)","","- C18 H18 S4 -","- C18 H18 S4 -","- C36 H36 S8 -","2","0.5","IS5312","Abe, Daisuke; Sasanuma, Yuji","Butane-1,4-diyl bis(benzenecarbodithioate)","Acta Crystallographica Section E","2013","69","11","o1636","","10.1107/S1600536813027529","","","1.54178","CuKα","","0.0369","0.0366","","","0.0994","0.0997","","","","","","1.127","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238753","10.829","0.002","9.6","0.002","12.53","0.003","90","","100.34","0.02","90","","1281.4","0.5","300","2","300","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Isopropyl-4-methoxy-5-methylphenyl acetate","","- C13 H18 O3 -","- C13 H18 O3 -","- C52 H72 O12 -","4","1","IS5314","Oubabi, Radouane; Auhmani, Aziz; Ait Itto, My Youssef; Driss, Mohamed; Soumhi, El Hassane","2-Isopropyl-4-methoxy-5-methylphenyl acetate","Acta Crystallographica Section E","2013","69","11","o1715","","10.1107/S160053681302922X","","","0.71073","MoKα","","0.0976","0.0455","","","0.1082","0.132","","","","","","1.018","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238754","7.1327","0.0009","23.852","0.003","7.3437","0.001","90","","113.541","0.003","90","","1145.4","0.3","123","","123","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-Acetyl-5-(4-fluorophenyl)-2-sulfanylideneimidazolidin-4-one","","- C11 H9 F N2 O2 S -","- C11 H9 F N2 O2 S -","- C44 H36 F4 N8 O8 S4 -","4","1","IS5315","Kitoh, Soh-ichi; Feng, Yijing; Fujinami, Shuhei; Ichitani, Masaki; Honda, Mitsunori; Kunimoto, Ko-Ki","1-Acetyl-5-(4-fluorophenyl)-2-sulfanylideneimidazolidin-4-one","Acta Crystallographica Section E","2013","69","11","o1699","","10.1107/S1600536813028560","","","0.7107","MoKα","","","0.0314","","","","0.0823","","","","","","1.06","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238755","12.747","0.0002","14.0577","0.0003","11.7639","0.0002","90","","99.752","0.001","90","","2077.55","0.07","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Hydroxy-5-[(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-enyl)(4-nitrophenyl)methyl]-1,3-dimethylpyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dione","","- C21 H23 N3 O7 -","- C21 H23 N3 O7 -","- C84 H92 N12 O28 -","4","1","IS5316","Sureshbabu, N.; Sughanya, V.","6-Hydroxy-5-[(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-enyl)(4-nitrophenyl)methyl]-1,3-dimethylpyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dione","Acta Crystallographica Section E","2013","69","11","o1690","o1691","10.1107/S1600536813028584","","","0.71073","MoKα","","0.0497","0.0377","","","0.0995","0.1114","","","","","","1.028","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238756","7.261","0.0015","7.5835","0.0015","8.5751","0.0017","68.38","0.03","89.07","0.03","63.66","0.03","387.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[[diaquabis(μ~3~-5-carboxylato-1<i>H</i>-pyrazole-3-carboxylic acid-κ^3^<i>O</i>^3^:<i>O</i>^3^;<i>O</i>^5^)dilithium(I)] monohydrate]","","- C10 H12 Li2 N4 O11 -","- C10 H12 Li2 N4 O11 -","- C10 H12 Li2 N4 O11 -","1","0.5","KP2459","Starosta, Wojciech; Leciejewicz, Janusz","<i>catena</i>-Poly[[diaquabis(μ~3~-5-carboxylato-1<i>H</i>-pyrazole-3-carboxylic acid-κ^3^<i>O</i>^3^:<i>O</i>^3^;<i>O</i>^5^)dilithium(I)] monohydrate]","Acta Crystallographica Section E","2013","69","11","m593","m594","10.1107/S1600536813026408","","","0.71073","MoKα","","0.0667","0.048","","","0.1261","0.139","","","","","","1.041","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238757","4.9164","0.0002","14.649","0.0005","18.013","0.0006","90","","90","","90","","1297.3","0.08","130","2","130","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2<i>R</i>,3<i>R</i>,4<i>S</i>,5<i>R</i>)-2-(4-Amino-5-iodo-7<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol","","- C11 H13 I N4 O3 -","- C11 H13 I N4 O3 -","- C44 H52 I4 N16 O12 -","4","1","KQ2009","Flörke, Ulrich; Drewes, Birte","(2<i>R</i>,3<i>R</i>,4<i>S</i>,5<i>R</i>)-2-(4-Amino-5-iodo-7<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol","Acta Crystallographica Section E","2013","69","11","o1646","o1647","10.1107/S1600536813027931","","","0.71073","MoKα","","0.0204","0.02","","","0.0508","0.051","","","","","","1.064","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238758","12.1431","0.0011","12.6551","0.0012","5.3907","0.0005","90","","90","","90","","828.4","0.13","120","2","120","2","","","","","","","","4","P n a 21","P 2c -2n","33","","6-(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl)-1,2,4,5-tetrazin-3(2<i>H</i>)-one","","- C7 H8 N6 O -","- C7 H8 N6 O -","- C28 H32 N24 O4 -","4","1","KQ2010","Suponitsky, Kyrill Yu.; Chernyshev, Victor M.; Mazharova, Anna G.; Palysaeva, Nadezhda V.; Sheremetev, Aleksei B.","6-(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl)-1,2,4,5-tetrazin-3(2<i>H</i>)-one","Acta Crystallographica Section E","2013","69","11","o1630","o1631","10.1107/S1600536813027360","","","0.71073","MoKα","","0.0436","0.0371","","","0.0896","0.0938","","","","","","1.053","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238759","13.769","0.003","10.832","0.002","16.91","0.003","90","","106.512","0.003","90","","2418","0.8","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>,<i>N</i>'-Tris[(1<i>H</i>-indol-3-yl)methyl]ethane-1,2-diamine","","- C29 H29 N5 -","- C29 H29 N5 -","- C116 H116 N20 -","4","1","LH5652","Li, Yan-Jun; Wang, De-Ju","<i>N</i>,<i>N</i>,<i>N</i>'-Tris[(1<i>H</i>-indol-3-yl)methyl]ethane-1,2-diamine","Acta Crystallographica Section E","2013","69","11","o1678","","10.1107/S1600536813028225","","","0.71073","MoKα","","0.081","0.0436","","","0.0983","0.1137","","","","","","0.988","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238760","5.0375","0.0003","11.4515","0.0013","20.802","0.002","90","","90","","90","","1200","0.19","200","1","200","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","LL-P880 beta","(6<i>S</i>*)-6-[(1<i>S</i>*,2<i>R</i>*)-1,2-Dihydroxypentyl]-4-methoxy-5,6-dihydro-2<i>H</i>-pyran-2-one","","- C11 H18 O5 -","- C11 H18 O5 -","- C44 H72 O20 -","4","1","LH5653","Valenti, Domenic J.; Arif, Atta M.; Strobel, Gary A.; Harper, James K.","(6<i>S</i>*)-6-[(1<i>S</i>*,2<i>R</i>*)-1,2-Dihydroxypentyl]-4-methoxy-5,6-dihydro-2<i>H</i>-pyran-2-one","Acta Crystallographica Section E","2013","69","11","o1657","o1658","10.1107/S1600536813027025","","","0.71073","MoKα","","0.082","0.0515","","","0.1072","0.1205","","","","","","1.056","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238761","13.971","0.002","12.15","0.003","9.169","0.002","90","","93.8","0.04","90","","1553","0.6","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H36 Mn N2 O20 P4 -","- C16 H36 Mn N2 O20 P4 -","- C32 H72 Mn2 N4 O40 P8 -","2","0.5","LH5654","Elboulali, Adel; Akriche, Samah; Rzaigui, Mohamed","Bis(2-methoxybenzylammonium) diaquabis(dihydrogen diphosphato-κ^2^<i>O</i>,<i>O</i>')manganate(II) dihydrate","Acta Crystallographica Section E","2013","69","11","m572","","10.1107/S1600536813026366","","","0.56087","AgKα","","0.1092","0.0468","","","0.0941","0.1116","","","","","","0.976","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238762","7.0412","0.0003","10.1058","0.0004","6.5773","0.0002","90","","95.509","0.003","90","","465.86","0.03","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,5-Dimethoxynaphthalene","","- C12 H12 O2 -","- C12 H12 O2 -","- C24 H24 O4 -","2","0.5","LH5655","Marfo-Owusu, Emmanuel; Thompson, Amber L.","1,5-Dimethoxynaphthalene","Acta Crystallographica Section E","2013","69","11","o1655","o1656","10.1107/S1600536813026731","","","1.5418","CuKα","","0.0361","0.0335","","0.0929","0.0908","0.0929","","","","","","1.0007","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238763","8.7718","0.0003","7.9892","0.0003","11.2921","0.0006","90","","96.581","0.004","90","","786.13","0.06","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Dimethylphosphoryl)methanaminium nitrate","","- C3 H11 N2 O4 P -","- C3 H11 N2 O4 P -","- C12 H44 N8 O16 P4 -","4","1","LH5656","Bianga, Claudia M.; Eggeling, Julia; Reiss, Guido J.","(Dimethylphosphoryl)methanaminium nitrate","Acta Crystallographica Section E","2013","69","11","o1639","o1640","10.1107/S1600536813027694","","","0.71073","MoKα","","0.036","0.0303","","","0.0621","0.0651","","","","","","1.006","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238764","17.1086","0.0006","15.0188","0.0004","19.9578","0.0007","90","","90","","90","","5128.2","0.3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tris[4-bromo-2-(methyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]cobalt(III)","","- C24 H21 Br3 Co N3 O3 -","- C24 H21 Br3 Co N3 O3 -","- C192 H168 Br24 Co8 N24 O24 -","8","1","LH5657","Huang, Qiu-Ping; Zhang, Chun-Lian; Zhao, Ru-Xia; Yang, Li; Jiang, Xi-Fu","Tris[4-bromo-2-(methyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]cobalt(III)","Acta Crystallographica Section E","2013","69","11","m601","","10.1107/S1600536813027591","","","0.71073","MoKα","","0.074","0.0406","","","0.0769","0.0894","","","","","","1.01","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238765","9.2563","0.001","10.6283","0.0011","17.623","0.0019","90","","116.775","0.007","90","","1547.8","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Chlorophenyl)-4-phenyl-1,2-dihydroquinazoline","","- C20 H15 Cl N2 -","- C20 H15 Cl N2 -","- C80 H60 Cl4 N8 -","4","1","LH5660","Derabli, Chamseddine; Boulcina, Raouf; Bouacida, Sofiane; Merazig, Hocine; Debache, Abdelmadjid","2-(4-Chlorophenyl)-4-phenyl-1,2-dihydroquinazoline","Acta Crystallographica Section E","2013","69","11","o1653","o1654","10.1107/S1600536813027839","","","0.71073","MoKα","","0.035","0.0307","","","0.0775","0.0807","","","","","","1.045","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238766","9.1584","0.0017","14.075","0.003","13.856","0.003","90","","90.106","0.003","90","","1786.1","0.6","188","1","188","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[bis[dimethyl(pyridine-κ<i>N</i>)indium(III)]-μ~4~-benzene-1,3-diolato-bis[dimethylindium(III)]-μ~4~-benzene-1,3-diolato]","","- C15 H21 In2 N O2 -","- C15 H21 In2 N O2 -","- C60 H84 In8 N4 O8 -","4","1","LH5663","Briand, Glen G.; Decken, Andreas; Hoey, Marshall R.","<i>catena</i>-Poly[bis[dimethyl(pyridine-κ<i>N</i>)indium(III)]-μ~4~-benzene-1,3-diolato-bis[dimethylindium(III)]-μ~4~-benzene-1,3-diolato]","Acta Crystallographica Section E","2013","69","11","m622","","10.1107/S1600536813028985","","","0.71073","MoKα","","0.0641","0.0347","","","0.0733","0.0867","","","","","","1.156","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238767","5.5151","0.0016","9.045","0.003","12.387","0.004","101","0.005","94.027","0.005","94.78","0.005","602.1","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","1-(4-Chlorophenyl)-3-(3-chloropropionyl)thiourea","","- C10 H10 Cl2 N2 O S -","- C10 H10 Cl2 N2 O S -","- C20 H20 Cl4 N4 O2 S2 -","2","1","LR2115","Yamin, Bohari M.; Soh, Siti K. C.; Yusoff, Siti Fairus M.","1-(4-Chlorophenyl)-3-(3-chloropropionyl)thiourea","Acta Crystallographica Section E","2013","69","11","o1696","","10.1107/S1600536813028511","","","0.71073","MoKα","","0.0716","0.0533","","","0.1113","0.1156","","","","","","1.218","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238768","9.9954","0.0018","10.695","0.002","16.397","0.003","79.764","0.003","83.659","0.003","73.048","0.003","1646.8","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","6,7-Diphenyl-5-thia-7-azaspiro[2.6]nonan-8-one","","- C19 H19 N O S -","- C19 H19 N O S -","- C76 H76 N4 O4 S4 -","4","2","LX2289","Yennawar, Hemant P.; Silverberg, Lee J.","6,7-Diphenyl-5-thia-7-azaspiro[2.6]nonan-8-one","Acta Crystallographica Section E","2013","69","11","o1659","","10.1107/S1600536813027979","","","0.71073","MOKα","","0.0566","0.0466","","","0.1246","0.1343","","","","","","1.019","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238769","13.6792","0.0003","13.6792","0.0003","24.9625","0.0013","90","","90","","90","","4671","0.3","295","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","(1<i>S</i>,1'<i>S</i>,2'<i>R</i>,4a'<i>S</i>,9a'<i>S</i>,9b'<i>R</i>)-1'-Acetyloxy-2,4'-dioxo-2',4',4a',7',8',9',9a',9b'-octahydro-1'<i>H</i>,2<i>H</i>-spiro[acenaphthylene-1,5'-pyrano[4,3-<i>a</i>]pyrrolizin]-2'-ylmethyl acetate","","- C26 H25 N O7 -","- C26 H25 N O7 -","- C208 H200 N8 O56 -","8","1","NC2316","Santhiya, S.; Naga Siva Rao, J.; Raghunathan, R.; Latha, N.; Lakshmi, S.","(1<i>S</i>,1'<i>S</i>,2'<i>R</i>,4a'<i>S</i>,9a'<i>S</i>,9b'<i>R</i>)-1'-Acetyloxy-2,4'-dioxo-2',4',4a',7',8',9',9a',9b'-octahydro-1'<i>H</i>,2<i>H</i>-spiro[acenaphthylene-1,5'-pyrano[4,3-<i>a</i>]pyrrolizin]-2'-ylmethyl acetate","Acta Crystallographica Section E","2013","69","11","o1601","","10.1107/S1600536813026111","","","0.71073","MoKα","","0.0678","0.0423","","","0.0918","0.1041","","","","","","1.06","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2238770","11.1585","0.0017","6.55","0.001","5.233","0.0008","90","","90","","90","","382.47","0.1","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Sodium cadmium orthoarsenate","","- As Cd Na O4 -","- As Cd Na O4 -","- As4 Cd4 Na4 O16 -","4","0.5","PJ2006","Weil, Matthias","Olivine-type NaCd(AsO~4~)","Acta Crystallographica Section E","2013","69","11","i75","","10.1107/S1600536813027256","","","0.71073","MoKα","","0.0189","0.0166","","","0.0413","0.0425","","","","","","1.097","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238771","7.9073","0.0002","9.2891","0.0002","10.8865","0.0002","84.474","0.001","79.798","0.001","72.437","0.001","749.52","0.03","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","(7-Chloro-2-oxo-2<i>H</i>-chromen-4-yl)methyl pyrrolidine-1-carbodithioate","","- C15 H14 Cl N O2 S2 -","- C15 H14 Cl N O2 S2 -","- C30 H28 Cl2 N2 O4 S4 -","2","1","PK2494","Kotresh, O.; Devarajegowda, H. C.; Shirahatti, Arunkumar; Kumar, K. Mahesh; Mahabhaleshwaraiah, N. M.","(7-Chloro-2-oxo-2<i>H</i>-chromen-4-yl)methyl pyrrolidine-1-carbodithioate","Acta Crystallographica Section E","2013","69","11","o1684","o1685","10.1107/S1600536813028080","","","0.71073","MoKα","","0.0337","0.0309","","","0.0972","0.1024","","","","","","1.182","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238772","7.7865","0.0009","7.7865","0.0009","7.466","0.002","90","","90","","90","","452.66","0.14","295","","295","","","","","","","","","4","I -4 2 d","I -4 2bw","122","rubidium dihydrogen arsenate(V)","Rubidium dihydrogenarsenate","","- As H2 O4 Rb -","- As H2 O4 Rb -","- As4 H8 O16 Rb4 -","4","0.25","PK2499","Stöger, Berthold","RbH~2~AsO~4~","Acta Crystallographica Section E","2013","69","11","i73","i74","10.1107/S1600536813026676","","","0.71073","MoKα","","0.0459","0.0254","","","0.0288","0.0317","","","","","","1.25","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238773","7.5163","0.0004","9.6774","0.0005","15.9053","0.0008","86.798","0.001","83.512","0.001","69.385","0.001","1075.75","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","3-(1,3-Diphenylpropan-2-yl)-4-methyl-6-phenylisoxazolo[3,4-<i>d</i>]pyridazin-7(6<i>H</i>)-one","","- C27 H23 N3 O2 -","- C27 H23 N3 O2 -","- C54 H46 N6 O4 -","2","1","QK2060","Campana, Charles F.; Mirzaei, Joseph; Koerner, Chris; Gates, Christina; Natale, Nicholas R.","3-(1,3-Diphenylpropan-2-yl)-4-methyl-6-phenylisoxazolo[3,4-<i>d</i>]pyridazin-7(6<i>H</i>)-one","Acta Crystallographica Section E","2013","69","11","o1680","o1681","10.1107/S160053681302802X","","","1.54178","CuKα","","0.0323","0.0315","","","0.0774","0.0781","","","","","","1.028","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238774","11.9315","0.0008","12.8805","0.001","15.3949","0.0013","90","","99.271","0.004","90","","2335","0.3","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Bis(μ-<i>L</i>-arginine-κ^3^<i>N</i>^2^,<i>O</i>:<i>O</i>')bis(<i>L</i>-arginine-κ^2^<i>N</i>^2^,<i>O</i>)tetra-μ-chlorido-tetrachloridotetracopper(II)","","- C6 H14 Cl2 Cu N4 O2 -","- C6 H14 Cl2 Cu N4 O2 -","- C48 H112 Cl16 Cu8 N32 O16 -","8","4","RK2413","Arularasan, P.; B.Sivakumar; Chakkaravarthi, G.; Mohan, R.","Bis(μ-<small>L</small>-arginine-κ^3^<i>N</i>^2^,<i>O</i>:<i>O</i>')bis(<small>L</small>-arginine-κ^2^<i>N</i>^2^,<i>O</i>)tetra-μ-chlorido-tetrachloridotetracopper(II)","Acta Crystallographica Section E","2013","69","11","m583","m584","10.1107/S1600536813026780","","","0.71073","MoKα","","0.0703","0.047","","","0.1013","0.1119","","","","","","0.978","","","","has coordinates","188723","2020-10-21","18:00:00",""
"2238775","11.041","0.005","5.76","0.004","30.069","0.013","90","","90","","90","","1912.3","1.8","298","2","298","1","","","","","","","","4","P n a 21","P 2c -2n","33","","<i>N</i>,<i>N</i>'-Bis(2-aminobenzyl)ethane-1,2-diaminium dinitrate","","- C16 H24 N6 O6 -","- C16 H24 N6 O6 -","- C64 H96 N24 O24 -","4","1","RK2415","Garza Rodríguez, Luis Ángel; Elizondo Martínez, Perla; Bernès, Sylvain; Nájera Martínez, Blanca; Pérez Rodríguez, Nancy","<i>N</i>,<i>N</i>'-Bis(2-aminobenzyl)ethane-1,2-diaminium dinitrate","Acta Crystallographica Section E","2013","69","11","o1643","o1644","10.1107/S1600536813027475","","","0.71073","MoKα","","0.1042","0.0612","","","0.1443","0.1799","","","","","","1.612","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238776","7.0624","0.0005","7.7132","0.0005","10.346","0.0007","93.353","0.001","90.107","0.001","98.832","0.001","555.92","0.07","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","6-(4-Chlorophenyl)-3-methylimidazo[2,1-<i>b</i>]thiazole","","- C12 H9 Cl N2 S -","- C12 H9 Cl N2 S -","- C24 H18 Cl2 N4 S2 -","2","1","RK2417","Bunev, Alexander S.; Sukhonosova, Elena V.; Statsyuk, Vladimir E.; Ostapenko, Gennady I.; Khrustalev, Victor N.","6-(4-Chlorophenyl)-3-methylimidazo[2,1-<i>b</i>]thiazole","Acta Crystallographica Section E","2013","69","11","o1701","","10.1107/S1600536813028833","","","0.71073","MoKα","","0.0532","0.0376","","","0.0887","0.093","","","","","","1.049","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238777","20.3346","0.0007","4.7167","0.0001","15.5674","0.0006","90","","109.255","0.002","90","","1409.58","0.08","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-2-[2-(3-Nitrophenyl)ethenyl]quinolin-8-ol","","- C17 H12 N2 O3 -","- C17 H12 N2 O3 -","- C68 H48 N8 O12 -","4","1","RN2119","Schulze, Mathias; Seichter, Wilhelm; Weber, Edwin","(<i>E</i>)-2-[2-(3-Nitrophenyl)ethenyl]quinolin-8-ol","Acta Crystallographica Section E","2013","69","11","o1651","o1652","10.1107/S1600536813027815","","","0.71073","MoKα","","0.0946","0.0654","","","0.1822","0.2255","","","","","","1.034","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238778","7.1892","0.0009","7.5438","0.0009","13.2195","0.0015","99.338","0.003","103.334","0.003","100.4","0.003","670.41","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis[(5-bromopyridin-2-yl)methanolato-κ^2^<i>N</i>,<i>O</i>]copper(II) monohydrate","","- C12 H12 Br2 Cu N2 O3 -","- C12 H12 Br2 Cu N2 O3 -","- C24 H24 Br4 Cu2 N4 O6 -","2","1","RU2055","Hamaguchi, Tomohiko; Kawahara, Issei; Ando, Isao","Bis[(5-bromopyridin-2-yl)methanolato-κ^2^<i>N</i>,<i>O</i>]copper(II) monohydrate","Acta Crystallographica Section E","2013","69","11","m585","","10.1107/S1600536813026974","","","0.71075","MoKα","","0.0522","0.0284","","","0.0552","0.0769","","","","","","1.196","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238779","23.4234","0.0014","5.0054","0.0003","15.9408","0.001","90","","97.21","0.006","90","","1854.2","0.2","291","2","291.