# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-02-20T02:35:33+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Zeitschrift für Kristallographie - New Crystal Structures') AND volume = 230 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
"8107630","4.915","0.004","4.915","0.004","15.45","0.01","90","","90","","120","","323.2","0.4","","","293","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C2 Cd F Li2 O6 Rb -","- C2 Cd F Li2 O6 Rb -","- C4 Cd2 F2 Li4 O12 Rb2 -","2","0.166667","","Chen, Jie; Luo, Min; Ye, Ning","Crystal structure of a new alkaline-cadmium carbonate Li2RbCd(CO3)2F, C2CdFLi2O6Rb","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","1","2","10.1515/ncrs-2014-9048","","x-ray","0.71073","MoKα","","","0.0242","","","0.0571","","","","","","","","","","","has coordinates","286983","2023-10-16","08:13:59",""
"8107631","8.673","0.0005","8.673","0.0005","12.443","0.001","90","","90","","90","","935.97","0.11","","","295","","","","","","","","","3","P 4/n c c :2","-P 4a 2ac","130","pentastrontium bis(dinitridocobaltate(I))","","","- Co2 N4 Sr5 -","- Co2 N4 Sr5 -","- Co8 N16 Sr20 -","4","0.25","","Ovchinnikov, Alexander; Höhn, Peter; Borrmann, Horst; Kazancioğlu, Monika; Kniep, Rüdiger","Crystal structure of pentastrontium bis(dinitridocobaltate(I)), Sr5[CoN2]2, Co2N4Sr5","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","3","4","10.1515/ncrs-2014-9131","","x-ray","0.71073","MoKα","","","0.0293","","","0.0684","","","","","","","","","","","has coordinates","286984","2023-10-16","08:48:44",""
"8107632","10.0547","0.0004","9.8289","0.0003","16.6993","0.0007","90","","90.659","0.002","90","","1650.23","0.11","","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1-[2-[(2-chloro-3-thienyl)methoxy]-2-(2,4-dichloro-phenyl)ethyl]-1H-imidazole","","","- C16 H13 Cl3 N2 O S -","- C16 H13 Cl3 N2 O S -","- C64 H52 Cl12 N8 O4 S4 -","4","1","","Pansuriya, Pramod B.; Friedrich, Holger B.; Maguire, Glenn E. M.","Crystal structure of 1-[2-[(2-chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl) ethyl]-1H-imidazole, C16H13Cl3N2OS","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","5","6","10.1515/ncrs-2014-0210","","x-ray","0.71073","MoKα","","","0.0386","","","0.0891","","","","","","","","","","","has coordinates","287110","2023-10-25","07:33:26",""
"8107633","8.7507","0.0001","15.8341","0.0002","29.9642","0.0004","90","","90","","90","","4151.82","0.09","","","150","","","","","","","","see text","5","P b c a","-P 2ac 2ab","61","","","","- C21 H26 Au Cl N2 -","- C21 H26 Au Cl N2 -","- C168 H208 Au8 Cl8 N16 -","8","1","","Huang, Yao-Huei; Lee, Hon Man","Crystal structure of chlorido-(1,3-dimesitylimidazolidin-2-ylidene-κ1C)- gold(I), C21H26AuClN2","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","7","8","10.1515/ncrs-2014-9080","","x-ray","0.71073","MoKα","","","0.0204","","","0.0403","","","","","","","","","","","has coordinates","299347","2025-04-22","16:49:34",""
"8107634","7.4237","0.0004","8.7173","0.0005","11.3227","0.0006","73.411","0.002","72.173","0.003","68.967","0.003","638.24","0.06","","","200","","","","","","","","","5","P -1","-P 1","2","3,5-diaza-methyl-2-methyl-6-oxo-6-phenyl-4-thioxohexanoate","","","- C12 H14 N2 O3 S -","- C12 H14 N2 O3 S -","- C24 H28 N4 O6 S2 -","2","1","","Odame, Felix; Hosten, Eric C.; Tshentu, Zenixole R.; Betz, Richard","Crystal structure of 3,5-diaza-methyl-2-methyl-6-oxo-6-phenyl-4- thioxohexanoate, at 200 K, C12H14N2O3S","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","9","10","10.1515/ncrs-2014-0217","","x-ray","0.71073","MoKα","","","0.0426","","","0.1158","","","","","","","","","","","has coordinates","287139","2023-10-27","06:37:28",""