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","8-Methoxy-3-methyl-3,4-dihydro-2<i>H</i>-1,3-benzoxazine","8-Methoxy-3-methyl-3,4-dihydro-2<i>H</i>-1,3-benzoxazine","","- C10 H13 N O2 -","- C10 H13 N O2 -","- C80 H104 N8 O16 -","8","2","RZ5083","Zhu, Jing; Yang, Xiang-Xiang; Xu, Long-Yu; Ren, Zhi-Dong; Qu, Ling-Bo","8-Methoxy-3-methyl-3,4-dihydro-2<i>H</i>-1,3-benzoxazine","Acta Crystallographica Section E","2013","69","11","o1619","","10.1107/S1600536813026706","","","1.5418","CuKα","","0.0604","0.0406","","","0.1027","0.1144","","","","","","1.019","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238780","7.2703","0.0011","7.3226","0.0007","11.7615","0.0011","88.232","0.008","79.343","0.01","61.35","0.013","538.8","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-[(4-Methylphenyl)sulfanyl]butan-2-one","","- C11 H14 O S -","- C11 H14 O S -","- C22 H28 O2 S2 -","2","1","RZ5084","Novaković, Sladjana B.; Leka, Zorica; Stevanović, Dragana; Muškinja, Jovana; Bogdanović, Goran A.","4-[(4-Methylphenyl)sulfanyl]butan-2-one","Acta Crystallographica Section E","2013","69","11","o1625","","10.1107/S1600536813026895","","","1.5418","CuKα","","0.0635","0.0553","","","0.1555","0.1702","","","","","","1.071","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238781","9.2709","0.0019","11.812","0.002","15.982","0.003","90","","90","","90","","1750.2","0.6","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Amino-6-chloro-<i>N</i>-methylbenzamide","","- C8 H9 Cl N2 O -","- C8 H9 Cl N2 O -","- C64 H72 Cl8 N16 O8 -","8","1","RZ5085","Liang, Yan-Hui; Mei, Xiang-Dong; Li, Yao-Fa; Pan, Wen-Liang; Ning, Jun","2-Amino-6-chloro-<i>N</i>-methylbenzamide","Acta Crystallographica Section E","2013","69","11","o1642","","10.1107/S1600536813027827","","","0.71073","MoKα","","0.0741","0.0646","","","0.1331","0.1386","","","","","","1.174","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238782","9.4737","0.0003","5.1709","0.0002","23.6159","0.0008","90","","96.823","0.001","90","","1148.69","0.07","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Benzylsulfanyl-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine","","- C12 H10 N4 S -","- C12 H10 N4 S -","- C48 H40 N16 S4 -","4","1","RZ5086","El Fal, Mohammed; Ramli, Youssef; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen","4-Benzylsulfanyl-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine","Acta Crystallographica Section E","2013","69","11","o1650","","10.1107/S160053681302789X","","","0.71073","MoKα","","0.0509","0.0405","","","0.1044","0.1124","","","","","","1.031","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238783","7.613","0.0007","14.2716","0.0014","16.2594","0.0013","90","","114.556","0.004","90","","1606.8","0.3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis(μ-hydroxido-κ^2^<i>O</i>:<i>O</i>)bis[bis(5-carboxypyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>^2^)iron(III)] dihydrate","","- C28 H22 Fe2 N4 O20 -","- C28 H22 Fe2 N4 O20 -","- C56 H44 Fe4 N8 O40 -","2","0.5","RZ5089","Cao, Wenhai","Bis(μ-hydroxido-κ^2^<i>O</i>:<i>O</i>)bis[bis(5-carboxypyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>^2^)iron(III)] dihydrate","Acta Crystallographica Section E","2013","69","11","m625","","10.1107/S1600536813029449","","","0.71073","MoKα","","0.045","0.0345","","","0.0902","0.0962","","","","","","1.006","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238784","7.362","0.0003","11.1227","0.0005","21.1248","0.001","90","","95.328","0.001","90","","1722.34","0.13","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis[μ-<i>N</i>-(pyridin-2-ylmethyl)pyridin-3-amine-κ^2^<i>N</i>:<i>N</i>']disilver(I) bis(perchlorate) dimethyl sulfoxide disolvate","","- C26 H34 Ag2 Cl2 N6 O10 S2 -","- C26 H34 Ag2 Cl2 N6 O10 S2 -","- C52 H68 Ag4 Cl4 N12 O20 S4 -","2","0.5","SJ5353","Moon, Suk-Hee; Park, Ki-Min","Bis[μ-<i>N</i>-(pyridin-2-ylmethyl)pyridin-3-amine-κ^2^<i>N</i>:<i>N</i>']disilver(I) bis(perchlorate) dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2013","69","11","m575","m576","10.1107/S1600536813026585","","","0.71073","MoKα","","0.0358","0.0325","","","0.0833","0.0855","","","","","","1.022","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238785","9.7426","0.0007","9.8821","0.0007","11.8356","0.0008","80.107","0.001","73.14","0.001","83.297","0.001","1071.6","0.13","100","","100","","","","","","","","","6","P -1","-P 1","2","","1-Methyl-4-[(<i>E</i>)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]pyridinium 4-bromobenzenesulfonate monohydrate","","- C21 H22 Br N O6 S -","- C21 H22 Br N O6 S -","- C42 H44 Br2 N2 O12 S2 -","2","1","SJ5354","Chantrapromma, Suchada; Ruanwas, Pumsak; Jindawong, Boonwasana; Fun, Hoong-Kun","1-Methyl-4-[(<i>E</i>)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]pyridinium 4-bromobenzenesulfonate monohydrate","Acta Crystallographica Section E","2013","69","11","o1623","o1624","10.1107/S1600536813027244","","","0.71073","MoKα","","0.0462","0.0432","","","0.1223","0.1254","","","","","","1.048","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238786","8.4889","0.0012","8.3552","0.0016","17.143","0.003","90","","91.294","0.011","90","","1215.6","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl (2<i>E</i>)-2-cyano-3-(4-methoxyphenyl)acrylate","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C52 H52 N4 O12 -","4","1","SJ5355","Suchetan, P. A.; Palakshamurthy, B. S.; Mohan, N. R.; Madan Kumar, S.; Lokanath, N. K.; Sreenivasa, S.","Ethyl (2<i>E</i>)-2-cyano-3-(4-methoxyphenyl)acrylate","Acta Crystallographica Section E","2013","69","11","o1610","","10.1107/S1600536813026871","","","1.54178","CuKα","","0.0864","0.0667","","","0.1792","0.2008","","","","","","1.02","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238787","7.402","0.004","8.9","0.005","10.606","0.006","78.186","0.009","84.118","0.008","70.04","0.007","642.4","0.6","168","2","168","2","","","","","","","","5","P -1","-P 1","2","","Aqua(azido)[<i>N</i>-(pyridin-2-ylcarbonyl)pyridine-2-carboxamido-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']copper(II)","","- C12 H10 Cu N6 O3 -","- C12 H10 Cu N6 O3 -","- C24 H20 Cu2 N12 O6 -","2","1","SJ5358","Bruda, Sandra; Turnbull, Mark M.; Wikaira, Jan L.","Aqua(azido)[<i>N</i>-(pyridin-2-ylcarbonyl)pyridine-2-carboxamido-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']copper(II)","Acta Crystallographica Section E","2013","69","11","m598","m599","10.1107/S1600536813027499","","","0.71073","MoKα","","0.0884","0.0634","","","0.0994","0.1053","","","","","","1.168","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238788","8.0508","0.0003","12.9487","0.0004","14.1915","0.0005","83.897","0.002","89.368","0.002","89.704","0.002","1470.94","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","<i>N</i>-[(2-Chlorophenyl)sulfonyl]-2-methoxybenzamide","","- C14 H12 Cl N O4 S -","- C14 H12 Cl N O4 S -","- C56 H48 Cl4 N4 O16 S4 -","4","2","SJ5359","Sreenivasa, S.; Palakshamurthy, B. S.; Suresha, E.; Tonannavar, J.; Jayashree, Yenagi; Suchetan, P. A.","<i>N</i>-[(2-Chlorophenyl)sulfonyl]-2-methoxybenzamide","Acta Crystallographica Section E","2013","69","11","o1716","","10.1107/S1600536813029012","","","0.71073","MoKα","","0.0806","0.0517","","","0.1435","0.1628","","","","","","0.903","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238789","7.2687","0.0013","7.8758","0.0014","14.177","0.003","104.071","0.01","99.672","0.01","97.21","0.01","764.2","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","4-Methoxy-<i>N</i>-(pyridin-4-ylmethyl)-3-(trifluoromethyl)benzamide monohydrate","","- C15 H15 F3 N2 O3 -","- C15 H15 F3 N2 O3 -","- C30 H30 F6 N4 O6 -","2","1","SJ5360","Sreenivasa, S.; Mohan, N. R.; Kumar, Vijith; Palakshamurthy, B. S.; Arunakumar, D. B.; Suchetan, P. A.","4-Methoxy-<i>N</i>-(pyridin-4-ylmethyl)-3-(trifluoromethyl)benzamide monohydrate","Acta Crystallographica Section E","2013","69","11","o1717","o1718","10.1107/S1600536813029103","","","0.71073","MoKα","","0.0588","0.0476","","","0.1259","0.1352","","","","","","1.064","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238790","7.8312","0.0005","13.9334","0.0009","9.6313","0.0006","90","","112.269","0.002","90","","972.54","0.11","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","Tetra-n-butylammonium cyanotrihydroborate","<i>N</i>,<i>N</i>,<i>N</i>-Tributylbutan-1-aminium (<i>T</i>-4)-(cyano-κ<i>C</i>)trihydroborate","","- C17 H39 B N2 -","- C17 H39 B N2 -","- C34 H78 B2 N4 -","2","1","SJ5361","Maris, Thierry","<i>N</i>,<i>N</i>,<i>N</i>-Tributylbutan-1-aminium (<i>T</i>-4)-(cyano-κ<i>C</i>)trihydroborate","Acta Crystallographica Section E","2013","69","11","o1713","","10.1107/S1600536813028924","","","1.54178","CuKα","","0.0347","0.0346","","","0.0916","0.0919","","","","","","1.027","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238791","14.5999","0.0004","16.5714","0.0004","18.0165","0.0004","83.693","0.002","84.586","0.002","87.992","0.002","4311.88","0.19","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","Ethylenediammonium sodium tetrakis[bis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')(oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^)cobalt(III)] [pentahydrogen di(phosphatooctadecatungsten)] tetradecahydrate","","- C26 H102 Co4 N18 Na O154 P4 W36 -","- C26 H102 Co4 N18 Na O154 P4 W36 -","- C26 H102 Co4 N18 Na O154 P4 W36 -","1","0.5","SU2626","Zhang, Shuzhuo; Wang, Jing; Xu, Yun","Ethylenediammonium sodium tetrakis[bis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')(oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^)cobalt(III)] [pentahydrogen di(phosphatooctadecatungstate)] tetradecahydrate","Acta Crystallographica Section E","2013","69","11","m605","m606","10.1107/S160053681302583X","","","0.71073","MoKα","","0.0689","0.0403","","","0.0669","0.0747","","","","","","0.955","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238792","8.5619","0.0001","11.8846","0.0002","17.7457","0.0003","90","","90","","90","","1805.71","0.05","90","0.2","90","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(<i>E</i>)-13-(4-Aminophenyl)parthenolide","(3a<i>S</i>,9a<i>R</i>,10a<i>R</i>,10b<i>S</i>,<i>E</i>)-3-[(<i>E</i>)-4-(4-Aminobenzylidene)-6,9a-dimethyl-3a,4,5,8,9,9a,10a,10b-octahydrooxireno[2',3':9,10]cyclodeca[1,2-<i>b</i>]furan-2(3<i>H</i>)-one","","- C21 H25 N O3 -","- C21 H25 N O3 -","- C84 H100 N4 O12 -","4","1","SU2647","Penthala, Narsimha Reddy; Janganati, Venumadhav; Parkin, Sean; Varughese, Kottayil I.; Crooks, Peter A.","(<i>E</i>)-13-(4-Aminophenyl)parthenolide","Acta Crystallographica Section E","2013","69","11","o1709","o1710","10.1107/S1600536813028730","","","1.54178","CuKα","","0.0268","0.0265","","","0.0699","0.0704","","","","","","1.062","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238793","27.1686","0.0016","27.1686","0.0016","10.8594","0.0006","90","","90","","120","","6941.8","0.7","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","4-Methoxy-<i>N</i>-[(4-methylphenyl)sulfonyl]benzamide","","- C15 H15 N O4 S -","- C15 H15 N O4 S -","- C270 H270 N18 O72 S18 -","18","1","SU2649","Sreenivasa, Swamy; Palakshamurthy, Bandrehalli Siddagangaiah; Tonannavar, Jagdish; Jayashree, Yenagi; Sudha, Achar Gurumurthy; Suchetan, Parameshwar Adimoole","4-Methoxy-<i>N</i>-[(4-methylphenyl)sulfonyl]benzamide including an unknown solvate","Acta Crystallographica Section E","2013","69","11","o1664","o1665","10.1107/S1600536813028158","","","0.71073","MoKα","","0.0527","0.0393","","","0.1032","0.1089","","","","","","1.062","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238794","7.9424","0.0009","14.5238","0.0016","14.6561","0.0016","75.087","0.002","89.99","0.002","86.012","0.002","1629.5","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2-(2,4-Difluorophenyl)-4,5-dimethyl-1-(4-methylphenyl)-1<i>H</i>-imidazole monohydrate","","- C18 H18 F2 N2 O -","- C18 H18 F2 N2 O -","- C72 H72 F8 N8 O4 -","4","2","SU2650","Srinivasan, Natesan; Rizwana Begum, Syed Rafee Ahamed; Hema, Ramu; Sridhar, Balasubramanian; Anitha, Azhagan Ganapathi","2-(2,4-Difluorophenyl)-4,5-dimethyl-1-(4-methylphenyl)-1<i>H</i>-imidazole monohydrate","Acta Crystallographica Section E","2013","69","11","o1599","o1600","10.1107/S1600536813026354","","","0.71073","MoKα","","0.0617","0.048","","","0.1276","0.1401","","","","","","1.001","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238795","26.488","0.003","9.7886","0.0011","12.2163","0.0013","90","","90","","90","","3167.4","0.6","98","2","98","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","4-Amino-<i>N</i>-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide‒1,4-diazabicyclo[2.2.2]octane (2/1)","","- C30 H40 N10 O4 S2 -","- C30 H40 N10 O4 S2 -","- C120 H160 N40 O16 S8 -","4","0.5","SU2652","Arman, Hadi D.; Kaulgud, Trupta; Tiekink, Edward R. T.","4-Amino-<i>N</i>-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide‒1,4-diazabicyclo[2.2.2]octane (2/1)","Acta Crystallographica Section E","2013","69","11","o1615","","10.1107/S1600536813027037","","","0.71073","MoKα","","0.049","0.044","","","0.11","0.1147","","","","","","0.985","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238796","7.823","0.0016","8.174","0.0016","18.994","0.004","90","","97.18","0.03","90","","1205.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Propyl 2-(1<i>H</i>-indol-3-yl)acetate","","- C13 H15 N O2 -","- C13 H15 N O2 -","- C52 H60 N4 O8 -","4","1","SU2653","Tang, Guo-Min; Xu, Wei","Propyl 2-(1<i>H</i>-indol-3-yl)acetate","Acta Crystallographica Section E","2013","69","11","o1686","","10.1107/S1600536813027633","","","0.71073","MoKα","","0.0973","0.0628","","","0.1544","0.1826","","","","","","1.001","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238797","18.001","0.004","7.6371","0.0017","9.372","0.002","90","","105.025","0.003","90","","1244.4","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(2-Chloroacetyl)glycine","","- C4 H6 Cl N O3 -","- C4 H6 Cl N O3 -","- C32 H48 Cl8 N8 O24 -","8","2","SU2655","Zhang, Yu-Cheng; Zhang, Xiu-Qin; Wang, Kai; Chen, Qiang","<i>N</i>-(2-Chloroacetyl)glycine","Acta Crystallographica Section E","2013","69","11","o1712","","10.1107/S1600536813028997","","","0.71073","MoKα","","0.043","0.0384","","","0.1002","0.1025","","","","","","1.066","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238798","6.13183","0.00019","12.0106","0.0004","14.8704","0.0005","90","","94.025","0.003","90","","1092.46","0.06","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1-[4-(4-Hydroxyphenyl)piperazin-1-yl]ethanone","1-[4-(4-Hydroxyphenyl)piperazin-1-yl]ethanone","","- C12 H16 N2 O2 -","- C12 H16 N2 O2 -","- C48 H64 N8 O8 -","4","1","SU2656","Kavitha, Channappa N.; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H. S.; Kaur, Manpreet","1-[4-(4-Hydroxyphenyl)piperazin-1-yl]ethanone","Acta Crystallographica Section E","2013","69","11","o1671","","10.1107/S1600536813028031","","","1.54184","CuKα","","0.0438","0.0405","","","0.1098","0.113","","","","","","1.071","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238799","5.9045","0.0003","15.6099","0.0007","20.0424","0.0009","90","","90","","90","","1847.28","0.15","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Pyrrolidinium-2-carboxylate‒4-nitrophenol (1/2)","","- C17 H19 N3 O8 -","- C17 H19 N3 O8 -","- C68 H76 N12 O32 -","4","1","SU2657","Sowmya, Narayanan Swarna; Vidyalakshmi, Yechuri; Sampathkrishnan, Sadasivam; Srinivasan, Thothadri; Velmurugan, Devadasan","Pyrrolidinium-2-carboxylate‒4-nitrophenol (1/2)","Acta Crystallographica Section E","2013","69","11","o1723","","10.1107/S1600536813028742","","","0.71073","MoKα","","0.0491","0.0365","","","0.087","0.0936","","","","","","1.064","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238800","11.0675","0.0005","8.0429","0.0003","15.6614","0.0007","90","","96.654","0.005","90","","1384.71","0.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate","Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate","","- C15 H11 F3 O2 S -","- C15 H11 F3 O2 S -","- C60 H44 F12 O8 S4 -","4","1","SU2658","Yamuna, Thammarse S.; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H. S.; Kaur, Manpreet","Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate","Acta Crystallographica Section E","2013","69","11","o1670","","10.1107/S1600536813028146","","","1.54184","CuKα","","0.0538","0.0433","","","0.1135","0.1229","","","","","","1.03","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238801","9.0532","0.0008","16.8067","0.0015","19.2508","0.0018","90","","90","","90","","2929.1","0.5","100","2","100","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","4-Ethynyl-<i>N</i>,<i>N</i>-diphenylaniline","","- C20 H15 N -","- C20 H15 N -","- C160 H120 N8 -","8","2","SU2660","Wang, Wan-Qiang","4-Ethynyl-<i>N</i>,<i>N</i>-diphenylaniline","Acta Crystallographica Section E","2013","69","11","o1722","","10.1107/S1600536813029036","","","0.71073","MoKα","","0.0464","0.0444","","","0.118","0.1209","","","","","","1.016","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238802","8.1848","0.0003","8.3253","0.0004","16.3194","0.0006","84.168","0.002","85.653","0.002","60.843","0.002","965.64","0.07","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","2-Allyl-7-nitro-2<i>H</i>-indazole","","- C10 H9 N3 O2 -","- C10 H9 N3 O2 -","- C40 H36 N12 O8 -","4","2","TK5258","Kouakou, Assoman; Rakib, El Mostapha; Spinelli, Domenico; Saadi, Mohamed; El Ammari, Lahcen","2-Allyl-7-nitro-2<i>H</i>-indazole","Acta Crystallographica Section E","2013","69","11","o1603","o1604","10.1107/S1600536813026743","","","0.71073","MoKα","","0.056","0.0463","","","0.1333","0.1423","","","","","","1.035","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238803","24.9063","0.0008","4.7226","0.0001","8.318","0.0003","90","","105.432","0.001","90","","943.11","0.05","295","2","295","2","","","","","","","","5","C 1 2 1","C 2y","5","","<i>catena</i>-Poly[[bis(nitrato-κ^2^<i>O</i>,<i>O</i>')barium]-bis(μ-<i>L</i>-histidine-κ^3^<i>O</i>,<i>O</i>':<i>O</i>]","","- C12 H18 Ba N8 O10 -","- C12 H18 Ba N8 O10 -","- C24 H36 Ba2 N16 O20 -","2","0.5","TK5259","Arularasan, P.; Chakkaravarthi, G.; Mohan, R.","<i>catena</i>-Poly[[bis(nitrato-κ^2^<i>O</i>,<i>O</i>')barium]-bis(μ-<small>L</small>-histidine-κ^3^<i>O</i>,<i>O</i>':<i>O</i>]","Acta Crystallographica Section E","2013","69","11","m597","","10.1107/S1600536813027402","","","0.71073","MoKα","","0.0189","0.0189","","","0.0484","0.0484","","","","","","1.15","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238804","22.122","0.004","13.616","0.003","10.565","0.002","90","","115.23","0.03","90","","2878.7","1.2","95","2","95","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3,14-Diethyl-2,13-diaza-6,17-diazoniatricyclo[16.4.0.0^7,12^]docosane dichloride tetrahydrate","","- C22 H54 Cl2 N4 O4 -","- C22 H54 Cl2 N4 O4 -","- C88 H216 Cl8 N16 O16 -","4","0.5","TK5261","Moon, Dohyun; Subhan, Md Abdus; Choi, Jong-Ha","3,14-Diethyl-2,13-diaza-6,17-diazoniatricyclo[16.4.0.0^7,12^]docosane dichloride tetrahydrate from synchrotron radiation","Acta Crystallographica Section E","2013","69","11","o1620","","10.1107/S1600536813027232","","","0.72","synchrotron","","0.0308","0.0289","","","0.078","0.079","","","","","","1.046","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238805","7.0982","0.0003","8.4931","0.0004","20.497","0.0009","90","","90","","90","","1235.68","0.1","123","","123","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2,4,6-trinitrophenyl furan 2-carboxilate","2,4,6-Trinitrophenyl furan-2-carboxylate","","- C11 H5 N3 O9 -","- C11 H5 N3 O9 -","- C44 H20 N12 O36 -","4","1","TK5263","Moreno-Fuquen, Rodolfo; Mosquera, Fabricio; Kennedy, Alan R.","2,4,6-Trinitrophenyl furan-2-carboxylate","Acta Crystallographica Section E","2013","69","11","o1682","","10.1107/S1600536813028274","","","0.71073","MoKα","","0.0452","0.0389","","","0.0917","0.0948","","","","","","1.063","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238806","6.048","0.003","7.312","0.004","9.024","0.005","90","","100.78","0.01","90","","392","0.4","153","2","153","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2-[(1<i>H</i>-Pyrrol-2-yl)methyl]-1<i>H</i>-pyrrole","","- C9 H10 N2 -","- C9 H10 N2 -","- C18 H20 N4 -","2","1","TK5264","Kim, Chong-Hyeak; Jeon, Yea-Sel; Lynch, Vincent; Sessler, Jonathan L.; Hwang, Kwang-Jin","2-[(1<i>H</i>-Pyrrol-2-yl)methyl]-1<i>H</i>-pyrrole","Acta Crystallographica Section E","2013","69","11","o1697","","10.1107/S1600536813028365","","","0.71075","MoKα","","0.0815","0.0567","","","0.1195","0.1321","","","","","","1.048","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238807","18.0158","0.0004","5.9346","0.0001","25.548","0.0008","90","","90","","90","","2731.5","0.11","290","2","290","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","<i>N</i>-[(1,3-Benzodioxol-5-yl)methyl]benzenesulfonamide","","- C14 H13 N O4 S -","- C14 H13 N O4 S -","- C112 H104 N8 O32 S8 -","8","1","TK5268","Maganhi, Stella H.; Tavares, Maurício T.; Damião, Mariana C. F. C. B.; Parise Filho, Roberto","<i>N</i>-[(1,3-Benzodioxol-5-yl)methyl]benzenesulfonamide: an analogue of capsaicin","Acta Crystallographica Section E","2013","69","11","o1700","","10.1107/S1600536813028481","","","0.71073","MoKα","","0.0774","0.0512","","","0.1322","0.1492","","","","","","1.04","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238808","13.439","0.003","15.636","0.003","18.644","0.004","90","","108.6","0.03","90","","3713.1","1.