"8107635","27.441","0.006","7.569","0.002","19.961","0.005","90","","111.521","0.002","90","","3856.9","1.6","","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H17 Co N3 O7 -","- C20 H17 Co N3 O7 -","- C160 H136 Co8 N24 O56 -","8","1","","Yin, Wei-Dong; Li, Gui-Lian","Crystal structure of poly[aqua(1,2-bis(4-pyridyl)ethane-κ2N:N’)(4-nitro- 1,2-benzenedicarboxylate-κ3O,O’:O’’)cobalt(II)], C20H17CoN3O7","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","11","12","10.1515/ncrs-2014-0218","","x-ray","0.71073","MoKα","","","0.0477","","","0.1115","","","","","","","","","","","has coordinates","287140","2023-10-27","07:18:51",""
"8107636","4.0727","0.0002","22.256","0.001","11.4854","0.0006","90","","98.364","0.003","90","","1029.99","0.09","","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(E)-2-[(ortho-hydroxy)benzylidene]-2-(thiomethyl)- thionohydrazide","","","- C9 H10 N2 O S2 -","- C9 H10 N2 O S2 -","- C36 H40 N8 O4 S8 -","4","1","","Madanhire, Tatenda; Abrahams, Abubak'r; Hosten, Eric C.; Betz, Richard","Crystal structure of (E)-2-[(ortho-hydroxy)benzylidene]-2-(thiomethyl)- thionohydrazide, C9H10N2OS2","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","13","14","10.1515/ncrs-2014-0223","","x-ray","0.71073","MoKα","","","0.0295","","","0.0725","","","","","","","","","","","has coordinates","287141","2023-10-27","07:42:28",""
"8107637","12.2013","0.0003","12.2013","0.0003","7.1016","0.0002","90","","90","","90","","1057.23","0.05","","","200","","","","","","","","","5","I -4","I -4","82","Tetraphenylphosphonium perrhenate(VII)","","","- C24 H20 O4 P Re -","- C24 H20 O4 P Re -","- C48 H40 O8 P2 Re2 -","2","0.25","","Mukiza, Janvier; Gerber, Thomas I. A.; Hosten, Eric C.; Betz, Richard","Crystal structure of a second polymorph of tetraphenylphosphonium perrhenate(VII), at 200 K, C24H20O4PRe","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","15","16","10.1515/ncrs-2014-0224","","x-ray","0.71073","MoKα","","","0.017","","","0.0416","","","","","","","","","","","has coordinates","287142","2023-10-27","08:38:35",""
"8107638","7.6067","0.0002","6.5835","0.0002","18.5042","0.0005","90","","97.29","0.001","90","","919.18","0.04","","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 Cu N2 S4 -","- C16 H16 Cu N2 S4 -","- C32 H32 Cu2 N4 S8 -","2","0.5","","Onwudiwe, Damian C.; Strydom, Christien A.; Hosten, Eric C.","Redetermination of the crystal structure of bis(N-methyl-N-phenyldithiocarbamato- κ2S,S’)copper(II), C16H16CuN2S4","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","17","18","10.1515/ncrs-2014-0225","","x-ray","0.71073","MoKα","","","0.0243","","","0.0626","","","","","","","","","","","has coordinates","287143","2023-10-27","09:02:38",""