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","<i>tert</i>-Butyl 2-(6-{2-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)pyrrol-1-yl]ethyl}-2,2-dimethyl-1,3-dioxan-4-yl)acetate","","- C40 H47 F N2 O5 -","- C40 H47 F N2 O5 -","- C160 H188 F4 N8 O20 -","4","2","VM2197","Wu, Ya-Ming","<i>tert</i>-Butyl 2-(6-{2-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)pyrrol-1-yl]ethyl}-2,2-dimethyl-1,3-dioxan-4-yl)acetate","Acta Crystallographica Section E","2013","69","11","o1621","","10.1107/S160053681302624X","","","0.71073","MoKα","","0.1243","0.059","","","0.0879","0.104","","","","","","1","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238809","39.45","0.004","5.4465","0.0005","32.787","0.003","90","","119.185","0.009","90","","6150.4","1.1","223","","223","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Anthracene-1,4,9,10-tetraone","","- C14 H6 O4 -","- C14 H6 O4 -","- C336 H144 O96 -","24","3","VM2198","Kitamura, Chitoshi; Kawase, Takeshi","Anthracene-1,4,9,10-tetraone","Acta Crystallographica Section E","2013","69","11","o1597","","10.1107/S1600536813026342","","","0.71073","MoKα","","0.162","0.0698","","","0.1493","0.2044","","","","","","0.994","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238810","17.3634","0.0013","11.4669","0.0009","6.0818","0.0004","90","","90","","90","","1210.91","0.15","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","1<i>H</i>-Benzotriazole‒4-hydroxybenzoic acid (1/1)","","- C13 H11 N3 O3 -","- C13 H11 N3 O3 -","- C52 H44 N12 O12 -","4","1","VM2200","Thirunavukkarasu, A.; Silambarasan, A.; Chakkaravarthi, G.; Mohankumar, R.; Umarani, P. R.","1<i>H</i>-Benzotriazole‒4-hydroxybenzoic acid (1/1)","Acta Crystallographica Section E","2013","69","11","o1605","","10.1107/S1600536813026767","","","0.71073","MoKα","","0.0374","0.0307","","","0.07","0.074","","","","","","1.042","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238811","10.318","0.002","19.262","0.004","10.721","0.002","90","","113.32","0.03","90","","1956.7","0.8","173.15","","173.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(μ-diphenylphosphanyl)bis[(trimethylphosphane)cobalt(I)](<i>Co</i>—<i>Co</i>)","","- C36 H56 Co2 P6 -","- C36 H56 Co2 P6 -","- C72 H112 Co4 P12 -","2","0.5","WM2765","Beck, Robert; Klein, Hans-Friedrich","Bis(μ-diphenylphosphanyl)bis[(trimethylphosphane)cobalt(I)](<i>Co</i>—<i>Co</i>)","Acta Crystallographica Section E","2013","69","11","m604","","10.1107/S1600536813027384","","","0.71073","MoKα","","0.0685","0.037","","","0.0768","0.083","","","","","","0.813","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238812","27.9894","0.001","12.3088","0.0005","19.3457","0.0007","90","","105.542","0.001","90","","6421.2","0.4","115","2","115","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(cyclohexylammonium) <i>cis</i>-dichloridobis(oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^)stannate(IV) chloride monohydrate","","- C22 H44 Cl3 N3 O9 Sn -","- C22 H44 Cl3 N3 O9 Sn -","- C176 H352 Cl24 N24 O72 Sn8 -","8","1","WM2771","Sarr, Modou; Diallo, Waly; Diasse-Sarr, Aminata; Plasseraud, Laurent; Cattey, Hélène","Tris(cyclohexylammonium) <i>cis</i>-dichloridobis(oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^)stannate(IV) chloride monohydrate","Acta Crystallographica Section E","2013","69","11","m581","m582","10.1107/S1600536813026901","","","0.71073","MoKα","","0.0674","0.049","","","0.0865","0.0947","","","","","","1.223","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238813","7.1488","0.0006","19.7517","0.0018","8.5126","0.0007","90","","92.674","0.008","90","","1200.68","0.18","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichloridobis[1-(2,4,6-trimethylphenyl)-1<i>H</i>-imidazole-κ<i>N</i>^3^]copper(II)","","- C24 H28 Cl2 Cu N4 -","- C24 H28 Cl2 Cu N4 -","- C48 H56 Cl4 Cu2 N8 -","2","0.5","WM2773","Zhang, Yantao; Lin, Zhuzhen","Dichloridobis[1-(2,4,6-trimethylphenyl)-1<i>H</i>-imidazole-κ<i>N</i>^3^]copper(II)","Acta Crystallographica Section E","2013","69","11","m621","","10.1107/S1600536813028821","","","1.54178","CuKα","","0.0646","0.0521","","","0.1324","0.1446","","","","","","1.024","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238814","15.8353","0.0007","10.226","0.0004","12.6532","0.0004","90","","90","","90","","2048.96","0.14","200","2","200","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)","","- C22 H22 Mn N2 O4 -","- C22 H22 Mn N2 O4 -","- C88 H88 Mn4 N8 O16 -","4","0.5","WM2774","Suckert, Stefan; Jess, Inke; Näther, Christian","Redetermination of bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)","Acta Crystallographica Section E","2013","69","11","m620","","10.1107/S1600536813028614","","","0.71073","MoKα","","0.0562","0.0465","","","0.099","0.103","","","","","","1.161","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238815","9.36","0.0003","7.81198","0.00019","11.9892","0.0003","90","","110.11","0.003","90","","823.21","0.04","290","2","290","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis[(dimethylphosphoryl)methanaminium] tetrachloridopalladate(II)","","- C6 H22 Cl4 N2 O2 P2 Pd -","- C6 H22 Cl4 N2 O2 P2 Pd -","- C12 H44 Cl8 N4 O4 P4 Pd2 -","2","0.5","WM2775","Reiss, Guido J.","Bis[(dimethylphosphoryl)methanaminium] tetrachloridopalladate(II)","Acta Crystallographica Section E","2013","69","11","m614","m615","10.1107/S1600536813028067","","","0.71073","MoKα","","0.0302","0.0223","","","0.0479","0.0509","","","","","","1.089","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238816","6.5974","0.0002","6.8994","0.0002","6.9961","0.0002","83.325","0.001","63.898","0.001","80.145","0.001","281.45","0.015","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","Dicadmium divanadate(V)","","- Cd2 O7 V2 -","- Cd2 O7 V2 -","- Cd4 O14 V4 -","2","1","WM2776","Ould Saleck, Ahmed; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen","A triclinic polymorph of dicadmium divanadate(V)","Acta Crystallographica Section E","2013","69","11","i79","","10.1107/S1600536813028869","","","0.71073","MoKα","","0.0164","0.0155","","","0.0369","0.0374","","","","","","1.206","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238817","6.863","0.003","9.553","0.003","6.302","0.002","90","","90","","90","","413.2","0.3","293","2","293","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","Tridysprosium nickel","","- Dy3 Ni -","- Dy3 Ni -","- Dy12 Ni4 -","4","0.5","WM2777","Levytskyy, Volodymyr; Babizhetskyy, Volodymyr; Kotur, Bohdan; Smetana, Volodymyr","Redetermination of Dy~3~Ni from single-crystal X-ray data","Acta Crystallographica Section E","2013","69","11","i80","","10.1107/S1600536813028717","","","0.71073","MoKα","","0.0697","0.0417","","","0.0485","0.052","","","","","","1.12","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238818","8.8115","0.001","11.4587","0.0013","18.785","0.002","90","","98.226","0.002","90","","1877.2","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-oxido-bis({2,2'-[ethane-1,2-diylbis(nitrilomethanylylidene)]diphenolato}titanium(IV)) chloroform disolvate","","- C34 H30 Cl6 N4 O6 Ti2 -","- C34 H30 Cl6 N4 O6 Ti2 -","- C68 H60 Cl12 N8 O12 Ti4 -","2","0.5","WM2780","Zaitsev, Kirill V.; Karlov, Sergey S.; Zaitseva, Galina S.; Lermontova, Elmira Kh.; Churakov, Andrei V.","Di-μ-oxido-bis({2,2'-[ethane-1,2-diylbis(nitrilomethanylylidene)]diphenolato}titanium(IV)) chloroform disolvate","Acta Crystallographica Section E","2013","69","11","m626","m627","10.1107/S1600536813029371","","","0.71073","MoKα","","0.0393","0.0314","","","0.0797","0.0836","","","","","","1.035","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238819","9.8118","0.0008","29.014","0.002","25.5854","0.0017","90","","90.196","0.006","90","","7283.6","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","di-benzylaminogossypol","2,2'-Bis{8-[(benzylamino)methylidene]-1,6-dihydroxy-5-isopropyl-8-[(benzylamino)methylidene]-3-methylnaphthalen-7(8<i>H</i>)-one}","","- C44 H44 N2 O6 -","- C44 H44 N2 O6 -","- C352 H352 N16 O48 -","8","2","XU5738","Hakberdiev, Shukhrat M.; Talipov, Samat A.; Dalimov, Davranbek N.; Ibragimov, Bakhtiyar T.","2,2'-Bis{8-[(benzylamino)methylidene]-1,6-dihydroxy-5-isopropyl-3-methylnaphthalen-7(8<i>H</i>)-one}","Acta Crystallographica Section E","2013","69","11","o1626","o1627","10.1107/S1600536813027281","","","1.54184","CuKα","","0.1166","0.0615","","","0.1637","0.1912","","","","","","0.937","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238820","4.8367","0.0003","9.0903","0.0006","9.4078","0.0006","108.091","0.001","100.637","0.001","102.275","0.001","369.95","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Poly[bis(ethanol)(μ~4~-2,3,5,6-tetrafluorobenzene-1,4-dicarboxylato)cadmium]","","- C12 H12 Cd F4 O6 -","- C12 H12 Cd F4 O6 -","- C12 H12 Cd F4 O6 -","1","0.5","XU5740","Ko, Nakeun; Kim, Jaheon","Poly[bis(ethanol)(μ~4~-2,3,5,6-tetrafluorobenzene-1,4-dicarboxylato)cadmium]","Acta Crystallographica Section E","2013","69","11","m577","m578","10.1107/S1600536813026287","","","0.71073","MoKα","","0.0206","0.0204","","","0.0542","0.0543","","","1.107","","","1.102","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238821","9.7357","0.0003","15.6699","0.0006","13.0764","0.0005","90","","94.791","0.001","90","","1987.93","0.12","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[(μ~3~-5-<i>tert</i>-butylbenzene-1,3-dicarboxylato)dipyridinecobalt(II)]","","- C22 H22 Co N2 O4 -","- C22 H22 Co N2 O4 -","- C88 H88 Co4 N8 O16 -","4","1","XU5741","Noh, Kyungkyou; Kim, Jaheon","Poly[(μ~3~-5-<i>tert</i>-butylbenzene-1,3-dicarboxylato)dipyridinecobalt(II)]","Acta Crystallographica Section E","2013","69","11","m579","m580","10.1107/S1600536813026640","","","0.71073","MoKα","","0.0603","0.0489","","","0.1249","0.1345","","","","","","1.106","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238822","14.023","0.003","6.383","0.0013","30.493","0.006","90","","102.79","0.03","90","","2661.7","1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","<i>N</i>-[5-(Diphenylphosphorylmethyl)-4-(4-fluorophenyl)-6-isopropylpyrimidin-2-yl]-<i>N</i>-methylmethanesulfonamide","","- C28 H29 F N3 O3 P S -","- C28 H29 F N3 O3 P S -","- C112 H116 F4 N12 O12 P4 S4 -","4","1","XU5743","Wu, Ya-Ming","<i>N</i>-[5-(Diphenylphosphorylmethyl)-4-(4-fluorophenyl)-6-isopropylpyrimidin-2-yl]-<i>N</i>-methylmethanesulfonamide","Acta Crystallographica Section E","2013","69","11","o1673","","10.1107/S1600536813028286","","","0.71073","MoKα","","0.1406","0.0649","","","0.1138","0.1357","","","","","","1","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238823","11.305","0.002","11.102","0.002","8.8737","0.0016","90","","94.565","0.005","90","","1110.2","0.3","98","2","98","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Aminobenzoic acid‒4-[2-(pyridin-4-yl)ethyl]pyridine (2/1)","","- C26 H26 N4 O4 -","- C26 H26 N4 O4 -","- C52 H52 N8 O8 -","2","0.5","XU5744","Arman, Hadi D.; Tiekink, Edward R. T.","2-Aminobenzoic acid‒4-[2-(pyridin-4-yl)ethyl]pyridine (2/1)","Acta Crystallographica Section E","2013","69","11","o1616","","10.1107/S1600536813027128","","","0.71069","MoKα","","0.0477","0.045","","","0.1095","0.1119","","","","","","1.081","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238824","8.4282","0.0017","11.132","0.002","16.14","0.005","90","","121.39","0.02","90","","1292.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(nitrato-κ^2^<i>O</i>,<i>O</i>')copper(II)","","- C10 H8 Cu N4 O6 -","- C10 H8 Cu N4 O6 -","- C40 H32 Cu4 N16 O24 -","4","1","XU5745","Liu, Feng-Yi; Zhang, Ming-Hui; Kou, Jun-Feng","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(nitrato-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2013","69","11","m609","","10.1107/S1600536813028201","","","0.71073","MoKα","","0.0509","0.0353","","","0.0888","0.0983","","","","","","1.042","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238825","7.859","0.002","5.9448","0.0015","19.83","0.005","90","","100.962","0.003","90","","909.6","0.4","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[2-methylpyridinium [tungstate-di-μ-selenido-silver-di-μ-selenido] 2-methylpyridine monosolvate]","","- C12 H15 Ag N2 Se4 W -","- C12 H15 Ag N2 Se4 W -","- C24 H30 Ag2 N4 Se8 W2 -","2","0.5","XU5746","Zhou, Lu-Jun; Shi, Hua-Tian; Xu, Chao; Chen, Qun; Zhang, Qian-Feng","<i>catena</i>-Poly[2-methylpyridinium [tungstate-di-μ-selenido-silver-di-μ-selenido] 2-methylpyridine monosolvate]","Acta Crystallographica Section E","2013","69","11","m608","","10.1107/S1600536813028213","","","0.71073","MoKα","","0.05","0.0337","","","0.0713","0.0778","","","","","","0.968","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238826","9.1","0.0002","12.549","0.0004","14.407","0.0005","90","","90","","90","","1645.22","0.09","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1<i>S</i>,3<i>R</i>,8<i>R</i>)-10-Bromomethyl-2,2-dichloro-3,7,7-trimethyltricyclo[6.4.0.0^1,3^]dodec-9-ene","","- C16 H23 Br Cl2 -","- C16 H23 Br Cl2 -","- C64 H92 Br4 Cl8 -","4","1","YK2099","Bimoussa, Abdoullah; Auhmani, Aziz; Ait Itto, My Youssef; Daran, Jean-Claude; Auhmani, Abdelwahed","Absolute configuration of (1<i>S</i>,3<i>R</i>,8<i>R</i>)-10-bromomethyl-2,2-dichloro-3,7,7-trimethyltricyclo[6.4.0.0^1,3^]dodec-9-ene","Acta Crystallographica Section E","2013","69","11","o1692","o1693","10.1107/S1600536813028183","","","1.54184","CuKα","","0.0281","0.0267","","","0.0681","0.0695","","","","","","1.039","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238827","17.9719","0.0009","9.7654","0.0005","7.3637","0.0003","90","","92.134","0.001","90","","1291.45","0.11","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(2<i>R</i>,2'<i>S</i>)-2,2'-Bipiperidine-1,1'-diium dibromide","","- C10 H22 Br2 N2 -","- C10 H22 Br2 N2 -","- C40 H88 Br8 N8 -","4","0.5","ZL2557","Yang, Guang; Noll, Bruce C.; Rybak-Akimova, Elena V.","(2<i>R</i>,2'<i>S</i>)-2,2'-Bipiperidine-1,1'-diium dibromide","Acta Crystallographica Section E","2013","69","11","o1711","","10.1107/S1600536813028754","","","0.71073","MoKα","","0.0212","0.0179","","","0.0438","0.0449","","","","","","1.109","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238828","6.7117","0.0011","12.1495","0.0019","13.102","0.003","82.714","0.015","89.252","0.016","83.238","0.013","1052.4","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","Bis(2,4,6-triamino-1,3,5-triazin-1-ium) 2-[bis(carboxylatomethyl)azaniumyl]acetate trihydrate","","- C12 H27 N13 O9 -","- C12 H27 N13 O9 -","- C24 H54 N26 O18 -","2","1","ZL2565","Hoxha, Kreshnik; Prior, Timothy J.","Bis(2,4,6-triamino-1,3,5-triazin-1-ium) 2-[bis(carboxylatomethyl)azaniumyl]acetate trihydrate","Acta Crystallographica Section E","2013","69","11","o1674","o1675","10.1107/S1600536813028250","","","0.71073","MoKα","","0.141","0.0843","","","0.2137","0.2435","","","","","","0.951","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238829","27.9353","0.0014","5.9247","0.0003","18.7763","0.0007","90","","126.527","0.003","90","","2497.2","0.2","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-Methyl-<i>N</i>-(4-nitrobenzylidene)piperazin-1-amine","","- C12 H16 N4 O2 -","- C12 H16 N4 O2 -","- C96 H128 N32 O16 -","8","1","ZL2568","Kavitha, Channappa N.; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H.S.; Kaur, Manpreet","4-Methyl-<i>N</i>-(4-nitrobenzylidene)piperazin-1-amine","Acta Crystallographica Section E","2013","69","11","o1687","o1688","10.1107/S1600536813028493","","","1.54184","CuKα","","0.0491","0.0405","","","0.1101","0.1189","","","","","","1.024","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238830","27.397","0.0017","9.5764","0.0006","21.6754","0.0014","90","","97.433","0.001","90","","5639.1","0.6","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[diaqua[μ~2~-4-(4-carboxyphenoxy)benzoato](μ~2~-4,4'-oxydibenzoato)praseodymium(III)] monohydrate]","","- C28 H23 O13 Pr -","- C28 H23 O13 Pr -","- C224 H184 O104 Pr8 -","8","1","ZS2278","Li, Ping; Su, Duo-Meng; Zheng, Chang-Ge","<i>catena</i>-Poly[[diaqua[μ~2~-4-(4-carboxyphenoxy)benzoato](μ~2~-4,4'-oxydibenzoato)praseodymium(III)] monohydrate]","Acta Crystallographica Section E","2013","69","11","m586","m587","10.1107/S1600536813026421","","","0.71073","MoKα","","0.0274","0.0245","","","0.0565","0.0588","","","","","","1.08","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238831","10.231","0.002","8.754","0.002","12.826","0.003","90","","101.27","0.03","90","","1126.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>'-Dimethyl-<i>N</i>''-(trichloroacetyl)phosphoramide","","- C4 H9 Cl3 N3 O2 P -","- C4 H9 Cl3 N3 O2 P -","- C16 H36 Cl12 N12 O8 P4 -","4","1","BG2520","Ovchynnikov, Vladimir","<i>N</i>,<i>N</i>'-Dimethyl-<i>N</i>''-(trichloroacetyl)phosphoramide","Acta Crystallographica Section E","2013","69","12","o1759","","10.1107/S1600536813030389","","","0.71073","MoKα","","0.0951","0.0765","","","0.1821","0.1954","","","","","","1.079","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238832","8.1267","0.0006","9.857","0.0008","17.2099","0.0012","90","","93.564","0.007","90","","1375.93","0.18","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>exo</i>-1,7-Dimethyl-4-phenyl-10-oxa-4-azatricyclo[5.2.1.0^2,6^]dec-8-ene-3,5-dione","","- C16 H15 N O3 -","- C16 H15 N O3 -","- C64 H60 N4 O12 -","4","1","BH2487","Pineda-Contreras, Armando; Vázquez-Vuelvas, Oscar Fernando; Negrete-López, Laura Edith; García-Ortega, Héctor; Flores-Alamo, Marcos","<i>exo</i>-1,7-Dimethyl-4-phenyl-10-oxa-4-azatricyclo[5.2.1.0^2,6^]dec-8-ene-3,5-dione","Acta Crystallographica Section E","2013","69","12","o1756","","10.1107/S1600536813030262","","","0.71073","MoKα","","0.0556","0.0399","","","0.0899","0.1012","","","","","","1.024","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238833","12.537","0.003","6.6745","0.0013","28.975","0.006","90","","90","","90","","2424.6","0.9","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(5-amino-1<i>H</i>-tetrazole-κ<i>N</i>^4^)diaqua(oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^)cadmium","","- C4 H10 Cd N10 O6 -","- C4 H10 Cd N10 O6 -","- C32 H80 Cd8 N80 O48 -","8","1","BH2488","Liang, Qian; Wang, Yulin; Zhao, Yan; Cao, Gaojuan","Bis(5-amino-1<i>H</i>-tetrazole-κ<i>N</i>^4^)diaqua(oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^)cadmium","Acta Crystallographica Section E","2013","69","12","m645","m646","10.1107/S1600536813030158","","","0.71073","MoKα","","0.0299","0.0293","","","0.0782","0.0786","","","","","","1.065","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238834","9.3327","0.0008","12.4575","0.0007","10.3103","0.0007","90","","105.469","0.008","90","","1155.27","0.15","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(11a<i>S</i>)-1,5,11,11a-Tetrahydro-1-benzothieno[3,2-<i>f</i>]indolizin-3(2<i>H</i>)-one","","- C14 H13 N O S -","- C14 H13 N O S -","- C56 H52 N4 O4 S4 -","4","2","BQ2390","Vrábel, Viktor; Sivý, Július; Šafář, Peter; Kožíšek, Jozef","(11a<i>S</i>)-1,5,11,11a-Tetrahydro-1-benzothieno[3,2-<i>f</i>]indolizin-3(2<i>H</i>)-one","Acta Crystallographica Section E","2013","69","12","o1819","o1820","10.1107/S1600536813031693","","","0.71073","MoKα","","0.0735","0.0395","","","0.0581","0.0645","","","","","","0.944","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238835","10.3982","0.0009","16.087","0.002","6.4421","0.0006","90","","120.425","0.009","90","","929.21","0.19","298","2","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Trisodium dicobalt(II) (arsenate/phosphate) (diarsenate/diphosphate)","","- As2.42 Co2 Na3 O11 P0.57 -","- As2.425 Co2 Na2.9975 O11 P0.575 -","- As9.7 Co8 Na11.99 O44 P2.3 -","4","0.5","BR2232","Ben Smida, Youssef; Guesmi, Abderrahmen; Zid, Mohamed Faouzi; Driss, Ahmed","Na~3~Co~2~(As~0.52~P~0.48~)O~4~(As~0.95~P~0.05~)~2~O~7~","Acta Crystallographica Section E","2013","69","12","i85","i86","10.1107/S1600536813032029","","","0.71073","MoKα","","0.0226","0.0199","","","0.0485","0.0494","","","","","","1.149","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238836","9.021","0.005","9.604","0.005","15.254","0.005","72.72","0.005","76.997","0.005","63.875","0.005","1126.1","0.9","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","16-Methyl-11-(2-methylphenyl)-14-phenyl-8,12-dioxa-14,15-diazatetracyclo[8.7.0.0^2,7^.0^13,17^]heptadeca-2(7),3,5,13(17),15-pentaene-10-carbonitrile","","- C28 H23 N3 O2 -","- C28 H23 N3 O2 -","- C56 H46 N6 O4 -","2","1","BT6941","Kanchanadevi, Jeevanandam; Anbalagan, Gopalakrishnan; Kannan, Damodharan; Bakthadoss, Manickam; Manivannan, Vadivelu","16-Methyl-11-(2-methylphenyl)-14-phenyl-8,12-dioxa-14,15-diazatetracyclo[8.7.0.0^2,7^.0^13,17^]heptadeca-2(7),3,5,13(17),15-pentaene-10-carbonitrile","Acta Crystallographica Section E","2013","69","12","o1746","","10.1107/S1600536813029905","","","0.71073","MoKα","","0.0627","0.0431","","","0.1181","0.1328","","","","","","1.028","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238837","13.8803","0.0006","8.3195","0.0005","15.9035","0.0007","90","","90","","90","","1836.49","0.16","200","2","200","2","","","","","","","","6","C m c 21","C 2c -2","36","","Bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(pyridine-κ<i>N</i>)(thiocyanato-κ<i>N</i>)manganese(III)","","- C16 H19 Mn N2 O4 S -","- C16 H19 Mn N2 O4 S -","- C64 H76 Mn4 N8 O16 S4 -","4","0.5","BT6942","Suckert, Stefan; Jess, Inke; Näther, Christian","Bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(pyridine-κ<i>N</i>)(thiocyanato-κ<i>N</i>)manganese(III): a redetermination using data from a single crystal","Acta Crystallographica Section E","2013","69","12","m657","","10.1107/S1600536813030407","","","0.71073","MoKα","","0.0346","0.0302","","","0.064","0.066","","","","","","1.044","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238838","7.3477","0.0007","15.4143","0.0014","20.3747","0.0019","104.642","0.008","92.414","0.008","90.793","0.007","2230","0.4","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)<i>-N</i>,<i>N</i>-Diethyl-2,6-diisopropyl-4-[2-(4-nitrophenyl)ethenyl]aniline","","- C24 H32 N2 O2 -","- C24 H32 N2 O2 -","- C96 H128 N8 O8 -","4","2","BT6943","Wink, Christoph; Schollmeyer, Dieter; Detert, Heiner","(<i>E</i>)<i>-N</i>,<i>N</i>-Diethyl-2,6-diisopropyl-4-[2-(4-nitrophenyl)ethenyl]aniline","Acta Crystallographica Section E","2013","69","12","o1785","o1786","10.1107/S1600536813030948","","","0.71073","MoKα","","0.1559","0.0567","","","0.1328","0.1739","","","","","","0.79","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238839","6.5975","0.0002","15.2612","0.0003","8.2688","0.0002","90","","100.045","0.003","90","","819.79","0.04","180","2","180","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1<i>S</i>,3<i>R</i>,8<i>R</i>,10<i>R</i>)-2,2-Dibromo-3,7,7,10-tetramethyltricyclo[6.4.0.0^1,3^]dodecan-9-one","","- C16 H24 Br2 O -","- C16 H24 Br2 O -","- C32 H48 Br4 O2 -","2","1","BT6944","Benharref, Ahmed; Mazoir, Noureddine; Daran, Jean-Claude; Berraho, Moha","(1<i>S</i>,3<i>R</i>,8<i>R</i>,10<i>R</i>)-2,2-Dibromo-3,7,7,10-tetramethyltricyclo[6.4.0.0^1,3^]dodecan-9-one","Acta Crystallographica Section E","2013","69","12","o1777","o1778","10.1107/S1600536813030936","","","1.54184","CuKα","","0.022","0.0219","","","0.0572","0.0573","","","","","","1.072","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238840","8.2615","0.0003","10.7624","0.0005","13.2432","0.0006","68.606","0.002","80.554","0.003","81.012","0.002","1075.53","0.08","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","(<i>E</i>)-1-[2-(4-Fluoro-2-nitrostyryl)-1-phenylsulfonyl-1<i>H</i>-indol-3-yl]propan-1-one","","- C25 H19 F N2 O5 S -","- C25 H19 F N2 O5 S -","- C50 H38 F2 N4 O10 S2 -","2","1","BT6945","Umadevi, M.; Saravanan, V.; Yamuna, R.; Mohanakrishnan, A. K.; Chakkaravarthi, G.","(<i>E</i>)-1-[2-(4-Fluoro-2-nitrostyryl)-1-phenylsulfonyl-1<i>H</i>-indol-3-yl]propan-1-one","Acta Crystallographica Section E","2013","69","12","o1780","","10.1107/S1600536813030961","","","0.71073","MoKα","","0.0835","0.0552","","","0.1518","0.1757","","","","","","1.025","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238841","7.75379","0.00016","11.9658","0.0003","14.9005","0.0003","90","","90","","90","","1382.47","0.05","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-Chloro-3-methylphenyl quinoline-2-carboxylate","","- C17 H12 Cl N O2 -","- C17 H12 Cl N O2 -","- C68 H48 Cl4 N4 O8 -","4","1","BT6947","Fazal, E.; Kaur, Manpreet; Sudha, B. S.; Nagarajan, S.; Jasinski, Jerry P.","4-Chloro-3-methylphenyl quinoline-2-carboxylate","Acta Crystallographica Section E","2013","69","12","o1842","o1843","10.1107/S1600536813032017","","","1.54184","CuKα","","0.0329","0.032","","","0.0841","0.085","","","","","","1.049","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238842","12.71","0.003","13.227","0.003","14.431","0.003","110.28","0.03","109.22","0.03","91.72","0.03","2120.2","1.1","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","[6,6'-Bis(1,1-dimethylethyl)-4,4'-dimethyl-2,2'-methylenediphenolato-κ^2^<i>O</i>,<i>O</i>']dichlorido(9<i>H</i>-fluoren-9-ol-κ<i>O</i>)titanium(IV)‒fluorene‒diethyl ether (1/0.5/1)","","- C46.5 H55 Cl2 O4 Ti -","- C46.5 H55 Cl2 O4 Ti -","- C93 H110 Cl4 O8 Ti2 -","2","1","BV2226","Nielson, Alastair J.; Shen, Chaohong; Waters, Joyce M.","[6,6'-Bis(1,1-dimethylethyl)-4,4'-dimethyl-2,2'-methylenediphenolato-κ^2^<i>O</i>,<i>O</i>']dichlorido(9<i>H</i>-fluoren-9-ol-κ<i>O</i>)titanium(IV)‒fluorene‒diethyl ether (1/0.5/1)","Acta Crystallographica Section E","2013","69","12","m673","m674","10.1107/S1600536813030249","","","0.71073","MoKα","","0.0521","0.0363","","","0.0782","0.0858","","","","","","1.074","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2238843","6.3368","0.0003","8.2642","0.0004","21.0277","0.0011","84.057","0.004","89.798","0.004","86.062","0.004","1092.68","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","4-(3-Fluoro-4-methylanilino)-2-methylidene-4-oxobutanoic acid","4-(3-Fluoro-4-methylanilino)-2-methylidene-4-oxobutanoic acid","","- C12 H12 F N O3 -","- C12 H12 F N O3 -","- C48 H48 F4 N4 O12 -","4","2","BV2227","Nayak, Prakash S.; Narayana, B.; Jasinski, Jerry P.; Yathirajan, H. S.; Kaur, Manpreet","4-(3-Fluoro-4-methylanilino)-2-methylidene-4-oxobutanoic acid","Acta Crystallographica Section E","2013","69","12","o1752","","10.1107/S160053681302998X","","","0.7107","MoKα","","0.1127","0.0808","","","0.197","0.2205","","","","","","1.059","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238844","6.1679","0.0012","11.094","0.002","20.502","0.004","90","","90","","90","","1402.9","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-[(Quinolin-8-yloxy)methyl]-1<i>H</i>-benzimidazole monohydrate","","- C17 H15 N3 O2 -","- C17 H15 N3 O2 -","- C68 H60 N12 O8 -","4","1","BX2452","Tang, Lin; Zhang, Yue; Wen, Yonghong","2-[(Quinolin-8-yloxy)methyl]-1<i>H</i>-benzimidazole monohydrate","Acta Crystallographica Section E","2013","69","12","o1838","","10.1107/S1600536813031322","","","0.71073","MoKα","","0.043","0.0391","","","0.0844","0.0866","","","","","","1.06","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238845","7.9844","0.001","14.1416","0.0017","18.553","0.002","90","","98.158","0.002","90","","2073.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-[(<i>tert</i>-Butyldiphenylsilyloxy)methyl]pyridazin-3(2<i>H</i>)-one","","- C21 H24 N2 O2 Si -","- C21 H24 N2 O2 Si -","- C84 H96 N8 O8 Si4 -","4","1","BX2453","Costas-Lago, María Carmen; Costas, Tamara; Vila, Noemí; Terán, Carmen","5-[(<i>tert</i>-Butyldiphenylsilyloxy)methyl]pyridazin-3(2<i>H</i>)-one","Acta Crystallographica Section E","2013","69","12","o1826","o1827","10.1107/S160053681303167X","","","0.71073","MoKα","","0.0958","0.0532","","","0.1358","0.1721","","","","","","1.006","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238846","11.697","0.0002","15.026","0.0003","29.777","0.0006","90","","99.864","0.002","90","","5156.21","0.17","180","2","180","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","Chlorido(η^6^-<i>N</i>^2^-diphenylphosphanyl-<i>N</i>^1^,<i>N</i>^1^-diisopropyl-4-methoxybenzamidine-κ<i>P</i>)(triphenylphosphane-κ<i>P</i>)ruthenium(II) trifluoromethansulfonate acetone disolvate","","- C51 H58 Cl F3 N2 O6 P2 Ru S -","- C51 H58 Cl F3 N2 O6 P2 Ru S -","- C204 H232 Cl4 F12 N8 O24 P8 Ru4 S4 -","4","1","CQ2007","Kéchaou-Perrot, Manel; Vendier, Laure; Igau, Alain","Chlorido(η^6^-<i>N</i>^2^-diphenylphosphanyl-<i>N</i>^1^,<i>N</i>^1^-diisopropyl-4-methoxybenzamidine-κ<i>P</i>)(triphenylphosphane-κ<i>P</i>)ruthenium(II) trifluoromethansulfonate acetone disolvate","Acta Crystallographica Section E","2013","69","12","m659","m660","10.1107/S1600536813029450","","","0.71073","MoKα","","0.0626","0.0428","","","0.0827","0.0892","","","","","","1.092","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238847","19.3078","0.0015","11.2651","0.0008","20.535","0.003","90","","90","","90","","4466.5","0.8","123","","123","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Di-<i>μ</i>~2~-acetato-1:2<i>κ</i>^2^<i>O</i>:<i>O</i>';2:3<i>κ</i>^2^<i>O</i>:<i>O</i>'-bis{<i>μ</i>~2~-4,4'-dichloro-2,2'-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}-1:2<i>κ</i>^6^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':<i>O</i>,<i>O</i>';2:3<i>κ</i>^6^<i>O</i>,<i>O</i>':<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'-tricadmium(II)","","- C42 H42 Cd3 Cl4 N4 O8 -","- C42 H42 Cd3 Cl4 N4 O8 -","- C168 H168 Cd12 Cl16 N16 O32 -","4","0.5","CQ2008","Kubono, Koji; Tani, Keita; Yokoi, Kunihiko; Shinmyozu, Teruo; Goto, Kenta","Di-<i>{μ</i>}~2~-acetato-1:2<i>{κ</i>}^2^<i>O</i>:<i>O</i>';2:3<i>{κ</i>}^2^<i>O</i>:<i>O</i>'-bis{<i>{μ</i>}~2~-4,4'-dichloro-2,2'-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}-1:2<i>{κ</i>}^6^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':<i>O</i>,<i>O</i>';2:3<i>{κ</i>}^6^<i>O</i>,<i>O</i>':<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'-tricadmium","Acta Crystallographica Section E","2013","69","12","m629","m630","10.1107/S1600536813029413","","","0.71075","MoKα","","","0.0186","","","","0.058","","","","","","1","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238848","8.8437","0.0001","16.7099","0.0002","11.7157","0.0002","90","","92.419","0.001","90","","1729.77","0.04","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylate","","- C21 H16 Br N O3 -","- C21 H16 Br N O3 -","- C84 H64 Br4 N4 O12 -","4","1","CV5433","Li, Chun; Campbell, Michael J.; Weaver, Matthew J.; Duncan, Nathan S.; Hunting, Janet L.; Natale, Nicholas R.","Ethyl 3-(10-bromoanthracen-9-yl)-5-methyl-1,2-oxazole-4-carboxylate","Acta Crystallographica Section E","2013","69","12","o1804","o1805","10.1107/S1600536813031395","","","0.71073","MoKα","","0.0257","0.0247","","","0.0736","0.0742","","","","","","1.045","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238849","14.693","0.002","13.531","0.002","16.347","0.002","90","","90","","90","","3250","0.8","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Ethyl 8-(2,4-dichlorophenyl)-6-methyl-1,2,4-triazolo[1,5-<i>a</i>]pyridine-7-carboxylate","","- C16 H13 Cl2 N3 O2 -","- C16 H13 Cl2 N3 O2 -","- C128 H104 Cl16 N24 O16 -","8","1","CV5435","Li, Yang; Sun, Chen; Zhang, Ran","Ethyl 8-(2,4-dichlorophenyl)-6-methyl-1,2,4-triazolo[1,5-<i>a</i>]pyridine-7-carboxylate","Acta Crystallographica Section E","2013","69","12","o1796","","10.1107/S160053681303033X","","","0.71073","MoKα","","0.0678","0.0545","","","0.1582","0.1704","","","","","","1.069","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238850","10.8728","0.0007","13.4403","0.001","9.0695","0.0006","90","","103.68","0.005","90","","1287.76","0.16","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","(C7H10NO)2.SnBr6.2H2O","Bis(2-methoxyanilinium) hexabromidostannate(IV) dihydrate","","- C14 H24 Br6 N2 O4 Sn -","- C14 H24 Br6 N2 O4 Sn -","- C28 H48 Br12 N4 O8 Sn2 -","2","0.5","CV5437","Chouaib, Hassen; Karoui, Sahel; Kamoun, Slaheddine; Michaud, Francois","Bis(2-methoxyanilinium) hexabromidostannate(IV) dihydrate","Acta Crystallographica Section E","2013","69","12","m678","m679","10.1107/S1600536813031681","","","0.71073","MoKα","","0.0695","0.0611","","","0.1484","0.1561","","","","","","1.069","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238851","8.1114","0.0005","11.8942","0.0007","12.397","0.0007","90","","106.402","0.001","90","","1147.37","0.12","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4,4'-Dinitrodiphenyl ether","1-Nitro-4-(4-nitrophenoxy)benzene","","- C12 H8 N2 O5 -","- C12 H8 N2 O5 -","- C48 H32 N8 O20 -","4","1","DS2235","Naz, Mehwish; Akhter, Zareen; McKee, Vickie; Nadeem, Arif","1-Nitro-4-(4-nitrophenoxy)benzene: a second monoclinic polymorph","Acta Crystallographica Section E","2013","69","12","o1747","","10.1107/S1600536813029346","","","0.71073","MoKα","","0.0485","0.0387","","","0.0964","0.1035","","","","","","1.062","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238852","15.8871","0.0001","15.8871","0.0001","15.93","0.0002","90","","90","","90","","4020.73","0.06","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","2,2,2-Trifluoro-<i>N</i>-(2-iodophenyl)acetamide","","- C8 H5 F3 I N O -","- C8 H5 F3 I N O -","- C128 H80 F48 I16 N16 O16 -","16","1","FF2122","Ruchun, Yang; Hui, Zhang; BanPeng, Cao","2,2,2-Trifluoro-<i>N</i>-(2-iodophenyl)acetamide","Acta Crystallographica Section E","2013","69","12","o1749","","10.1107/S1600536813029851","","","0.71073","MoKα","","0.0788","0.0437","","","0.0833","0.1046","","","","","","1.059","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238853","8.3356","0.001","8.841","0.001","13.696","0.002","74.103","0.007","83.263","0.006","83.56","0.007","960.6","0.2","100","0.5","100","0.5","","","","","","","","6","P -1","-P 1","2","","Hexa-μ-acetato-1:2κ^4^<i>O</i>,<i>O</i>';1:2κ^2^<i>O</i>:<i>O</i>;2:3κ^4^<i>O</i>,<i>O</i>';2:3κ^2^<i>O</i>:<i>O</i>-bis(4,4'-dimethyl-2,2'-bipyridine)-1κ^2^<i>N</i>,<i>N</i>';3κ^2^<i>N</i>,<i>N</i>'-2-calcium-1,3-dizinc","","- C36 H42 Ca N4 O12 Zn2 -","- C36 H42 Ca N4 O12 Zn2 -","- C36 H42 Ca N4 O12 Zn2 -","1","0.5","FJ2647","Pramanik, Avijit; Fronczek, Frank R.; Venkatraman, Ramaiyer; Hossain, Md. Alamgir","Hexa-μ-acetato-1:2κ^4^<i>O</i>,<i>O</i>';1:2κ^2^<i>O</i>:<i>O</i>;2:3κ^4^<i>O</i>,<i>O</i>';2:3κ^2^<i>O</i>:<i>O</i>-bis(4,4'-dimethyl-2,2'-bipyridine)-1κ^2^<i>N</i>,<i>N</i>';3κ^2^<i>N</i>,<i>N</i>'-2-calcium-1,3-dizinc","Acta Crystallographica Section E","2013","69","12","m643","m644","10.1107/S1600536813030122","","","0.71073","MoKα","","0.046","0.034","","","0.081","0.086","","","","","","1.049","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238854","4.8474","0.0002","15.2776","0.0006","20.5546","0.0006","90","","96.113","0.004","90","","1513.55","0.1","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[μ~2~-<i>N</i>^2^,<i>N</i>^2'^-Bis(3-methoxy-2-oxidobenzylidene)benzene-1,3-dicarbohydrazidato]bis[pyridinecopper(II)]","","- C34 H28 Cu2 N6 O6 -","- C34 H28 Cu2 N6 O6 -","- C68 H56 Cu4 N12 O12 -","2","0.5","FJ2648","Tong, Hai-Bin; Xiao, Zi-Jing","[μ~2~-<i>N</i>^2^,<i>N</i>^2'^-Bis(3-methoxy-2-oxidobenzylidene)benzene-1,3-dicarbohydrazidato]bis[pyridinecopper(II)]","Acta Crystallographica Section E","2013","69","12","m658","","10.1107/S1600536813030286","","","1.54178","CuKα","","0.0579","0.0453","","","0.1222","0.1332","","","","","","1.059","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238855","24.427","0.003","30.875","0.004","10.0956","0.0013","90","","90","","90","","7613.9","1.7","173","2","173","2","","","","","","","","6","F d d 2","F 2 -2d","43","","{2,2'-[Ethane-1,2-diylbis(nitrilomethanylylidene)]diphenolato}(isopropanolato)aluminium dichloromethane hemisolvate","","- C19.5 H22 Al Cl N2 O3 -","- C19.5 H22 Al Cl N2 O3 -","- C312 H352 Al16 Cl16 N32 O48 -","16","1","FK2075","Zaitsev, Kirill V.; Kuchuk, Ekaterina A.; Karlov, Sergey S.; Zaitseva, Galina S.; Churakov, Andrei V.","{2,2'-[Ethane-1,2-diylbis(nitrilomethanylylidene)]diphenolato}(isopropanolato)aluminium dichloromethane hemisolvate","Acta Crystallographica Section E","2013","69","12","m631","m632","10.1107/S1600536813029644","","","0.71073","MoKα","","0.0397","0.0337","","","0.078","0.0812","","","","","","1.043","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238856","4.5886","0.0005","8.5213","0.0011","13.9621","0.0015","75.898","0.013","87.669","0.013","77.58","0.014","517.05","0.11","200","2","200","2","","","","","","","","5","P -1","-P 1","2","4-Hydroxy-3-methoxybenzaldehyde thiosemicarbazone","4-Hydroxy-3-methoxybenzaldehyde thiosemicarbazone","","- C9 H11 N3 O2 S -","- C9 H11 N3 O2 S -","- C18 H22 N6 O4 S2 -","2","1","FY2108","de Oliveira, Adriano Bof; Feitosa, Bárbara Regina Santos; Näther, Christian; Jess, Inke","4-Hydroxy-3-methoxybenzaldehyde thiosemicarbazone","Acta Crystallographica Section E","2013","69","12","o1861","","10.1107/S1600536813032303","","","0.71073","MoKα","","0.0447","0.0359","","","0.0957","0.1","","","","","","1.026","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238857","10.1163","0.0005","10.2176","0.0004","13.8162","0.0006","72.074","0.004","70.108","0.004","63.889","0.005","1184.53","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[2-(1-Hydroxycyclohexyl)-2-(4-methoxyphenyl)ethyl]dimethylazanium benzenesulfonate monohydrate","","- C23 H35 N O6 S -","- C23 H35 N O6 S -","- C46 H70 N2 O12 S2 -","2","1","GG2130","Corvalan, Carolina H.; Vega, Daniel R.","Venlafaxine besylate monohydrate","Acta Crystallographica Section