"8107639","16.435","0.001","12.9012","0.0009","8.6788","0.0005","90","","90.007","0.004","90","","1840.2","0.2","","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1-(2-cyano-1,5-dimethyl- 4-pyrryl)-2-(2-methyl-5-formyl-3- thienyl)-3,3,4,4,5,5-hexafluorocyclopent- 1-ene","","","- C18 H12 F6 N2 O S -","- C18 H12 F6 N2 O S -","- C72 H48 F24 N8 O4 S4 -","4","1","","Zheng, Chunhong; Fan, Congbin; Pu, Shouzhi","Crystal structure of the photochromic compound 1-(2-cyano-1,5-dimethyl- 4-pyrryl)-2-(2-methyl-5-formyl-3-thienyl)-3,3,4,4,5,5-hexafluorocyclopent- 1-ene, C18H12F6N2OS","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","19","20","10.1515/ncrs-2014-9000","","x-ray","0.71073","MoKα","","","0.0531","","","0.1399","","","","","","","","","","","has coordinates","287489","2023-11-09","08:15:07",""
"8107640","8.1836","0.0002","8.4974","0.0002","10.8493","0.0003","82.291","0.001","79.191","0.001","69.961","0.001","694.2","0.03","","","200","","","","","","","","","5","P -1","-P 1","2","benzyltriethylammoniumchloride monohydrate","","","- C13 H24 Cl N O -","- C13 H24 Cl N O -","- C26 H48 Cl2 N2 O2 -","2","1","","Hosten, Eric C.; Betz, Richard","Redetermination of the crystal structure of benzyltriethylammoniumchloride monohydrate at 200 K – localization of hydrogen atoms, C13H24ClNO","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","21","22","10.1515/ncrs-2014-9024","","x-ray","0.71073","MoKα","","","0.0305","","","0.0876","","","","","","","","","","","has coordinates","287490","2023-11-09","09:59:07",""
"8107641","24.2146","0.0006","8.9277","0.0002","31.2847","0.0007","90","","118.864","0.002","90","","5922.9","0.3","","","200","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","bis(u2-S-(Z)-3-(hydroxido(phenyl)methylene)-1,1- diphenyl thioureaa-kO,S,S)hexacarbonyl dirhenium(I)","","","- C60 H52 N4 O8 Re2 S2 -","- C60 H52 N4 O8 Re2 S2 -","- C240 H208 N16 O32 Re8 S8 -","4","1","","Mukiza, Janvier; Gerber, Thomas I. A.; Hosten, Eric C.; Betz, Richard","Crystal structure of bis(μ2-S-(Z)-3-(hydroxido(phenyl)methylene)-1,1- diphenyl thioureaa-κO,S,S)hexacarbonyl dirhenium(I), C60H52N4O8Re2S2","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","23","26","10.1515/ncrs-2014-0230","","x-ray","0.71073","MoKα","","","0.036","","","0.0786","","","","","","","","","","","has coordinates","287491","2023-11-09","11:05:25",""
"8107642","3.9398","0.0002","12.5823","0.0006","9.8199","0.0004","90","","106.934","0.002","90","","465.68","0.04","","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-bromo-1H-imidazole","","","- C3 H3 Br N2 -","- C3 H3 Br N2 -","- C12 H12 Br4 N8 -","4","1","","Hosten, Eric C.; Betz, Richard","Crystal structure of 4-bromo-1H-imidazole, at 200 K, C3H3BrN2","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","27","28","10.1515/ncrs-2014-0232","","x-ray","0.71073","MoKα","","","0.0296","","","0.0758","","","","","","","","","","","has coordinates","287508","2023-11-10","08:32:05",""
"8107643","6.0941","0.0006","7.3417","0.0007","24.394","0.002","90","","90","","90","","1091.41","0.17","","","200","","","","","","","","","4","P c a 21","P 2c -2ac","29","4-bromo-4'-methoxy-biphenyl,","","","- C13 H11 Br O -","- C13 H11 Br O -","- C52 H44 Br4 O4 -","4","1","","Hosten, Eric C.; Betz, Richard","Crystal structure of 4-bromo-4’-methoxy-biphenyl, at 200 K, C13H11BrO","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","29","30","10.1515/ncrs-2014-0233","","x-ray","0.71073","MoKα","","","0.0472","","","0.1175","","","","","","","","","","","has coordinates","287509","2023-11-10","09:05:07",""