E","2013","69","12","o1737","o1738","10.1107/S1600536813027542","","","0.71073","MoKα","","0.0962","0.0534","","","0.1511","0.1631","","","","","","1.015","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2238858","6.893","0.004","8.257","0.006","13.33","0.01","72.78","0.03","87.44","0.03","69.42","0.03","676.9","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethylenediammonium tetrachloridozincate","","- C6 H18 Cl4 N2 Zn -","- C6 H18 Cl4 N2 Zn -","- C12 H36 Cl8 N4 Zn2 -","2","1","GK2591","Akhtar, Muhammad; Fettouhi, Mohammed; Ahmed, Maqsood; Khan, Islam Ullah; Ahmad, Saeed","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethylenediammonium tetrachloridozincate","Acta Crystallographica Section E","2013","69","12","m642","","10.1107/S1600536813029802","","","0.71073","MoKα","","0.0551","0.0309","","","0.0675","0.0749","","","","","","1.048","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2238859","8.171","0.0008","10.0684","0.0009","10.6066","0.001","98.331","0.003","94.22","0.003","95.367","0.003","856.23","0.14","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-[1-(3-methylbutyl)-4-phenyl-1<i>H</i>-1,2,3-triazol-5-yl]-2-oxoacetate","","- C17 H21 N3 O3 -","- C17 H21 N3 O3 -","- C34 H42 N6 O6 -","2","1","GK2593","Ahmed, Muhammad Naeem; Yasin, Khawaja Ansar; Tahir, M. Nawaz; Hafeez, Muhammad; Aziz, Shahid","Ethyl 2-[1-(3-methylbutyl)-4-phenyl-1<i>H</i>-1,2,3-triazol-5-yl]-2-oxoacetate","Acta Crystallographica Section E","2013","69","12","o1768","","10.1107/S1600536813030420","","","0.71073","MoKα","","0.0613","0.0468","","","0.1415","0.1558","","","","","","1.055","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238860","3.91001","0.00015","11.3347","0.0004","17.8432","0.0006","90","","93.4","0.003","90","","789.4","0.05","100","1","100","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5-Dimethoxybenzonitrile","","- C9 H9 N O2 -","- C9 H9 N O2 -","- C36 H36 N4 O8 -","4","1","GK2594","Bugenhagen, Bernhard; Al Jasem, Yosef; Thiemann, Thies","2,5-Dimethoxybenzonitrile","Acta Crystallographica Section E","2013","69","12","o1808","","10.1107/S1600536813031309","","","0.7107","MoKα","","0.0596","0.0439","","","0.1028","0.116","","","","","","1.058","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238861","4.9248","0.0002","5.5117","0.0002","16.3894","0.0007","83.721","0.002","89.038","0.002","86.765","0.002","441.48","0.03","115","","115","","","","","","","","","6","P 1","P 1","1","","(-)-(<i>S</i>)-<i>N</i>-Benzyl-2-[(<i>R</i>)-6-fluorochroman-2-yl]-2-hydroxyethanaminium bromide","","- C18 H21 Br F N O2 -","- C18 H21 Br F N O2 -","- C18 H21 Br F N O2 -","1","1","GW2140","Rousselin, Yoann; Laureano, Hugo; Clavel, Alexandre","A triclinic polymorph of ({-})-(<i>S</i>)-<i>N</i>-benzyl-2-[(<i>R</i>)-6-fluorochroman-2-yl]-2-hydroxyethanaminium bromide","Acta Crystallographica Section E","2013","69","12","o1794","o1795","10.1107/S1600536813030377","","","0.71073","MoKα~1~","","0.021","0.0209","","","0.0522","0.0523","","","","","","1.114","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238862","12.822","0.0003","8.2709","0.0002","14.6165","0.0004","90","","112.841","0.001","90","","1428.52","0.06","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(4-Acetylphenyl)-4-methoxybenzenesulfonamide","","- C15 H15 N O4 S -","- C15 H15 N O4 S -","- C60 H60 N4 O16 S4 -","4","1","HB7153","Kobkeatthawin, Thawanrat; Chantrapromma, Suchada; Chidan Kumar, C. S.; Fun, Hoong-Kun","<i>N</i>-(4-Acetylphenyl)-4-methoxybenzenesulfonamide","Acta Crystallographica Section E","2013","69","12","o1750","o1751","10.1107/S1600536813029875","","","0.71073","MoKα","","0.0855","0.0466","","","0.114","0.1347","","","","","","1.036","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238863","9.6625","0.0003","10.8994","0.0002","15.8154","0.0004","90","","90","","90","","1665.61","0.07","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(3a<i>R</i>,8b<i>R</i>)-3a,8b-Dihydroxy-2-methylsulfanyl-3-nitro-1-phenyl-1,8b-dihydroindeno [1,2-<i>b</i>]pyrrol-4(3a<i>H</i>)-one","","- C18 H14 N2 O5 S -","- C18 H14 N2 O5 S -","- C72 H56 N8 O20 S4 -","4","1","HB7154","Nagalakshmi, R. A.; Suresh, J.; Jeyachandran, V.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","(3a<i>R</i>,8b<i>R</i>)-3a,8b-Dihydroxy-2-methylsulfanyl-3-nitro-1-phenyl-1,8b-dihydroindeno[1,2-<i>b</i>]pyrrol-4(3a<i>H</i>)-one","Acta Crystallographica Section E","2013","69","12","o1770","o1771","10.1107/S1600536813029577","","","0.71073","MoKα","","0.0366","0.0324","","","0.088","0.0916","","","","","","1.002","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238864","12.9105","0.0009","6.1738","0.0004","16.9255","0.0011","90","","90.341","0.007","90","","1349.05","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(5'-Fluoro-2'-methoxybiphenyl-3-yl)-1,3,4-oxadiazol-2-amine","","- C15 H12 F N3 O2 -","- C15 H12 F N3 O2 -","- C60 H48 F4 N12 O8 -","4","1","HB7155","Usha, M. K.; Ramaprasad, G. C.; Kalluraya, Balakrishna; Kant, Rajni; Gupta, Vivek K.; Revannasiddaiah, D.","5-(5'-Fluoro-2'-methoxybiphenyl-3-yl)-1,3,4-oxadiazol-2-amine","Acta Crystallographica Section E","2013","69","12","o1788","","10.1107/S1600536813031206","","","0.71073","MoKα","","0.1157","0.0535","","","0.1046","0.1346","","","","","","1.006","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238865","8.754","0.0007","13.6648","0.001","15.3465","0.0011","97.206","0.001","91.186","0.002","99.924","0.001","1792.3","0.2","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","Bis{4-[(<i>E</i>)-2-(1<i>H</i>-indol-3-yl)ethenyl]-1-methylpyridinium} 4-chlorobenzenesulfonate nitrate","","- C38 H34 Cl N5 O6 S -","- C38 H34 Cl N5 O6 S -","- C76 H68 Cl2 N10 O12 S2 -","2","1","HB7156","Fun, Hoong-Kun; Quah, Ching Kheng; Boonnak, Nawong; Chantrapromma, Suchada","Bis{4-[(<i>E</i>)-2-(1<i>H</i>-indol-3-yl)ethenyl]-1-methylpyridinium} 4-chlorobenzenesulfonate nitrate","Acta Crystallographica Section E","2013","69","12","o1753","o1754","10.1107/S1600536813030080","","","0.71073","MoKα","","0.0937","0.0743","","","0.2312","0.2541","","","","","","1.048","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238866","10.836","0.001","7.5409","0.0007","16.349","0.003","90","","93.52","0.01","90","","1333.4","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Imidazolium <i>trans</i>-diaquadioxalatochromate(III) dihydrate","","- C7 H13 Cr N2 O12 -","- C7 H13 Cr N2 O12 -","- C28 H52 Cr4 N8 O48 -","4","0.5","HB7157","Chérif, Ichraf; Abdelhak, Jawher; Zid, Mohamed Faouzi; Driss, Ahmed","Imidazolium <i>trans</i>-diaquadioxalatochromate(III) dihydrate","Acta Crystallographica Section E","2013","69","12","m667","m668","10.1107/S160053681303078X","","","0.71073","MoKα","","0.0311","0.0294","","","0.0845","0.0857","","","","","","1.116","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238867","10.5618","0.0002","11.2123","0.0002","11.3084","0.0002","89.974","0.001","77.619","0.001","70.842","0.001","1232.03","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","3-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","","- C26 H37 N5 S -","- C26 H37 N5 S -","- C52 H74 N10 S2 -","2","1","HB7161","Al-Abdullah, Ebtehal S.; Al-Tuwaijri, Hanaa M.; El-Emam, Ali A.; Chidan Kumar, C. S.; Fun, Hoong-Kun","3-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2013","69","12","o1813","o1814","10.1107/S1600536813031127","","","1.54178","CuKα","","0.0429","0.0403","","","0.1147","0.1167","","","","","","1.076","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238868","7.176","0.0003","8.6895","0.0004","12.1555","0.0006","92.645","0.002","92.115","0.002","103.781","0.002","734.47","0.06","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2-[(<i>E</i>)-2-(4-Methoxyphenyl)ethenyl]-1-methylpyridinium iodide","","- C15 H16 I N O -","- C15 H16 I N O -","- C30 H32 I2 N2 O2 -","2","1","HB7162","Senthil, K.; Kalainathan, S.; RubanKumar, A.; Ramkumar, V.; Podder, Jiban","2-[(<i>E</i>)-2-(4-Methoxyphenyl)ethenyl]-1-methylpyridinium iodide","Acta Crystallographica Section E","2013","69","12","o1848","","10.1107/S1600536813031929","","","0.71073","MoKα","","0.0217","0.0204","","","0.0512","0.0523","","","","","","1.089","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238869","19.1707","0.0005","6.4106","0.0002","14.2838","0.0003","90","","103.366","0.002","90","","1707.87","0.08","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(Adamantan-1-yl)-1,2,3,4-tetrahydroisoquinoline-2-carbothioamide","","- C20 H26 N2 S -","- C20 H26 N2 S -","- C80 H104 N8 S4 -","4","1","HB7163","El-Emam, Ali A.; Al-Abdullah, Ebtehal S.; Al-Tuwaijri, Hanaa M.; Chidan Kumar, C. S.; Fun, Hoong-Kun","<i>N</i>-(Adamantan-1-yl)-1,2,3,4-tetrahydroisoquinoline-2-carbothioamide","Acta Crystallographica Section E","2013","69","12","o1815","","10.1107/S1600536813031516","","","1.54178","CuKα","","0.0512","0.0412","","","0.1075","0.1143","","","","","","1.074","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238870","6.38693","0.00018","16.8893","0.0005","12.2649","0.0004","90","","103.527","0.003","90","","1286.32","0.07","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Chlorophenyl quinoline-2-carboxylate","","- C16 H10 Cl N O2 -","- C16 H10 Cl N O2 -","- C64 H40 Cl4 N4 O8 -","4","1","HB7166","Fazal, E.; Kaur, Manpreet; Sudha, B. S.; Nagarajan, S.; Jasinski, Jerry P.","4-Chlorophenyl quinoline-2-carboxylate","Acta Crystallographica Section E","2013","69","12","o1841","","10.1107/S1600536813032054","","","1.54184","CuKα","","0.0445","0.0385","","","0.0984","0.1035","","","","","","1.05","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238871","8.2595","0.0004","10.0175","0.0004","12.5257","0.0006","88.798","0.004","78.824","0.004","89.22","0.003","1016.45","0.08","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","3-[1-(4-Bromophenyl)ethoxy]-2,2,5-trimethyl-4-phenyl-3-azahexane","","- C22 H30 Br N O -","- C22 H30 Br N O -","- C44 H60 Br2 N2 O2 -","2","1","HG5350","Pitliya, Praveen; Butcher, Ray J.; Karim, A.; Hudrlik, Paul F.; Hudrlik, Anne M.; Raghavan, D.","3-[1-(4-Bromophenyl)ethoxy]-2,2,5-trimethyl-4-phenyl-3-azahexane","Acta Crystallographica Section E","2013","69","12","o1792","o1793","10.1107/S1600536813029966","","","0.71073","MoKα","","0.1355","0.0663","","","0.1006","0.1232","","","","","","1.083","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238872","10.1258","0.0007","10.4671","0.0008","17.8888","0.0012","100.833","0.006","92.527","0.005","116.812","0.007","1643.9","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)- 2-phenylacetamide","<i>N</i>-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)-2-phenylacetamide","","- C19 H19 N3 O2 -","- C19 H19 N3 O2 -","- C76 H76 N12 O8 -","4","2","HG5356","Kaur, Manpreet; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H. S.; Narayana, B.","<i>N</i>-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)-2-phenylacetamide","Acta Crystallographica Section E","2013","69","12","o1726","o1727","10.1107/S1600536813029590","","","1.54184","CuKα","","0.0526","0.0462","","","0.1234","0.1302","","","","","","1.036","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238873","8.5795","0.0006","9.8373","0.0007","13.6999","0.0008","70.03","0.006","76.779","0.005","79.362","0.006","1050.74","0.13","295","2","295","2","","","","","","","","8","P -1","-P 1","2","","(2-{[4-(Chloridomercuryl)phenyl]iminomethyl}pyridine-κ^2^<i>N</i>,<i>N</i>')diiodidomercury(II) dimethyl sulfoxide monosolvate","","- C14 H15 Cl Hg2 I2 N2 O S -","- C14 H15 Cl Hg2 I2 N2 O S -","- C28 H30 Cl2 Hg4 I4 N4 O2 S2 -","2","1","HG5358","Basu Baul, Tushar S.; Longkumer, Imliwati; Ng, Seik Weng; Tiekink, Edward R. T.","(2-{[4-(Chloridomercuryl)phenyl]iminomethyl}pyridine-κ^2^<i>N</i>,<i>N</i>')diiodidomercury(II) dimethyl sulfoxide monosolvate","Acta Crystallographica Section E","2013","69","12","m633","m634","10.1107/S1600536813029693","","","0.71073","MoKα","","0.0798","0.053","","","0.1234","0.1431","","","","","","1.034","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238874","4.7223","0.0005","13.9357","0.0017","23.028","0.003","90","","90","","90","","1515.4","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>N</i>'-[(<i>E</i>)-5-Bromo-2-hydroxy-3-methoxybenzylidene]benzohydrazide monohydrate","","- C15 H15 Br N2 O4 -","- C15 H15 Br N2 O4 -","- C60 H60 Br4 N8 O16 -","4","1","HG5359","Emmanuel, Jessy; Sithambaresan, M.; Kurup, M. R. Prathapachandra","<i>N</i>'-[(<i>E</i>)-5-Bromo-2-hydroxy-3-methoxybenzylidene]benzohydrazide monohydrate","Acta Crystallographica Section E","2013","69","12","o1775","o1776","10.1107/S1600536813030572","","","0.71073","MoKα","","0.0693","0.0444","","","0.1","0.114","","","","","","0.888","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238875","7.9617","0.0003","9.6379","0.0004","10.5783","0.0005","71.351","0.001","82.023","0.001","66.757","0.001","706.6","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-2-hydroxymethyl-2-methylpropane-1,3-diolato)bis[dichloridotitanium(IV)] diethyl ether disolvate","","- C18 H40 Cl4 O8 Ti2 -","- C18 H40 Cl4 O8 Ti2 -","- C18 H40 Cl4 O8 Ti2 -","1","0.5","HG5360","Nielson, Alastair J.; Shen, Chaohong; Waters, Joyce M.","Bis(μ-2-hydroxymethyl-2-methylpropane-1,3-diolato)bis[dichloridotitanium(IV)] diethyl ether disolvate","Acta Crystallographica Section E","2013","69","12","m676","m677","10.1107/S1600536813031504","","","0.71073","MoKα","","0.0249","0.0215","","","0.059","0.0606","","","","","","1.043","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238876","16.402","0.002","7.7699","0.001","16.403","0.002","90","","115.466","0.001","90","","1887.3","0.4","173","2","173.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(5-hydroxyisophthalato-κ<i>O</i>^1^)bis[4-(pyridine-3-carboxamido-κ<i>N</i>^3^)pyridinium]copper(II) tetrahydrate","","- C38 H36 Cu N6 O16 -","- C38 H36 Cu N6 O16 -","- C76 H72 Cu2 N12 O32 -","2","0.5","HG5361","O'Donovan, Megan E.; LaDuca, Robert L.","Bis(5-hydroxyisophthalato-κ<i>O</i>^1^)bis[4-(pyridine-3-carboxamido-κ<i>N</i>^3^)pyridinium]copper(II) tetrahydrate","Acta Crystallographica Section E","2013","69","12","m663","","10.1107/S1600536813030675","","","0.71073","MoKα","","0.0315","0.0272","","","0.0728","0.0759","","","","","","1.069","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238877","9.969","0.0006","12.8677","0.0006","5.8409","0.0003","90","","106.491","0.006","90","","718.44","0.07","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methylaspartic acid monohydrate","","- C5 H11 N O5 -","- C5 H11 N O5 -","- C20 H44 N4 O20 -","4","1","HG5362","Brewer, Greg; Burton, Aaron S.; Dworkin, Jason P.; Butcher, Ray J.","2-Methylaspartic acid monohydrate","Acta Crystallographica Section E","2013","69","12","o1856","o1857","10.1107/S1600536813032170","","","1.54178","CuKα","","0.093","0.0897","","","0.2704","0.2787","","","","","","1.202","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238878","7.9642","0.0016","12.53","0.003","8.709","0.0017","90","","113.66","0.03","90","","796","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[di-μ~9~-citrato-tetrasodiumzinc]","","- C12 H10 Na4 O14 Zn -","- C12 H10 Na4 O14 Zn -","- C24 H20 Na8 O28 Zn2 -","2","0.5","HY2639","Ma, Yu-Hong; Yang, Hong-Wei; Hao, Jing-Tuan; Ma, Pi-Zhuang; Yao, Ting","Poly[di-μ~9~-citrato-tetrasodiumzinc]","Acta Crystallographica Section E","2013","69","12","m672","","10.1107/S1600536813030067","","","0.71073","MoKα","","0.049","0.0367","","","0.0712","0.0745","","","","","","1.149","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238879","12.8246","0.0003","11.9115","0.0003","8.5375","0.0002","90","","99.735","0.001","90","","1285.41","0.05","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(6-Bromobenzo[<i>d</i>]thiazol-2-yl)-5,5-dimethylthiazol-4(5<i>H</i>)-one","","- C12 H9 Br N2 O S2 -","- C12 H9 Br N2 O S2 -","- C48 H36 Br4 N8 O4 S8 -","4","1","IM2444","Würfel, Hendryk; Görls, Helmar; Weiss, Dieter; Beckert, Rainer","2-(6-Bromobenzo[<i>d</i>]thiazol-2-yl)-5,5-dimethylthiazol-4(5<i>H</i>)-one","Acta Crystallographica Section E","2013","69","12","o1821","","10.1107/S1600536813031334","","","0.71073","MoKα","","0.0295","0.0251","","","0.0615","0.0645","","","","","","1.018","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238880","8.82","0.0004","10.4769","0.0005","19.7407","0.001","80.211","0.001","78.984","0.001","69.784","0.001","1669.51","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-(1-Allyl-1<i>H</i>-indazol-5-yl)-4-methylbenzenesulfonamide","","- C17 H17 N3 O2 S -","- C17 H17 N3 O2 S -","- C68 H68 N12 O8 S4 -","4","2","IM2445","Chicha, Hakima; Rakib, El Mostapha; Abderrafia, Hafid; Saadi, Mohamed; El Ammari, Lahcen","<i>N</i>-(1-Allyl-1<i>H</i>-indazol-5-yl)-4-methylbenzenesulfonamide","Acta Crystallographica Section E","2013","69","12","o1847","","10.1107/S1600536813032091","","","0.71073","MoKα","","0.0553","0.042","","","0.1102","0.1204","","","","","","1.024","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238881","12.5204","0.001","10.4962","0.0007","12.983","0.001","90","","98.892","0.002","90","","1685.7","0.