"8107644","15.954","0.0019","7.7489","0.0009","17.811","0.002","90","","90","","90","","2201.9","0.4","","","296","","","","","","","","","5","P b c a","-P 2ac 2ab","61","poly[mu4-2,6-dimethyl-pyridine-3,5-dicarboxylate- k6O,O':O',O'',O''':O'''] calcium(II)","","","- C9 H11 Ca N O6 -","- C9 H11 Ca N O6 -","- C72 H88 Ca8 N8 O48 -","8","1","","Zhao, Yan; Li, Shi-Hui; Zhang, Li","Crystal structure of poly[μ4-2,6-dimethyl-pyridine-3,5-dicarboxylate- κ6O,O’:O’,O’’,O’’’:O’’’] calcium(II), C9H11CaNO6","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","31","32","10.1515/ncrs-2014-9068","","x-ray","0.71073","MoKα","","","0.0398","","","0.101","","","","","","","","","","","has coordinates","287510","2023-11-10","09:25:16",""
"8107645","5.8945","0.0004","6.0522","0.0003","10.7643","0.0007","101.219","0.002","90.581","0.002","95.445","0.002","374.81","0.04","","","200","","","","","","","","","3","P -1","-P 1","2","endo-2-carboxy-bicyclo[2.2.1]-heptane","","","- C8 H12 O2 -","- C8 H12 O2 -","- C16 H24 O4 -","2","1","","Schalekamp, Henk; Hosten, Eric C.; Betz, Richard","Redetermination of the crystal structure of endo-2-carboxy-bicyclo[2.2.1]- heptane, C8H12O2","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","33","34","10.1515/ncrs-2014-0235","","x-ray","0.71073","MoKα","","","0.0417","","","0.1105","","","","","","","","","","","has coordinates","287511","2023-11-10","10:05:40",""
"8107646","8.831","0.0004","9.779","0.0004","20.4514","0.0008","87.361","0.002","78.463","0.002","76.439","0.002","1682.22","0.12","","","200","","","","","","","","","5","P -1","-P 1","2","4-bromobenzoic acid-triphenylphosphane oxide-water(1:2:1)","","","- C79 H69 Br O8 P4 -","- C79 H69 Br O8 P4 -","- C79 H69 Br O8 P4 -","1","0.5","","Mukiza, Janvier; Gerber, Thomas I. A.; Hosten, Eric C.; Betz, Richard","The crystal structure of 4-bromobenzoic acid — triphenylphosphane oxide — water (1:2:1), C79H69BrO8P4","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","35","37","10.1515/ncrs-2014-0226","","x-ray","0.71073","MoKα","","","0.0331","","","0.0907","","","","","","","","","","","has coordinates","287512","2023-11-10","10:33:50",""
"8107647","20.817","0.0006","7.8774","0.0003","21.8896","0.0006","90","","110.596","0.002","90","","3360.11","0.19","","","200","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","fac-tricarbonyl-2-((E)-(3-amino-2-hydroxypropyl- imino)methyl)phenol rhenium(I) toluene solvate","","","- C33 H34 N4 O10 Re2 -","- C33 H37 N4 O10 Re2 -","- C132 H148 N16 O40 Re8 -","4","0.5","","Habarurema, Gratien; Gerber, Thomas I. A.; Hosten, Eric C.; Betz, Richard","Crystal structure of fac-tricarbonyl-2-((E)-(3-amino-2-hydroxypropylimino) methyl)phenol rhenium(I) toluene solvate, C33H34N4O10Re2","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","38","40","10.1515/ncrs-2014-0221","","x-ray","0.71073","MoKα","","","0.0166","","","0.0351","","","","","","","","","","","has coordinates","287561","2023-11-13","08:48:42",""
"8107648","14.604","0.001","18.865","0.002","11.0673","0.0009","90","","90","","90","","3049.1","0.5","","","296","","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C52 H72 N8 Ni2 O20 S4 -","- C52 H72 N8 Ni2 O20 S4 -","- C104 H144 N16 Ni4 O40 S8 -","2","0.5","","Han, Min-Le; Du, De-Guang","Crystal structure of catena[(tetraaqua-bis(μ2-(4,4'-bipyridine-κ2N:N'))- nickel(II)][(diaqua-bis(3-methyl-4-amino-benzensulphonate-κ1O)-bis(μ2- (4,4'-bipyridine-κ2N:N'))nickel(II)]—3-methyl-4-aminobenzensulphonate— ethanol (1:2:2), C52H72N8Ni2O20S4","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","41","43","10.1515/ncrs-2014-0222","","x-ray","0.71073","MoKα","","","0.0282","","","0.0727","","","","","","","","","","","has coordinates","287562","2023-11-13","09:27:58",""