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(<i>Z</i>)-3-(1-chloroprop-1-enyl)-2-methyl-1-phenylsulfonyl-1<i>H</i>-indole","","- C18 H16 Cl N O2 S -","- C18 H16 Cl N O2 S -","- C72 H64 Cl4 N4 O8 S4 -","4","1","IS5320","Umadevi, M.; Saravanan, V.; Yamuna, R.; Mohanakrishnan, A. K.; Chakkaravarthi, G.","(<i>Z</i>)-3-(1-Chloroprop-1-enyl)-2-methyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2013","69","12","o1781","","10.1107/S1600536813030730","","","0.71073","MoKα","","0.0646","0.0415","","","0.1026","0.1182","","","","","","1.03","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238882","19.5","0.009","5.291","0.002","6.0809","0.0015","90","","94.27","0.03","90","","625.7","0.4","292","","292","","","","","","","","","3","P 1 21 1","P 2yb","4","","(-)-Benzyl 2,3-dideoxy-β-<i>D</i>-<i>erythro</i>-hex-2-enopyranoside","","- C13 H16 O4 -","- C13 H16 O4 -","- C26 H32 O8 -","2","1","IS5321","Ohba, Shigeru; Okazaki, Hayato; Ueda, Yuji; Hanaya, Kengo; Shoji, Mitsuru; Sugai, Takeshi","({-})-Benzyl 2,3-dideoxy-β-<small>D</small>-<i>erythro</i>-hex-2-enopyranoside","Acta Crystallographica Section E","2013","69","12","o1811","","10.1107/S1600536813031140","","","0.71069","MoKα","","","0.0563","","","","0.2547","","","","","","1.044","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238883","10.2772","0.0007","8.661","0.0006","18.898","0.0014","90","","90.676","0.002","90","","1682","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(2-Bromomethyl-1-phenylsulfonyl-1<i>H</i>-indol-3-yl)propan-1-one","","- C18 H16 Br N O3 S -","- C18 H16 Br N O3 S -","- C72 H64 Br4 N4 O12 S4 -","4","1","IS5323","Umadevi, M.; Saravanan, V.; Yamuna, R.; Mohanakrishnan, A. K.; Chakkaravarthi, G.","1-(2-Bromomethyl-1-phenylsulfonyl-1<i>H</i>-indol-3-yl)propan-1-one","Acta Crystallographica Section E","2013","69","12","o1802","o1803","10.1107/S1600536813031413","","","0.71073","MoKα","","0.1289","0.0519","","","0.11","0.1329","","","","","","1","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238884","6.1598","0.0005","7.7223","0.0006","11.4952","0.0007","80.683","0.006","83.494","0.006","74.614","0.007","518.83","0.07","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","2-(Phenylselenonyl)pyridine","","- C11 H9 N O2 Se -","- C11 H9 N O2 Se -","- C22 H18 N2 O4 Se2 -","2","1","JJ2170","Gulati, Shivani; Bhasin, K. K.; Potapov, V. A.; Arora, Ekta; Butcher, Ray J.","2-(Phenylselenonyl)pyridine","Acta Crystallographica Section E","2013","69","12","o1791","","10.1107/S1600536813029978","","","0.71073","MoKα","","0.0696","0.0469","","","0.0798","0.0901","","","","","","1.013","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238885","5.9089","0.0005","10.4444","0.001","11.9274","0.0011","90","","90","","90","","736.1","0.12","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Isovaline monohydrate","2-Azaniumyl-2-methylbutanoate monohydrate","","- C5 H13 N O3 -","- C5 H13 N O3 -","- C20 H52 N4 O12 -","4","1","JJ2178","Butcher, Ray J.; Brewer, Greg; Burton, Aaron S.; Dworkin, Jason P.","Isovaline monohydrate","Acta Crystallographica Section E","2013","69","12","o1829","o1830","10.1107/S1600536813031620","","","1.54184","CuKα","","0.064","0.0564","","","0.1565","0.1624","","","","","","1.109","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238886","16.9052","0.0002","16.798","0.0002","14.3805","0.0002","90","","97.272","0.001","90","","4050.83","0.09","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[aqualithium(I)]-μ-3-carboxy-5,6-dimethylpyrazine-2-carboxylato-κ^4^<i>O</i>^2^,<i>N</i>^1^:<i>O</i>^3^,<i>N</i>^4^]","","- C8 H9 Li N2 O5 -","- C8 H9 Li N2 O5 -","- C128 H144 Li16 N32 O80 -","16","2","KP2460","Starosta, Wojciech; Leciejewicz, Janusz","<i>catena</i>-Poly[[aqualithium(I)]-μ-3-carboxy-5,6-dimethylpyrazine-2-carboxylato-κ^4^<i>O</i>^2^,<i>N</i>^1^:<i>O</i>^3^,<i>N</i>^4^]","Acta Crystallographica Section E","2013","69","12","m655","m656","10.1107/S1600536813030493","","","1.54178","CuKα","","0.0518","0.0402","","","0.1051","0.1103","","","","","","0.972","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238887","16.2367","0.0007","7.1047","0.0002","11.4018","0.0003","90","","90","","90","","1315.28","0.08","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","4-Formyl-2-nitrophenyl 2-chlorobenzoate","","- C14 H8 Cl N O5 -","- C14 H8 Cl N O5 -","- C56 H32 Cl4 N4 O20 -","4","1","LH5661","Moreno-Fuquen, Rodolfo; Hernandez, Geraldine; Ellena, Javier; De Simone, Carlos A.; Tenorio, Juan C.","4-Formyl-2-nitrophenyl 2-chlorobenzoate","Acta Crystallographica Section E","2013","69","12","o1806","","10.1107/S1600536813031346","","","0.71073","MoKα","","0.0722","0.0439","","","0.1043","0.1197","","","","","","1.031","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238888","11.6611","0.0005","13.1823","0.0005","13.2251","0.0005","77.25","0.003","87.32","0.003","67.342","0.004","1828.15","0.14","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 6-(4-chlorophenyl)-4-(4-fluorophenyl)-2-oxocyclohex-3-ene-1-carboxylate","","- C21 H18 Cl F O3 -","- C21 H18 Cl F O3 -","- C84 H72 Cl4 F4 O12 -","4","2","LH5662","Sapnakumari, M.; Narayana, B.; Yathirajan, H.S.; Jasinski, Jerry P.; Butcher, Ray J.","Ethyl 6-(4-chlorophenyl)-4-(4-fluorophenyl)-2-oxocyclohex-3-ene-1-carboxylate","Acta Crystallographica Section E","2013","69","12","o1839","o1840","10.1107/S1600536813031851","","","1.54178","CuKα","","0.0584","0.0554","","","0.1456","0.1483","","","","","","1.093","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238889","7.1135","0.0008","19.4512","0.0011","30.8","0.002","90","","90","","90","","4261.7","0.6","223.15","","223.15","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,9-Dimethyl-1,10-phenanthrolin-1-ium 2,4,5-tricarboxybenzoate monohydrate","","- C24 H20 N2 O9 -","- C24 H20 N2 O9 -","- C192 H160 N16 O72 -","8","1","LH5664","Zhong, Kai-Long","2,9-Dimethyl-1,10-phenanthrolin-1-ium 2,4,5-tricarboxybenzoate monohydrate","Acta Crystallographica Section E","2013","69","12","o1782","o1783","10.1107/S1600536813030857","","","0.71073","MoKα","","0.1489","0.0881","","","0.2192","0.2719","","","","","","1.001","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238890","8.3978","0.0003","11.2689","0.0004","15.921","0.0006","90","","90","","90","","1506.67","0.09","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-<i>N</i>-Benzyl-2,6-dideoxy-2,6-imino-3,4-<i>O</i>-isopropylidene-<i>D</i>-allononitrile","","- C16 H20 N2 O3 -","- C16 H20 N2 O3 -","- C64 H80 N8 O12 -","4","1","LH5665","Ayers, Benjamin J.; Jenkinson, Sarah F.; Fleet, George W. J.; Thompson, Amber L.","2-<i>N</i>-Benzyl-2,6-dideoxy-2,6-imino-3,4-<i>O</i>-isopropylidene-<small>D</small>-allononitrile","Acta Crystallographica Section E","2013","69","12","o1772","","10.1107/S1600536813030584","","","0.71073","MoKα","","0.0731","0.0436","","0.1207","0.0948","0.1207","","","","","","0.9532","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238891","6.07","0.0003","7.1073","0.0004","24.2183","0.0013","90","","94.035","0.005","90","","1042.22","0.1","200","1","200","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","caesium 4-nitrobenzoate dihydrate","Poly[μ~3~-aqua-aqua-μ~5~-(4-nitrobenzoato)-caesium]","","- C7 H8 Cs N O6 -","- C7 H8 Cs N O6 -","- C28 H32 Cs4 N4 O24 -","4","1","LH5666","Smith, Graham","Poly[μ~3~-aqua-aqua-μ~5~-(4-nitrobenzoato)-caesium]","Acta Crystallographica Section E","2013","69","12","m664","m665","10.1107/S1600536813030638","","","0.71073","MoKα","","0.0385","0.0321","","","0.0711","0.0739","","","","","","1.149","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238892","7.371","0.003","13.741","0.003","15.065","0.004","115.269","0.004","95.327","0.003","101.323","0.004","1325.9","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,9-dimethyl-1,10-phenanthroline)copper(I) pentacyanidonitrosoferrate(II)","","- C61 H48 Cu2 Fe N14 O -","- C61 H48 Cu2 Fe N14 O -","- C61 H48 Cu2 Fe N14 O -","1","0.5","LH5667","Rusanova, Julia A.; Kozachuk, Olesia V.; Semenaka, Valentyna V.; Dyakonenko, Viktoriya V.","Bis(2,9-dimethyl-1,10-phenanthroline)copper(I) pentacyanidonitrosoferrate(II)","Acta Crystallographica Section E","2013","69","12","m684","m685","10.1107/S1600536813031760","","","0.71073","MoKα","","0.0945","0.05","","","0.0995","0.1085","","","","","","0.931","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238893","7.2509","0.0011","15.67","0.002","14.529","0.002","90","","99.579","0.003","90","","1627.8","0.4","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-1-(2-Hydroxy-6-methoxyphenyl)-3-(2,4,6-trimethoxyphenyl)prop-2-en-1-one","","- C19 H20 O6 -","- C19 H20 O6 -","- C76 H80 O24 -","4","1","LH5668","Koh, Dongsoo","(<i>E</i>)-1-(2-Hydroxy-6-methoxyphenyl)-3-(2,4,6-trimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2013","69","12","o1809","","10.1107/S1600536813031498","","","0.71073","MoKα","","0.1382","0.0493","","","0.1039","0.1463","","","","","","0.833","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238894","8.7927","0.0008","17.417","0.0015","12.5014","0.0012","90","","98.69","0.009","90","","1892.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{4-Chloro-<i>N</i>'-[(2-oxidonaphthalen-1-yl-κ<i>O</i>)methylidene]benzohydrazidato-κ^2^<i>N</i>',<i>O</i>}dimethyltin(IV)","","- C20 H17 Cl N2 O2 Sn -","- C20 H17 Cl N2 O2 Sn -","- C80 H68 Cl4 N8 O8 Sn4 -","4","1","LH5669","Cui, Jichun; Qiao, Yanling; Wang, Fei","{4-Chloro-<i>N</i>'-[(2-oxidonaphthalen-1-yl-κ<i>O</i>)methylidene]benzohydrazidato-κ^2^<i>N</i>',<i>O</i>}dimethyltin(IV)","Acta Crystallographica Section E","2013","69","12","m688","","10.1107/S1600536813031826","","","0.71073","MoKα","","0.0577","0.0397","","","0.0929","0.1074","","","","","","1.06","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238895","14.4259","0.0014","6.6145","0.0006","21.722","0.002","90","","94.166","0.003","90","","2067.2","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1-Benzoyl-4-thiobiuret","{[(Phenylformamido)carbonyl]amino}methanethioamide","","- C9 H9 N3 O2 S -","- C9 H9 N3 O2 S -","- C72 H72 N24 O16 S8 -","8","1","LR2116","Kim, Namhun; Kim, Haneol; Kang, Sung Kwon","A monoclinic polymorph of 1-benzoyl-4-thiobiuret","Acta Crystallographica Section E","2013","69","12","o1760","","10.1107/S1600536813030250","","","0.71073","MoKα","","0.0834","0.0467","","","","0.1151","","","","","","1.027","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238896","10.774","0.004","7.988","0.003","24.681","0.01","90","","100.207","0.007","90","","2090.5","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-[(<i>tert</i>-Butyldiphenylsilyloxy)methyl]pyridazin-3(2<i>H</i>)-one","","- C21 H24 N2 O2 Si -","- C21 H24 N2 O2 Si -","- C84 H96 N8 O8 Si4 -","4","1","LR2118","Costas-Lago, María Carmen; Costas, Tamara; Vila, Noemí; Besada, Pedro","4-[(<i>tert</i>-Butyldiphenylsilyloxy)methyl]pyridazin-3(2<i>H</i>)-one","Acta Crystallographica Section E","2013","69","12","o1859","o1860","10.1107/S1600536813032212","","","0.71073","MoKα","","0.0918","0.0464","","","0.1171","0.1484","","","","","","1.003","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238897","18.086","0.0004","19.1755","0.0004","19.4619","0.0004","90","","90","","90","","6749.5","0.2","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","<i>catena</i>-Poly[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylendiammonium [[tetrabromidoantimonate(III)]-μ-bromido] hemihydrate]","","- C12 H38 Br10 N4 O Sb2 -","- C12 H38 Br10 N4 O Sb2 -","- C96 H304 Br80 N32 O8 Sb16 -","8","1","NC2318","Kharrat, Houda; Kamoun, Slaheddine; Michaud, François","<i>catena</i>-Poly[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylendiammonium [[tetrabromidoantimonate(III)]-μ-bromido] hemihydrate]","Acta Crystallographica Section E","2013","69","12","m637","m638","10.1107/S1600536813028894","","","0.71073","MoKα","","0.1261","0.0473","","","0.0748","0.089","","","","","","1.014","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238898","7.371","0.0011","9.0675","0.0011","14.704","0.002","90","","105.041","0.011","90","","949.1","0.2","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethane-1,2-diaminium 2,2'-[terephthaloylbis(azanediyl)]diacetate tetrahydrate","","- C14 H28 N4 O10 -","- C14 H28 N4 O10 -","- C28 H56 N8 O20 -","2","0.5","NC2319","Pook, Niels-Patrick; Gjikaj, Mimoza; Adam, Arnold","Ethane-1,2-diaminium 2,2'-[terephthaloylbis(azanediyl)]diacetate tetrahydrate","Acta Crystallographica Section E","2013","69","12","o1731","","10.1107/S1600536813029632","","","0.71073","MoKα","","0.0442","0.0384","","","0.0934","0.0963","","","","","","1.091","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238899","12.529","0.0004","13.0264","0.0004","14.5681","0.0005","90","","111.674","0.003","90","","2209.53","0.13","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diethyl [4-(2,2':6',2''-terpyridine-4'-yl)phenyl]phosphonate","","- C25 H24 N3 O3 P -","- C25 H24 N3 O3 P -","- C100 H96 N12 O12 P4 -","4","1","NC2320","Chyba, Jan; Necas, Marek; Pinkas, Jiri","Diethyl [4-(2,2':6',2''-terpyridine-4'-yl)phenyl]phosphonate","Acta Crystallographica Section E","2013","69","12","o1824","","10.1107/S1600536813031541","","","0.71073","MoKα","","0.0492","0.0298","","","0.0716","0.0747","","","","","","1.015","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238900","8.724","0.003","15.141","0.006","17.844","0.007","93.89","0.03","99.19","0.03","103.26","0.03","2251.3","1.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-(4-Methoxyphenyl)-6-methyl-2-phenyl-5-{[4-(trifluoromethyl)anilino]methyl}pyrimidin-4-amine","","- C26 H23 F3 N4 O -","- C26 H23 F3 N4 O -","- C104 H92 F12 N16 O4 -","4","2","NC2321","Cieplik, Jerzy; Pluta, Janusz; Bryndal, Iwona; Lis, Tadeusz","<i>N</i>-(4-Methoxyphenyl)-6-methyl-2-phenyl-5-{[4-(trifluoromethyl)anilino]methyl}pyrimidin-4-amine","Acta Crystallographica Section E","2013","69","12","o1831","o1832","10.1107/S160053681303170X","","","0.71073","MoKα","","0.0799","0.0538","","","0.1123","0.1247","","","","","","1.034","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238901","12.7884","0.0006","8.0546","0.0006","21.4116","0.001","90","","94.069","0.004","90","","2200","0.2","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl <i>N</i>-(3-cyano-1<i>H</i>-indol-2-yl)formimidate","","- C12 H11 N3 O -","- C12 H11 N3 O -","- C96 H88 N24 O8 -","8","1","NG5344","Ruchun, Yang; Hui, Zhang; BanPeng, Cao","Ethyl <i>N</i>-(3-cyano-1<i>H</i>-indol-2-yl)formimidate","Acta Crystallographica Section E","2013","69","12","o1745","","10.1107/S1600536813029589","","","0.71073","MoKα","","0.0526","0.0402","","","0.1027","0.1104","","","","","","1.122","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238902","13.1252","0.0019","17.281","0.003","6.4777","0.0009","90","","90","","90","","1469.2","0.4","103","2","103","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","<i>catena</i>-Poly[[tetra-μ-formato-κ^8^<i>O</i>:<i>O</i>'-dicopper(II)]-μ-hexamethylenetetramine-κ^2^<i>N</i>^1^:<i>N</i>^5^]","","- C10 H16 Cu2 N4 O8 -","- C10 H16 Cu2 N4 O8 -","- C40 H64 Cu8 N16 O32 -","4","0.5","NG5345","Cao, Jianfang; Huang, Ziping; Cao, Changnian; Cheng, Chunchun; Sun, Chunyan","<i>catena</i>-Poly[[tetra-μ-formato-κ^8^<i>O</i>:<i>O</i>'-dicopper(II)]-μ-hexamethylenetetramine-κ^2^<i>N</i>^1^:<i>N</i>^5^]","Acta Crystallographica Section E","2013","69","12","m690","","10.1107/S160053681303184X","","","0.71073","MoKα","","0.0333","0.0282","","","","0.0766","","","1.042","","","1.042","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238903","12.4748","0.0017","5.363","0.0006","17.021","0.002","90","","90.699","0.005","90","","1138.7","0.2","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,2-Bis(4-benzyloxy-2-hydroxybenzylidene)hydrazine","5,5'-Bis(benzyloxy)-2,2'-[hydrazinediylidenebis(methanylylidene)]diphenol","","- C28 H24 N2 O4 -","- C28 H24 N2 O4 -","- C56 H48 N4 O8 -","2","0.5","NG5346","Sajitha, N. R.; Sithambaresan, M.; Kurup, M. R. Prathapachandra","5,5'-Bis(benzyloxy)-2,2'-[hydrazinediylidenebis(methanylylidene)]diphenol","Acta Crystallographica Section E","2013","69","12","o1755","","10.1107/S1600536813030171","","","0.71073","MoKα","","0.0856","0.0435","","","0.1004","0.122","","","","","","1.008","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238904","11.1933","0.0004","7.7564","0.0003","13.7728","0.0005","90","","121.741","0.002","90","","1016.91","0.07","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-amino-4,5-dimethoxybenzoate","","- C10 H13 N O4 -","- C10 H13 N O4 -","- C40 H52 N4 O16 -","4","1","NG5347","Hill, Tania N.; Patel, Naadiya","Methyl 2-amino-4,5-dimethoxybenzoate","Acta Crystallographica Section E","2013","69","12","o1779","","10.1107/S1600536813030894","","","0.71073","MoKα","","","0.038","","","","0.1089","","","","","","1.051","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238905","10.8504","0.0003","22.2977","0.0008","20.3988","0.0008","90","","90","","90","","4935.3","0.3","293","2","293","2","","","","","","","","5","I b a 2","I 2 -2c","45","","Di-<i>n</i>-butyl[4-hydroxy-<i>N</i>'-(3-methoxy-2-oxidobenzylidene-κ<i>O</i>^2^)benzohydrazidato-κ^2^<i>N</i>,<i>O</i>]tin(IV)","","- C23 H30 N2 O4 Sn -","- C23 H30 N2 O4 Sn -","- C184 H240 N16 O32 Sn8 -","8","1","NG5348","Qiao, Yanling; Wang, Fei","Di-<i>n</i>-butyl[4-hydroxy-<i>N</i>'-(3-methoxy-2-oxidobenzylidene-κ<i>O</i>^2^)benzohydrazidato-κ^2^<i>N</i>,<i>O</i>]tin(IV)","Acta Crystallographica Section E","2013","69","12","m675","","10.1107/S1600536813031401","","","0.71073","MoKα","","0.0624","0.0387","","","0.0662","0.0755","","","","","","1.011","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238906","11.7109","0.0013","13.0181","0.0014","13.398","0.0014","72.337","0.005","66.78","0.005","82.742","0.006","1788.6","0.3","298","","298","","","","","","","","","5","P -1","-P 1","2","","(3-Methylbenzonitrile-κ<i>N</i>)tetrakis(μ-<i>N</i>-phenylacetamidato)-κ^4^<i>N</i>:<i>O</i>;κ^4^<i>O</i>:<i>N</i>-dirhodium(II)(<i>Rh</i>—<i>Rh</i>)","","- C40 H39 N5 O4 Rh2 -","- C40 H39 N5 O4 Rh2 -","- C80 H78 N10 O8 Rh4 -","2","1","PK2497","Eagle, Cassandra T.; Atem-Tambe, Nkongho; Kpogo, Kenneth K.; Tan, Jennie; Quarshie, Fredricka","(3-Methylbenzonitrile-κ<i>N</i>)tetrakis(μ-<i>N</i>-phenylacetamidato)-κ^4^<i>N</i>:<i>O</i>;κ^4^<i>O</i>:<i>N</i>-dirhodium(II)(<i>Rh</i>—<i>Rh</i>)","Acta Crystallographica Section E","2013","69","12","m639","","10.1107/S1600536813029838","","","0.71075","MoKα","","0.0861","0.0493","","","0.0903","0.1016","","","","","","1.042","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238907","5.007","0.001","11.642","0.002","12.739","0.003","63.66","0.03","82.69","0.03","82.75","0.03","658","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>-(2-Oxoazepan-3-yl)cyclohexanecarboxamide","","- C13 H22 N2 O2 -","- C13 H22 N2 O2 -","- C26 H44 N4 O4 -","2","1","PK2501","Chunjuan, Shi; Zhao, Yang","<i>N</i>-(2-Oxo-2,3,4,5,6,7-hexahydro-1<i>H</i>-azepin-3-yl)cyclohexanecarboxamide","Acta Crystallographica Section E","2013","69","12","o1837","","10.1107/S1600536813031863","","","0.71073","MoKα","","0.0953","0.0624","","","0.1576","0.1774","","","","","","1.008","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238908","9.3691","0.0004","17.7016","0.0008","14.2208","0.0007","90","","92.779","0.003","90","","2355.72","0.19","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(μ~3~-Hydrido)[μ~3~-2-(trimethylsilyl)ethylidyne-\ κ^3^<i>C</i>^1^:<i>C</i>^1^:<i>C</i>^1^]tetrakis[(η^5^-\ cyclopentadienyl)cobalt(II)]","","- C25 H32 Co4 Si -","- C25 H32 Co4 Si -","- C100 H128 Co16 Si4 -","4","1","PK2502","Haehnel, Martin; Spannenberg, Anke; Rosenthal, Uwe","(μ~3~-Hydrido)[μ~3~-2-(trimethylsilyl)ethylidyne-κ^3^<i>C</i>^1^:<i>C</i>^1^:<i>C</i>^1^]tetrakis[(η^5^-cyclopentadienyl)cobalt(II)]","Acta Crystallographica Section E","2013","69","12","m651","","10.1107/S1600536813030432","","","0.71073","MoKα","","0.0464","0.0284","","","0.0518","0.0576","","","","","","1.027","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238909","23.128","0.005","6.332","0.002","15.03","0.003","90","","103.22","0.02","90","","2142.8","0.9","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","phloroglucinol tribenzoate","Benzene-1,3,5-triyl tribenzoate","","- C27 H18 O6 -","- C27 H18 O6 -","- C108 H72 O24 -","4","1","PK2503","Corfield, Peter W. R.; Balija, Amy M.","Benzene-1,3,5-triyl tribenzoate","Acta Crystallographica Section E","2013","69","12","o1822","o1823","10.1107/S1600536813031462","","","0.7107","MoKα","","0.1164","0.0401","","","0.0913","0.1137","","","","","","1.026","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238910","21.0855","0.0003","14.0236","0.0002","10.0626","0.0001","90","","115.474","0.001","90","","2686.18","0.06","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","<i>N</i>-Benzyl-2-hydroxyethanaminium cyanurate","","- C12 H16 N4 O4 -","- C12 H16 N4 O4 -","- C96 H128 N32 O32 -","8","1","QK2061","Contreras-Espejel, Carlos Abraham; García-Eleno, Marco A.; Santacruz-Juárez, Ericka; Reyes-Martínez, Reyna; Morales-Morales, David","<i>N</i>-Benzyl-2-hydroxyethanaminium cyanurate","Acta Crystallographica Section E","2013","69","12","o1741","o1742","10.1107/S1600536813029383","","","0.71073","MoKα","","0.0658","0.0402","","","0.0953","0.1145","","","","","","1.023","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238911","10.237","0.003","10.356","0.003","10.936","0.003","117.075","0.004","93.113","0.004","110.463","0.004","935","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-oxido-bis({2,2'-[ethane-1,2-diylbis(nitrilomethanylylidene)]diphenolato}titanium(IV)) chloroform disolvate","","- C34 H34 Cl6 N4 O6 Ti2 -","- C34 H34 Cl6 N4 O6 Ti2 -","- C34 H34 Cl6 N4 O6 Ti2 -","1","0.5","QK2062","Zaitsev, Kirill V.; Karlov, Sergey S.; Piskun, Yulia A.; Vasilenko, Irina V.; Churakov, Andrei V.","Di-μ-oxido-bis({2,2'-[ethane-1,2-diylbis(nitrilomethanylylidene)]diphenolato}titanium(IV)) chloroform disolvate","Acta Crystallographica Section E","2013","69","12","m635","m636","10.1107/S1600536813029656","","","0.71073","MoKα","","0.0617","0.0405","","","0.0852","0.092","","","","","","1.03","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238912","6.19172","0.00017","15.4196","0.0004","14.6585","0.0004","90","","90.761","0.003","90","","1399.38","0.07","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Dimethylphenyl quinoline-2-carboxylate","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C72 H60 N4 O8 -","4","1","QM2101","Fazal, E.; Kaur, Manpreet; Sudha, B. S.; Nagarajan, S.; Jasinski, Jerry P.","3,4-Dimethylphenyl quinoline-2-carboxylate","Acta Crystallographica Section E","2013","69","12","o1853","o1854","10.1107/S1600536813032157","","","1.54184","CuKα","","0.0467","0.0419","","","0.1154","0.1205","","","","","","1.051","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238913","14.8695","0.0012","7.735","0.0006","15.2791","0.0013","90","","107.196","0.008","90","","1678.8","0.2","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-Amino-6-(piperidin-1-yl)-4-<i>p</i>-tolylpyridine-3,5-dicarbonitrile","","- C19 H19 N5 -","- C19 H19 N5 -","- C76 H76 N20 -","4","1","RK2416","Inglebert, S. Antony; Kamalraja, Jayabal; Sethusankar, K.; Vasuki, Gnanasambandam","2-Amino-6-(piperidin-1-yl)-4-<i>p</i>-tolylpyridine-3,5-dicarbonitrile","Acta Crystallographica Section E","2013","69","12","o1807","","10.1107/S1600536813030845","","","0.71073","MoKα","","0.1573","0.0597","","","0.1284","0.1478","","","","","","0.768","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238914","10.3322","0.001","11.2231","0.0011","12.4813","0.0012","111.021","0.002","105.355","0.002","100.763","0.002","1237.3","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Bis{μ~4~-<i>N</i>-[phenyl(pyridin-2-ylazanidyl)methyl]pyridin-2-aminido}tetrakis(tetrahydrofuran)tetralithium","","- C50 H60 Li4 N8 O4 -","- C50 H60 Li4 N8 O4 -","- C50 H60 Li4 N8 O4 -","1","0.5","RK2418","Chen, Juan","Bis{μ~4~-<i>N</i>-[phenyl(pyridin-2-ylazanidyl)methyl]pyridin-2-aminido}tetrakis(tetrahydrofuran)tetralithium","Acta Crystallographica Section E","2013","69","12","m683","","10.1107/S1600536813031838","","","0.71073","MoKα","","0.1281","0.0725","","","0.2108","0.2434","","","","","","0.925","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238915","13.831","0.003","15.28","0.003","14.363","0.003","90","","110.55","0.03","90","","2842.3","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[[(μ~2~-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis{μ~2~-<i>N</i>-[2-(2-hydroxybenzoyl)carbamothioyl]acetamidato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>S</i>}bis(nitrato-κ^2^<i>O</i>,<i>O</i>')dicadmium] dimethylformamide tetrasolvate]","","- C42 H56 Cd2 N14 O16 S2 -","- C42 H56 Cd2 N14 O16 S2 -","- C84 H112 Cd4 N28 O32 S4 -","2","0.5","RZ5087","You, Ming-Hua; Li, Fo-Jun; Yang, Xiao-Ping; Lin, Xu-Xiang; Ye, Hua-Yan","Poly[[(μ~2~-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis{μ~2~-<i>N</i>-[2-(2-hydroxybenzoyl)carbamothioyl]acetamidato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>S</i>}bis(nitrato-κ^2^<i>O</i>,<i>O</i>')dicadmium] dimethylformamide tetrasolvate]","Acta Crystallographica Section E","2013","69","12","m647","m648","10.1107/S1600536813030055","","","0.71073","MoKα","","0.0637","0.0599","","","0.1388","0.141","","","","","","1.276","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238916","17.837","0.002","9.163","0.004","10.552","0.003","90","","90","","90","","1724.6","0.9","298","","298","","","","","","","","","7","P m m a","-P 2a 2a","51","","Bis(4-aminopyridinium) μ~6~-oxido-dodeca-μ~2~-oxido-hexaoxido[rhenium(VII)tetratungsten(VI)vanadium(V)]ate heptahydrate","","- C10 H28 N4 O26 Re V W4 -","- C10 H28 N4 O26 Re V W4 -","- C20 H56 N8 O52 Re2 V2 W8 -","2","0.25","RZ5088","Maaloui, Ahlem; Toumi, Samah Akriche; Rzaigui, Mohamed","Bis(4-aminopyridinium) μ~6~-oxido-dodeca-μ~2~-oxido-hexaoxido[rhenium(VII)tetratungsten(VI)vanadium(V)]ate heptahydrate","Acta Crystallographica Section E","2013","69","12","m661","m662","10.1107/S1600536813030687","","","0.56087","AgKα","","0.1631","0.0691","","","0.1544","0.1924","","","","","","1.025","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238917","7.6891","0.0001","10.8642","0.0001","11.9867","0.0001","93.349","0.001","108.509","0.001","109.387","0.001","880.541","0.019","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Bis(3-azaniumylpropyl)azanium hexachloridobismuthate(III) monohydrate","","- C6 H22 Bi Cl6 N3 O -","- C6 H22 Bi Cl6 N3 O -","- C12 H44 Bi2 Cl12 N6 O2 -","2","1","RZ5091","Elfaleh, Nizar; Chouaib, Hassen; Kamoun, Slaheddine","Bis(3-azaniumylpropyl)azanium hexachloridobismuthate(III) monohydrate","Acta Crystallographica Section E","2013","69","12","m666","","10.1107/S1600536813030900","","","0.71073","MoKα","","0.0338","0.0212","","","0.0511","0.0567","","","","","","0.92","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238918","13.401","0.003","7.4825","0.0019","15.068","0.004","90","","98.986","0.004","90","","1492.4","0.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 6-methyl-8-phenyl-1,2,4-triazolo[1,5-<i>a</i>]pyridine-7-carboxylate","","- C16 H15 N3 O2 -","- C16 H15 N3 O2 -","- C64 H60 N12 O8 -","4","1","RZ5092","Li, Yang; Sun, Chen; Zhang, Ran","Ethyl 6-methyl-8-phenyl-1,2,4-triazolo[1,5-<i>a</i>]pyridine-7-carboxylate","Acta Crystallographica Section E","2013","69","12","o1812","","10.1107/S1600536813031152","","","0.71073","MoKα","","0.0656","0.0489","","","0.1341","0.1517","","","","","","1.049","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238919","15.007","0.002","10.3322","0.0008","16.019","0.002","90","","117.399","0.013","90","","2205.2","0.5","130","2","130","2","","","","","","","","4","P 1 21 1","P 2yb","4","(<i>S</i>)-(+)-<i>cis</i>-4'-Benzyloxypraziquantel","(<i>S</i>)-(+)-2-[<i>cis</i>-4-(Benzyloxy)cyclohexanecarbonyl]-1,2,3,6,7,11b-hexahydro-4<i>H</i>-pyrazino[2,1-<i>a</i>]isoquinolin-4-one","","- C26 H30 N2 O3 -","- C26 H30 N2 O3 -","- C104 H120 N8 O12 -","4","2","RZ5093","Cedillo-Cruz, Alberto; Aguilar, María Isabel; Jung-Cook, Helgi","(<i>S</i>)-(+)-<i>cis</i>-4'-Benzyloxypraziquantel","Acta Crystallographica Section E","2013","69","12","o1835","o1836","10.1107/S1600536813031735","","","1.54184","CuKα","","0.0913","0.0521","","","0.1103","0.1373","","","","","","1.029","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238920","12.7882","0.0007","13.7906","0.0006","16.0636","0.0007","90","","90","","90","","2832.9","0.2","291","2","291.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>S</i>)-4,5-Diphenyl-1-[1-phenyl-3-(phenylsulfanyl)propan-2-yl]-2-(thiophen-2-yl)-1<i>H</i>-imidazole","","- C34 H28 N2 S2 -","- C34 H28 N2 S2 -","- C136 H112 N8 S8 -","4","1","RZ5094","Gao, Jie; Wang, Hongyan; Yang, Liangru; Xiao, Yongmei; Mao, Pu","(<i>S</i>)-4,5-Diphenyl-1-[1-phenyl-3-(phenylsulfanyl)propan-2-yl]-2-(thiophen-2-yl)-1<i>H</i>-imidazole","Acta Crystallographica Section E","2013","69","12","o1858","","10.1107/S1600536813032066","","","1.5418","CuKα","","0.0514","0.0448","","","0.1197","0.1267","","","","","","1.027","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238921","20.266","0.004","4.6925","0.0001","15.7807","0.0011","90","","108.941","0.018","90","","1419.5","0.3","123","0.18","123","0.18","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Octylindoline-2,3-dione","","- C16 H21 N O2 -","- C16 H21 N O2 -","- C64 H84 N4 O8 -","4","1","RZ5095","Qachchachi, Fatima-Zahrae; Kandri Rodi, Youssef; Essassi, El Mokhtar; Kunz, Werner; El Ammari, Lahcen","1-Octylindoline-2,3-dione","Acta Crystallographica Section E","2013","69","12","o1801","","10.1107/S1600536813031383","","","1.5418","CuKα","","0.064","0.0568","","","0.1607","0.1673","","","","","","1.18","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238922","9.8073","0.0002","8.2784","0.0001","10.7741","0.0002","90","","95.015","0.001","90","","871.39","0.03","90","0.2","90","0.2","","","","","","","","4","P 1 21 1","P 2yb","4","13-(Imidazol-1-yl)-11,13-dihydromelampomagnolide B monohydrate","(1a<i>R</i>,7a<i>S</i>,8<i>R</i>,10a<i>S</i>,10b<i>S</i>,<i>E</i>)-5-Hydroxymethyl-8-[(1<i>H</i>-imidazol-1-yl)methyl]-1a-methyl-2,3,6,7,7a,8,10a,10b-octahydrooxireno[2',3':9,10]cyclodeca[1,2-b]furan-9(1a<i>H</i>)-one monohydrate","","- C18 H26 N2 O5 -","- C18 H26 N2 O5 -","- C36 H52 N4 O10 -","2","1","SJ5362","Janganati, Venumadhav; Penthala, Narsimha Reddy; Parkin, Sean; Crooks, Peter A.","13-(Imidazol-1-yl)-11,13-dihydromelampomagnolide B monohydrate","Acta Crystallographica Section E","2013","69","12","o1734","o1735","10.1107/S1600536813029188","","","1.54178","CuKα","","0.0238","0.0237","","","0.061","0.0612","","","","","","1.043","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238923","8.386","0.0006","11.861","0.0009","12.1102","0.0009","110.481","0.007","108.093","0.007","92.329","0.006","1057.43","0.16","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Raltegravir monohydrate","<i>N</i>-(4-fluorobenzyl)-5-hydroxy-1-methyl-2-{1-methyl-1-[(5-methyl-1,3,4-oxadiazol-2-ylcarbonyl)amino]ethyl}-6-oxo-1,6-dihydropyrimidine-4-carboxamide monohydrate","","- C20 H23 F N6 O6 -","- C20 H23 F N6 O6 -","- C40 H46 F2 N12 O12 -","2","1","SJ5363","Yamuna, Thammarse S.; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H. S.; Kaur, Manpreet","Raltegravir monohydrate","Acta Crystallographica Section E","2013","69","12","o1743","o1744","10.1107/S1600536813029747","","","0.71073","MoKα","","0.0932","0.0674","","","0.1824","0.206","","","","","","1.028","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238924","9.1329","0.0002","10.5227","0.0002","16.7194","0.0003","90","","90","","90","","1606.78","0.05","90","0.2","90","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","13-(<i>N</i>,<i>N</i>-Dimethylamino)micheliolide 0.08-hydrate","(3<i>R</i>,3a<i>S</i>,9<i>R</i>,9a<i>S</i>,9b<i>S</i>)-3-[(Dimethylamino)methyl]-9-hydroxy-6,9-dimethyl-3,3a,4,5,7,8,9,9a-octahydroazuleno[4,5-<i>b</i>]furan-2(9b<i>H</i>)-one 0.08-hydrate","","- C17 H27.16 N O3.08 -","- C17 H27.156 N O3.078 -","- C68 H108.624 N4 O12.312 -","4","1","SJ5365","Bommagani, Shobanbabu; Penthala, Narsimha Reddy; Janganati, Venumadhav; Parkin, Sean; Crooks, Peter A.","13-(<i>N</i>,<i>N</i>-Dimethylamino)micheliolide 0.08-hydrate","Acta Crystallographica Section E","2013","69","12","o1789","o1790","10.1107/S1600536813030304","","","1.54178","CuKα","","0.0254","0.0252","","","0.0665","0.0666","","","","","","1.071","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238925","9.4373","0.0014","17.992","0.003","19.966","0.003","90","","103.276","0.003","90","","3299.5","0.9","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrachlorido[<i>N</i>^2^,<i>N</i>^2'^-(dimethylsilanediyl)bis(<i>N</i>-<i>tert</i>-butyl-3-methylbenzimidamide)-κ^2^<i>N</i>^2^,<i>N</i>^2'^]hafnium(IV)","","- C26 H40 Cl4 Hf N4 Si -","- C26 H40 Cl4 Hf N4 Si -","- C104 H160 Cl16 Hf4 N16 Si4 -","4","0.5","SJ5366","Wang, Tao; Zhao, Jian-Ping; Bai, Sheng-Di","Tetrachlorido[<i>N</i>^2^,<i>N</i>^2'^-(dimethylsilanediyl)bis(<i>N</i>-<i>tert</i>-butyl-3-methylbenzimidamidato)-κ^2^<i>N</i>^2^,<i>N</i>^2'^]hafnium(IV)","Acta Crystallographica Section E","2013","69","12","m654","","10.1107/S1600536813030328","","","0.71073","MoKα","","0.0384","0.0283","","","0.057","0.0606","","","","","","1.02","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238926","10.9448","0.0012","18.96","0.002","7.4738","0.0008","90","","94.743","0.002","90","","1545.6","0.3","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-(4-Aminophenyl)-2-methoxy-4-phenylnicotinonitrile","","- C19 H15 N3 O -","- C19 H15 N3 O -","- C76 H60 N12 O4 -","4","1","SJ5368","Suwunwong, Thitipone; Chantrapromma, Suchada; Quah, Ching Kheng; Fun, Hoong-Kun","6-(4-Aminophenyl)-2-methoxy-4-phenylnicotinonitrile","Acta Crystallographica Section E","2013","69","12","o1816","o1817","10.1107/S1600536813031437","","","0.71073","MoKα","","0.0676","0.0457","","","0.1274","0.1425","","","","","","1.066","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238927","9.8201","0.0013","10.3315","0.0014","12.4914","0.0017","99.898","0.002","111.134","0.002","107.042","0.002","1074","0.3","100","","100","","","","","","","","","6","P -1","-P 1","2","","2-[(<i>E</i>)-2-(4-Hydroxy-3-methoxyphenyl)ethenyl]-1-methylpyridinium 4-bromobenzenesulfonate monohydrate","","- C21 H22 Br N O6 S -","- C21 H22 Br N O6 S -","- C42 H44 Br2 N2 O12 S2 -","2","1","SJ5370","Chantrapromma, Suchada; Boonnak, Nawong; Jindawong, Boonwasana; Fun, Hoong-Kun","2-[(<i>E</i>)-2-(4-Hydroxy-3-methoxyphenyl)ethenyl]-1-methylpyridinium 4-bromobenzenesulfonate monohydrate","Acta Crystallographica Section E","2013","69","12","o1851","o1852","10.1107/S1600536813031917","","","0.71073","MoKα","","0.055","0.0435","","","0.105","0.1127","","","","","","1.05","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238928","16.177","0.0004","20.984","0.0005","16.673","0.0004","90","","96.654","0.002","90","","5621.7","0.2","100","2","100","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","Bis(2,2'-bipyridine)[1,9-bis(diphenylphosphanyl)-1,2,3,4,6,7,8,9-octahydropyrimido[1,2-<i>a</i>]pyrimidin-5-ium]ruthenium(II) hexafluoridophosphate dibromide dichloromethane disolvate monohydrate","","- C53 H54 Br2 Cl4 F6 N7 O P3 Ru -","- C53 H54 Br2 Cl4 F6 N7 O P3 Ru -","- C212 H216 Br8 Cl16 F24 N28 O4 P12 Ru4 -","4","1","SU2644","Shang, Congcong; Vendier, Laure; Sutra, Pierre; Igau, Alain","Bis(2,2'-bipyridine)[1,9-bis(diphenylphosphanyl)-1,2,3,4,6,7,8,9-octahydropyrimido[1,2-<i>a</i>]pyrimidin-5-ium]ruthenium(II) hexafluoridophosphate dibromide dichloromethane disolvate monohydrate","Acta Crystallographica Section E","2013","69","12","m640","m641","10.1107/S1600536813029462","","","0.71073","MoKα","","0.0876","0.0546","","","0.1152","0.1309","","","","","","1.041","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238929","11.4484","0.0019","9.0914","0.0015","13.23","0.002","90","","90","","90","","1377","0.4","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Bromo-3-hydroxy-6-methylpyridine","","- C6 H6 Br N O -","- C6 H6 Br N O -","- C48 H48 Br8 N8 O8 -","8","1","SU2659","Singh, Govind Pratap; Rajesh Goud, N.; Jeevan Kumar, P.; Sundaresan, C. N.; Nageswara Rao, G.","2-Bromo-3-hydroxy-6-methylpyridine","Acta Crystallographica Section E","2013","69","12","o1729","","10.1107/S1600536813029498","","","0.71073","MoKα","","0.0328","0.0245","","","0.0611","0.0659","","","","","","1.063","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238930","15.7317","0.0007","7.2634","0.0012","28.8121","0.0003","90","","90","","90","","3292.2","0.6","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","5-Acetyl-4-(3-hydroxyphenyl)-6-methyl-1,2,3,4-tetrahydropyrimidin-2-one‒tris(hydroxymethyl)ammonium chloride (2/1)","","- C29 H38 Cl N5 O9 -","- C29 H38 Cl N5 O9 -","- C116 H152 Cl4 N20 O36 -","4","1","SU2662","Huq, C. A. M. A.; Fouzia, S.; NizamMohideen, M.","5-Acetyl-4-(3-hydroxyphenyl)-6-methyl-1,2,3,4-tetrahydropyrimidin-2-one‒tris(hydroxymethyl)ammonium chloride (2/1)","Acta Crystallographica Section E","2013","69","12","o1766","o1767","10.1107/S1600536813030559","","","0.71073","MoKα","","0.0636","0.0467","","","0.1399","0.1573","","","","","","0.883","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238931","9.6841","0.0002","9.703","0.0002","10.8456","0.0003","67.516","0.001","74.957","0.001","86.249","0.001","908.72","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-2-[2-(4-Carboxyphenyl)ethenyl]-8-hydroxyquinolin-1-ium chloride ethanol monosolvate","","- C20 H20 Cl N O4 -","- C20 H20 Cl N O4 -","- C40 H40 Cl2 N2 O8 -","2","1","SU2663","Schulze, Mathias M.; Seichter, Wilhelm; Weber, Edwin","(<i>E</i>)-2-[2-(4-Carboxyphenyl)ethenyl]-8-hydroxyquinolin-1-ium chloride ethanol monosolvate","Acta Crystallographica Section E","2013","69","12","o1773","o1774","10.1107/S1600536813030274","","","0.71073","MoKα","","0.0638","0.0478","","","0.1384","0.1469","","","","","","1.104","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238932","7.473","0.002","11.977","0.004","9.661","0.003","90","","91.01","0.02","90","","864.6","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Methyl <i>N</i>-(3-cyanopicolinoyl)-<i>L</i>-tryptophanate","","- C19 H16 N4 O3 -","- C19 H16 N4 O3 -","- C38 H32 N8 O6 -","2","1","SU2666","Ovdiichuk, Olga; Hordiyenko, Olga; Voitenko, Zoia; Arrault, Axelle; Medviediev, Volodymyr","Methyl <i>N</i>-(3-cyanopicolinoyl)-<small>L</small>-tryptophanate","Acta Crystallographica Section E","2013","69","12","o1810","","10.1107/S160053681303153X","","","0.7107","MoKα","","0.108","0.0505","","","0.1068","0.1328","","","","","","0.925","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238933","9.2035","0.0002","13.4629","0.0002","22.9607","0.0005","90","","90","","90","","2844.96","0.1","100","","100","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1<i>S</i>,5<i>S</i>,7<i>R</i>)-3-Benzoyl-4-hydroxy-8,8-dimethyl-1,5,7-tris(3-methylbut-2-enyl)bicyclo[3.3.1]nona-3-ene-2,9-dione","","- C33 H42 O4 -","- C33 H42 O4 -","- C132 H168 O16 -","4","1","TK5270","Vaneesa Nagalingam, Sree; Wong Pik Ching, Janet; Khaled bin Break, Mohammed; Tahir, M. Ibrahim M.; Khoo, Teng-Jin","A <i>P</i>2~1~2~1~2~1~ polymorph of (+)-clusianone","Acta Crystallographica Section E","2013","69","12","o1799","o1800","10.1107/S1600536813031036","","","1.5418","CuKα","","0.0352","0.0335","","0.0838","0.0824","0.0838","","","","","","0.9567","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238934","8.4658","0.0003","8.6643","0.0003","16.1126","0.0006","84.196","0.002","87.768","0.003","79.541","0.002","1156.01","0.07","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","(<i>E</i>)-1-[2-(4-Chloro-2-nitrostyryl)-1-phenylsulfonyl-1<i>H</i>-indol-3-yl]propan-1-one","","- C25 H19 Cl N2 O5 S -","- C25 H19 Cl N2 O5 S -","- C50 H38 Cl2 N4 O10 S2 -","2","1","TK5271","Umadevi, M.; Saravanan, V.; Yamuna, R.; Mohanakrishnan, A. K.; Chakkaravarthi, G.","(<i>E</i>)-1-[2-(4-Chloro-2-nitrostyryl)-1-phenylsulfonyl-1<i>H</i>-indol-3-yl]propan-1-one","Acta Crystallographica Section E","2013","69","12","o1784","","10.1107/S1600536813031073","","","0.71073","MoKα","","0.0728","0.0499","","","0.1327","0.1496","","","","","","1.03","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238935","10.8409","0.0005","10.0152","0.0007","13.9777","0.0007","90","","99.246","0.003","90","","1497.89","0.15","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,4,6-trinitrophenyl 4-bromobenzoate","2,4,6-Trinitrophenyl 4-bromobenzoate","","- C13 H6 Br N3 O8 -","- C13 H6 Br N3 O8 -","- C52 H24 Br4 N12 O32 -","4","1","TK5272","Moreno-Fuquen, Rodolfo","2,4,6-Trinitrophenyl 4-bromobenzoate","Acta Crystallographica Section E","2013","69","12","o1787","","10.1107/S1600536813031061","","","0.71073","MoKα","","0.0829","0.0461","","","0.1128","0.1339","","","","","","1.02","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238936","5.4371","0.0001","9.8496","0.0003","10.2564","0.0003","96.445","0.001","91.232","0.001","91.328","0.001","545.49","0.03","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Poly[[octaaqua-μ~4~-(benzene-1,2,4,5-tetracarboxylato)-dicobalt(II)] octahydrate]","","- C10 H34 Co2 O24 -","- C10 H18 Co2 O24 -","- C10 H18 Co2 O24 -","1","0.5","VN2077","Camara, Magatte; Tine, Modou; Daiguebonne, Carole; Guillou, Olivier; Roisnel, Thierry","Poly[[octaaqua-μ~4~-(benzene-1,2,4,5-tetracarboxylato)-dicobalt(II)] octahydrate]","Acta Crystallographica Section E","2013","69","12","m680","m681","10.1107/S1600536813031577","","","0.71073","MoKα","","0.0567","0.048","","","0.142","0.1529","","","","","","0.967","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238937","10.8704","0.0006","12.8983","0.001","8.3362","0.0005","90","","106.503","0.003","90","","1120.67","0.13","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","bis 1,3-phenylendiamine dithiocyanato-cadmiate(II)","Poly[bis(μ~2~-1,3-phenylenediamine-κ^2^<i>N</i>:<i>N</i>')di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>-cadmium]","","- C8 H8 Cd N4 S2 -","- C8 H8 Cd N4 S2 -","- C32 H32 Cd4 N16 S8 -","4","0.5","VN2078","Chemli, Rakia; Kamoun, Slaheddine; Roisnel, Thierry","Poly[bis(μ~2~-1,3-phenylenediamine-κ^2^<i>N</i>:<i>N</i>')di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>-cadmium]","Acta Crystallographica Section E","2013","69","12","m670","m671","10.1107/S1600536813031255","","","0.71073","MoKα","","0.039","0.0338","","","0.0625","0.0641","","","","","","1.026","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238938","7.1089","0.0001","7.1089","0.0001","25.616","0.0004","90","","90","","90","","1294.54","0.03","296","2","296","2","","","","","","","","3","P 43","P 4cw","78","Sr2As2O7","Strontium diarsenate","","- As2 O7 Sr2 -","- As2 O7 Sr2 -","- As16 O56 Sr16 -","8","2","WM2770","Mbarek, Aicha; Edhokkar, Fadhila","The <i>P</i>4~3~ enantiomorph of Sr~2~As~2~O~7~","Acta Crystallographica Section E","2013","69","12","i84","","10.1107/S1600536813031619","","","0.71073","MoKα","","0.0254","0.0218","","","0.0427","0.0437","","","","","","1.014","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238939","7.9488","0.0004","15.1248","0.0008","4.4661","0.0002","90","","90","","90","","536.93","0.05","100","2","100","2","","","","","","","","2","P b a m","-P 2 2ab","55","Lithium Silicide","Tridecalithium tetrasilicide","","- Li13 Si4 -","- Li13 Si4 -","- Li26 Si8 -","2","0.25","WM2778","Zeilinger, Michael; Fässler, Thomas F.","Revision of the Li~13~Si~4~ structure","Acta Crystallographica Section E","2013","69","12","i81","i82","10.1107/S1600536813029759","","","0.71073","MoKα","","0.0155","0.0148","","","0.0433","0.0437","","","","","","1.079","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238940","8.4854","0.0004","12.5107","0.0006","18.9003","0.001","89.024","0.002","87.75","0.002","72.206","0.003","1908.94","0.17","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","<i>N</i>^1^-(Thiophen-2-ylmethyl)-<i>N</i>^3^,<i>N</i>^3^-bis[3-(thiophen-2-ylmethylammonio)propyl]propane-1,3-diammonium hexafluoridosilicate methanol trisolvate","","- C27 H52 F12 N4 O3 S3 Si2 -","- C27 H52 F12 N4 O3 S3 Si2 -","- C54 H104 F24 N8 O6 S6 Si4 -","2","1","WM2779","Haque, Syed A.; Cooper, Dominique N.; Powell, Douglas R.; Venkatraman, Ramaiyer; Hossain, Md. Alamgir","<i>N</i>^1^-(Thiophen-2-ylmethyl)-<i>N</i>^3^,<i>N</i>^3^-bis[3-(thiophen-2-ylmethylammonio)propyl]propane-1,3-diammonium hexafluoridosilicate methanol trisolvate","Acta Crystallographica Section E","2013","69","12","o1739","o1740","10.1107/S1600536813029565","","","0.71073","MoKα","","0.0552","0.044","","","0.1166","0.1246","","","","","","1.002","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238941","17.0606","0.0012","4.9834","0.0003","13.9283","0.001","90","","98.127","0.006","90","","1172.29","0.14","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","caesium 2,3,6-trichlorophenylacetate monohydrate","Poly[μ-aqua-μ~5~-[2-(2,3,6-trichlorophenyl)acetato]-caesium]","","- C8 H6 Cl3 Cs O3 -","- C8 H6 Cl3 Cs O3 -","- C32 H24 Cl12 Cs4 O12 -","4","1","WM2781","Smith, Graham","Poly[μ-aqua-μ~5~-[2-(2,3,6-trichlorophenyl)acetato]-caesium]","Acta Crystallographica Section E","2013","69","12","m628","","10.1107/S1600536813029395","","","0.71073","MoKα","","0.0629","0.0495","","","0.1029","0.1113","","","","","","1.089","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238942","5.414","0.0006","18.172","0.002","12.9392","0.0015","90","","92.388","0.006","90","","1271.9","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","6-Chloro-<i>N</i>-(pyridin-4-ylmethyl)pyridine-3-sulfonamide","","- C11 H10 Cl N3 O2 S -","- C11 H10 Cl N3 O2 S -","- C44 H40 Cl4 N12 O8 S4 -","4","1","WM2782","Suchetan, Parameshwar Adimoole; Mohan, Revanasiddappa Nadigar; Vijithkumar; Palakshamurthy, Bandrehalli Siddagangaiah; Sreenivasa, Swamy","6-Chloro-<i>N</i>-(pyridin-4-ylmethyl)pyridine-3-sulfonamide","Acta Crystallographica Section E","2013","69","12","o1765","","10.1107/S1600536813030523","","","0.71073","MoKα","","0.0628","0.0442","","","0.1257","0.1373","","","","","","0.824","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238943","9.3031","0.0014","5.8892","0.0008","9.762","0.0012","90","","96.111","0.011","90","","531.8","0.13","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Hexaaquanickel(II) dihydrogen hypodiphosphate","","- H14 Ni O12 P2 -","- H14 Ni O12 P2 -","- H28 Ni2 O24 P4 -","2","0.5","WM2784","Gjikaj, Mimoza; Wu, Peng; Pook, Niels-Patrick","Hexaaquanickel(II) dihydrogen hypodiphosphate","Acta Crystallographica Section E","2013","69","12","i83","","10.1107/S1600536813030717","","","0.71073","MoKα","","0.0304","0.0291","","","0.0732","0.0742","","","","","","1.157","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238944","8.2261","0.0009","17.1054","0.0015","16.5895","0.0018","90","","95.52","0.009","90","","2323.5","0.4","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","μ-Hexathiometadiphosphato-bis[(1,4,7,10,13,16-hexaoxacyclooctadecane-κ^6^<i>O</i>)rubidium] acetonitrile disolvate","","- C28 H54 N2 O12 P2 Rb2 S6 -","- C28 H54 N2 O12 P2 Rb2 S6 -","- C56 H108 N4 O24 P4 Rb4 S12 -","2","0.5","WM2785","Gjikaj, Mimoza; Pook, Niels-Patrick; Qarri, Flora","μ-Hexathiometadiphosphato-bis[(1,4,7,10,13,16-hexaoxacyclooctadecane-κ^6^<i>O</i>)rubidium] acetonitrile disolvate","Acta Crystallographica Section E","2013","69","12","m689","","10.1107/S1600536813032121","","","0.71073","MoKα","","0.0693","0.0469","","","0.0696","0.0742","","","","","","1.148","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238945","10.5719","0.0005","10.8783","0.0006","23.8868","0.0011","90","","93.507","0.002","90","","2741.9","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-{4-Methyl-<i>N</i>-[(2,3,4,9-tetrahydro-1<i>H</i>-carbazol-3-yl)methyl]benzenesulfonamido}ethyl 4-methylbenzenesulfonate","","- C29 H32 N2 O5 S2 -","- C29 H32 N2 O5 S2 -","- C116 H128 N8 O20 S8 -","4","1","XU5750","Göçmentürk, Mustafa; Ergün, Yavuz; Mougang-Soume, Berline; Çaylak Delibaş, Nagihan; Hökelek, Tuncer","2-{4-Methyl-<i>N</i>-[(2,3,4,9-tetrahydro-1<i>H</i>-carbazol-3-yl)methyl]benzenesulfonamido}ethyl 4-methylbenzenesulfonate","Acta Crystallographica Section E","2013","69","12","o1797","o1798","10.1107/S1600536813031097","","","1.54178","CuKα","","0.0427","0.042","","","0.1154","0.1162","","","","","","1.052","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238946","6.4406","0.0002","15.458","0.0005","8.0789","0.0002","90","","97.143","0.002","90","","798.08","0.04","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[μ-<i>N</i>-(pyridin-2-yl)methanesulfonamido-κ^2^<i>N</i>:<i>N</i>']silver(I)","","- C12 H14 Ag2 N4 O4 S2 -","- C12 H14 Ag2 N4 O4 S2 -","- C24 H28 Ag4 N8 O8 S4 -","2","0.5","XU5753","Hu, Hui-Ling; Yeh, Chun-Wei","Bis[μ-<i>N</i>-(pyridin-2-yl)methanesulfonamido-κ^2^<i>N</i>:<i>N</i>']silver(I)","Acta Crystallographica Section E","2013","69","12","m682","","10.1107/S1600536813031814","","","0.71073","MoKα","","0.0525","0.0359","","","0.084","0.0918","","","","","","1.045","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238947","9.701","0.0006","17.4114","0.0013","15.002","0.001","90","","104.126","0.004","90","","2457.3","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>'-[(<i>E</i>)-2-Fluorobenzylidene]benzohydrazide","","- C14 H11 F N2 O -","- C14 H11 F N2 O -","- C112 H88 F8 N16 O8 -","8","2","YK2100","Sreeja, P. B.; Sithambaresan, M.; Aiswarya, N.; Kurup, M. R. Prathapachandra","<i>N</i>'-[(<i>E</i>)-2-Fluorobenzylidene]benzohydrazide","Acta Crystallographica Section E","2013","69","12","o1828","","10.1107/S1600536813031747","","","0.71073","MoKα","","0.1016","0.0503","","","0.1315","0.1649","","","","","","1.002","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238948","12.187","0.002","12.98","0.002","13.437","0.002","90","","90","","90","","2125.6","0.6","293","2","293","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tetraaquabis(piperazin-1-ium)cobalt(II) bis(sulfate) dihydrate","","- C8 H34 Co N4 O14 S2 -","- C8 H34 Co N4 O14 S2 -","- C32 H136 Co4 N16 O56 S8 -","4","0.5","ZL2569","Sahbani, Thameur; Smirani Sta, Wajda; Rzaigui, Mohamed","Tetraaquabis(piperazin-1-ium)cobalt(II) bis(sulfate) dihydrate","Acta Crystallographica Section E","2013","69","12","m649","m650","10.1107/S1600536813030365","","","0.56085","AgKα","","0.099","0.045","","","0.093","0.1075","","","","","","1.037","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238949","20.1934","0.0002","12.7424","0.0001","15.9008","0.0001","90","","100.038","0.001","90","","4028.84","0.06","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Di-μ-oxido-bis[bis(diisopropylacetamidinato)-κ<i>N</i>;κ^2^<i>N</i>,<i>N</i>'-germanium(IV)]","","- C32 H68 Ge2 N8 O2 -","- C32 H68 Ge2 N8 O2 -","- C128 H272 Ge8 N32 O8 -","4","0.5","ZL2570","Syre, Ronny; Frenzel, Nancy; Hrib, Cristian G.; Burte, Edmund P.; Jones, Peter G.; Edelmann, Frank T.","Di-μ-oxido-bis[bis(diisopropylacetamidinato)-κ<i>N</i>;κ^2^<i>N</i>,<i>N</i>'-germanium(IV)]","Acta Crystallographica Section E","2013","69","12","m686","m687","10.1107/S1600536813032133","","","1.54184","CuKα","","0.0209","0.0202","","","0.0558","0.0565","","","","","","1.079","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238950","13.3019","0.0004","15.7762","0.0005","7.4265","0.0002","90","","93.719","0.002","90","","1555.19","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Bromobenzene-1,3-dicarbonitrile","","- C8 H3 Br N2 -","- C8 H3 Br N2 -","- C64 H24 Br8 N16 -","8","2","ZP2009","Seidel, Nadine; Seichter, Wilhelm; Weber, Edwin","5-Bromobenzene-1,3-dicarbonitrile","Acta Crystallographica Section E","2013","69","12","o1732","o1733","10.1107/S1600536813028857","","","0.71073","MoKα","","0.0433","0.0308","","","0.0718","0.0783","","","","","","1.047","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238951","8.8949","0.0018","9.0003","0.0018","25.58","0.005","90","","96.75","0.03","90","","2033.7","0.7","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-[6-(4-methylbenzoyl)-7-phenyl-2,3-dihydro-1<i>H</i>-pyrrolizin-5-yl]-2-oxoacetate","","- C25 H23 N O4 -","- C25 H23 N O4 -","- C100 H92 N4 O16 -","4","1","ZP2010","Zhong, Jia-liang; Sun, Wen-xia; Zhang, Fu-li; Liu, Li-hong; Liu, He","Ethyl 2-[6-(4-methylbenzoyl)-7-phenyl-2,3-dihydro-1<i>H</i>-pyrrolizin-5-yl]-2-oxoacetate","Acta Crystallographica Section E","2013","69","12","o1730","","10.1107/S1600536813029401","","","0.71073","MoKα","","0.1282","0.0617","","","0.1578","0.1936","","","","","","0.965","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238952","11.5314","0.0016","8.7905","0.0011","9.3363","0.0013","90","","97.339","0.014","90","","938.6","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-Ethoxy-3-methoxybenzaldehyde","","- C10 H12 O3 -","- C10 H12 O3 -","- C40 H48 O12 -","4","1","ZQ2209","Leka, Zorica; Novaković, Sladjana B.; Bogdanović, Goran A.; Muškinja, Jovana; Vukićević, Rastko D.","4-Ethoxy-3-methoxybenzaldehyde","Acta Crystallographica Section E","2013","69","12","o1728","","10.1107/S160053681302761X","","","1.5418","CuKα","","0.0659","0.0468","","","0.1284","0.1475","","","","","","1.036","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238953","13.6601","0.0007","8.5782","0.0005","15.2373","0.0008","90","","97.684","0.003","90","","1769.46","0.17","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(3a<i>R</i>,8b<i>R</i>)-3a,8b-Dihydroxy-1-(4-methoxyphenyl)-2-methylsulfanyl-3-nitro-1,8b-dihydroindeno[1,2-<i>b</i>]pyrrol-4(3a<i>H</i>)-one","","- C19 H16 N2 O6 S -","- C19 H16 N2 O6 S -","- C76 H64 N8 O24 S4 -","4","1","ZQ2211","Nagalakshmi, R. A.; Suresh, J.; Jeyachandran, V.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha","(3a<i>R</i>,8b<i>R</i>)-3a,8b-Dihydroxy-1-(4-methoxyphenyl)-2-methylsulfanyl-3-nitro-1,8b-dihydroindeno[1,2-<i>b</i>]pyrrol-4(3a<i>H</i>)-one","Acta Crystallographica Section E","2013","69","12","o1849","o1850","10.1107/S1600536813031279","","","0.71073","MoKα","","0.0649","0.0526","","","0.144","0.1553","","","","","","1.02","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2238954","7.4317","0.0015","8.0137","0.0016","10.083","0.002","92.09","0.03","93.81","0.03","101.09","0.03","587.2","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","2-[(Ferrocen-1-yl)(hydroxy)methyl]prop-2-enenitrile","","- C14 H13 Fe N O -","- C14 H13 Fe N O -","- C28 H26 Fe2 N2 O2 -","2","1","ZQ2212","Selvanayagam, S.; Ravikumar, K.; Kathiravan, S.; Raghunathan, R.","2-[(Ferrocen-1-yl)(hydroxy)methyl]prop-2-enenitrile","Acta Crystallographica Section E","2013","69","12","m669","","10.1107/S1600536813031218","","","0.71073","MoKα","","0.0439","0.0413","","","0.1096","0.1119","","","","","","1.061","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2238955","10.4817","0.0004","13.4904","0.0005","15.1639","0.0005","90","","90","","90","","2144.21","0.13","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4'-Acetyloxy-1,3,1'-trioxo-1,3,4,4a,4b,5,6,7,9,9a-decahydrospiro[indene-2,9'-pyrano[4,3-<i>a</i>]pyrrolizin]-3'-yl)methyl acetate","","- C23 H23 N O8 -","- C23 H23 N O8 -","- C92 H92 N4 O32 -","4","1","ZS2277","Latha, N.; Naga Siva Rao, J.; Raghunathan, R.; Divya, G.; Lakshmi, S.","(4'-Acetyloxy-1,3,1'-trioxo-1,3,4,4a,4b,5,6,7,9,9a-decahydrospiro[indene-2,9'-pyrano[4,3-<i>a</i>]pyrrolizin]-3'-yl)methyl acetate","Acta Crystallographica Section E","2013","69","12","o1764","","10.1107/S1600536813029826","","","0.71073","MoKα","","0.0757","0.0517","","","0.1311","0.1463","","","","","","1.033","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238956","12.4854","0.0006","11.3906","0.0005","28.365","0.002","90","","90","","90","","4034","0.4","295","2","295","2","","","","","","","","5","P n a 21","P 2c -2n","33","","[<i>meso</i>-5,10,15,20-Tetrakis(3-methylthiophen-2-yl)porphyrinato-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']nickel(II) benzene hemisolvate","","- C43 H31 N4 Ni S4 -","- C43 H31 N4 Ni S4 -","- C172 H124 N16 Ni4 S16 -","4","1","ZS2280","Prasath, R.; Bhavana, P.; Gupta, Sushil K.; Butcher, Ray J.","[<i>meso</i>-5,10,15,20-Tetrakis(3-methylthiophen-2-yl)porphyrinato-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']nickel(II) benzene hemisolvate","Acta Crystallographica Section E","2013","69","12","m652","m653","10.1107/S1600536813030468","","","0.71069","MoKα","","0.1664","0.0766","","","0.1842","0.24","","","","","","0.985","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2240715","10.3754","0.0017","32.519","0.005","5.0615","0.0008","90","","90","","90","","1707.7","0.5","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","<i>N</i>'-[(<i>E</i>)-Benzylidene]-2-(6-methoxynaphthalen-2-yl)propanohydrazide","","- C21 H20 N2 O2 -","- C21 H20 N2 O2 -","- C84 H80 N8 O8 -","4","1","SJ5356","Mague, Joel T.; Akkurt, Mehmet; Mohamed, Shaaban K.; El-Remaily, Mahmoud A. A.; Albayati, Mustafa R.","<i>N</i>'-[(<i>E</i>)-Benzylidene]-2-(6-methoxynaphthalen-2-yl)propanohydrazide","Acta Crystallographica Section E","2013","69","11","o1614","","10.1107/S1600536813026986","","","0.71073","MoKα","","0.0567","0.0516","","","0.1255","0.1284","","","","","","1.099","","","","has coordinates,has Fobs","136874","2020-10-21","18:00:00",""
"2240718","4.7741","0.0013","15.198","0.004","17.274","0.005","90","","95.275","0.012","90","","1248","0.6","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(4-Hydroxy-3,5-dimethylphenyl)(phenyl)methanone","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","ZS2279","Dileep, C. S.; Prashanth, T.; Jeyaseelan, S.; Khanum, S. A.; Sridhar, M. A.","(4-Hydroxy-3,5-dimethylphenyl)(phenyl)methanone","Acta Crystallographica Section E","2013","69","11","o1676","","10.1107/S1600536813028444","","","0.71073","MoKα","","0.0537","0.0408","","","0.1253","0.1403","","","","","","1.02","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2240733","8.7195","0.0017","9.9454","0.0019","23.389","0.004","90","","90","","90","","2028.3","0.7","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(3,4-Difluorophenyl)-1<i>H</i>-benzimidazole","","- C13 H8 F2 N2 -","- C13 H8 F2 N2 -","- C104 H64 F16 N16 -","8","1","LH5659","Krishnamurthy, M. S.; Fathima, Nikhath; Nagarajaiah, H.; Begum, Noor Shahina","2-(3,4-Difluorophenyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2013","69","11","o1689","","10.1107/S1600536813028559","","","0.71073","MoKα","","0.095","0.0593","","","0.1422","0.1558","","","","","","1.009","","","","has coordinates,has Fobs","136894","2020-10-21","18:00:00",""
"2240740","26.1463","0.0017","12.3091","0.0008","10.1776","0.0007","90","","101.383","0.004","90","","3211.1","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(4-Fluorophenyl)-4-(thiophen-2-yl)-2,3-dihydro-1,5-benzothiazepine","","- C19 H14 F N S2 -","- C19 H14 F N S2 -","- C152 H112 F8 N8 S16 -","8","1","JJ2176","Manjula, M.; Manjunath, B. C.; Renuka, N.; Ajay Kumar, K.; Lokanath, N. K.","2-(4-Fluorophenyl)-4-(thiophen-2-yl)-2,3-dihydro-1,5-benzothiazepine","Acta Crystallographica Section E","2013","69","11","o1608","","10.1107/S1600536813025889","","","1.54178","CuKα","","0.0625","0.0465","","","0.1239","0.1341","","","","","","1.053","","","","has coordinates,has Fobs","136902","2020-10-21","18:00:00",""
"9015960","8.9391","","9.4694","","16.9374","","90","","90","","90","","1433.72","","","","","","","","","","","","Mitsukoshi, Hizen-cho, Karatsu City, Saga Prefecture, Japan","10","P c c n","-P 2ab 2ac","56","","","Lanthanite-(Nd)","- C3 H16 Eu0.03 Gd0.08 La0.61 Nd0.95 O17 Pr0.17 Sm0.12 Y0.04 -","- C3 H16 Eu0.03 Gd0.08 La0.61 Nd0.95 O17 Pr0.17 Sm0.12 Y0.04 -","- C12 H64 Eu0.12 Gd0.32 La2.44 Nd3.8 O68 Pr0.68 Sm0.48 Y0.16 -","4","0.5","","Morrison, S. M.; Andrade, M. B.; Wenz, M. D.; Domanik, K. J.; Downs, R. T.","Lanthanite-(Nd), Nd2(CO3)3*8H2O","Acta Crystallographica, Section E","2013","69","","i15","i16","10.1107/S1600536813003164","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9017349","16.9093","","9.7287","","20.9019","","90","","112.396","","90","","3179.12","","","","","","","","","","","","Iwagi Island, Inland Sea, Ehime Prefecture, Japan","12","C 1 2/c 1","-C 2yc","15","","","Katayamalite","- Ca7 F0.4 Fe0.04 H1.4 K0.89 Li3 Na0.12 O37.4 Si12 Sn0.02 Ti1.8 Zr0.14 -","- Ca7 F0.4 Fe0.04 H1.4 K0.89 Li3 Na0.12 O37.4 Si12 Sn0.02 Ti1.8 Zr0.14 -","- Ca28 F1.6 Fe0.16 H5.6 K3.56 Li12 Na0.48 O149.6 Si48 Sn0.08 Ti7.2 Zr0.56 -","4","0.5","","Andrade, M. B.; Doell, D.; Downs, R. T.; Yang, H.","Redetermination of katayamalite, KLi3Ca7Ti2(SiO3)12(OH)2","Acta Crystallographica, Section E","2013","69","","i41","i41","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""
"9017350","13.5059","","13.5059","","5.8903","","90","","90","","120","","930.497","","","","","","","","","","","","Jote West mine, Pampa Larga Mining District, Copiapo, Chile","11","P 63/m","-P 6c","176","","","Agardite-(Y)","- As2.484 Ca0.43 Cu6 Dy0.01 Er0.02 H12.002 Ho0.01 O21.001 P0.516 Y0.52 Yb0.01 -","- As2.484 Ca0.43 Cu6 Dy0.01 Er0.02 H12.002 Ho0.01 O21.001 P0.516 Y0.52 Yb0.01 -","- As4.968 Ca0.86 Cu12 Dy0.02 Er0.04 H24.004 Ho0.02 O42.002 P1.032 Y1.04 Yb0.02 -","2","0.166667","","Morrison, S. M.; Domanik, K. J.; Origlieri, M. J.; Downs, R. T.","Agardite-(Y), Cu2+6Y(AsO4)3(OH)6*3H2O","Acta Crystallographica, Section E","2013","69","","i61","i62","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""