"8107649","22.178","0.001","12.4411","0.0005","17.1519","0.0007","90","","90.27","0.002","90","","4732.5","0.3","","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Crystal structure of tricarbonyl-chlorido-(N-(pyridin-2-yl)-N-((4-tert- butyl)benzoyl)pyridine-2-amine)rhenium(I)","","","- C24 H21 Cl N3 O4 Re -","- C24 H21 Cl N3 O4 Re -","- C192 H168 Cl8 N24 O32 Re8 -","8","1","","Mukiza, Janvier; Gerber, Thomas I. A.; Hosten, Eric C.; Betz, Richard","Crystal structure of tricarbonyl-chlorido-(N-(pyridin-2-yl)-N-((4-tertbutyl) benzoyl)pyridine-2-amine)rhenium(I), C24H21ClN3O4Re","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","44","46","10.1515/ncrs-2014-9029","","x-ray","0.71073","MoKα","","","0.0179","","","0.0376","","","","","","","","","","","has coordinates","287563","2023-11-13","10:07:52",""
"8107650","11.0847","0.0002","9.9392","0.0002","19.5046","0.0003","90","","102.164","0.001","90","","2100.64","0.07","","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1,5-bis((1E)-4-hydroxy-3-methoxybenzylidene)- thiocarbonohydrazide ethanol solvate","","","- C19 H24 N4 O5 S -","- C19 H24 N4 O5 S -","- C76 H96 N16 O20 S4 -","4","1","","Schmitt, Bonell; Gerber, Thomas I. A.; Hosten, Eric C; Betz, Richard","Crystal structure of 1,5-bis((1E)-4-hydroxy-3-methoxybenzylidene)- thiocarbonohydrazide ethanol solvate, at 200 K, C19H24N4O5S","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","47","49","10.1515/ncrs-2014-0228","","x-ray","0.71073","MoKα","","","0.0395","","","0.1069","","","","","","","","","","","has coordinates","287564","2023-11-13","10:30:05",""
"8107713","10.6902","0.0004","12.9126","0.0004","15.1755","0.0005","92.277","0.002","104.928","0.002","111.714","0.002","1859.08","0.12","","","173","","","","","","","","","5","P -1","-P 1","2","is(dicyclohexylammonium) 4-(2-carboxylato- phenyl)-3,5-dimethyl-1,2,6-thiadiazin-2-ide 1,1-dioxide methanol monosolvate","","","- C37 H62 N4 O5 S -","- C37 H62 N4 O5 S -","- C74 H124 N8 O10 S2 -","2","1","","Bhatt, Nilay; Bhatt, Pralav; Govender, Thavendran; Kruger, Hendrik G.; Maguire, Glenn E. M.","Crystal structure of bis(dicyclohexylammonium) 4-(2-carboxylatophenyl)- 3,5-dimethyl-1,2,6-thiadiazin-2-ide 1,1-dioxide methanol monosolvate, C37H62N4O5S","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","53","55","10.1515/ncrs-2014-0209","","x-ray","0.71073","MoKα","","","0.038","","","0.0999","","","","","","","","","","","has coordinates","288032","2023-12-05","10:30:32",""
"8107714","9.9185","0.0003","27.256","0.0007","10.0375","0.0002","90","","109.082","0.001","90","","2564.42","0.11","","","200","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H28 Cl N4 O3 Re -","- C24 H28 Cl N4 O3 Re -","- C96 H112 Cl4 N16 O12 Re4 -","4","1","","Schmitt, Bonell; Gerber, Thomas I. A.; Hosten, Eric C.; Betz, Richard","Crystal structure of fac-tricarbonyl-chlorido-bis(para-N’,N’-dimethyl-κ- N-pyridyl)rhenium(I) toluene (1:1), C24H28ClN4O3Re","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","56","58","10.1515/ncrs-2014-0236","","x-ray","0.71073","MoKα","","","0.0471","","","0.0886","","","","","","","","","","","has coordinates","288114","2023-12-07","08:35:07",""
"8107715","4.0853","0.0002","9.6025","0.0004","21.989","0.001","90","","90","","90","","862.61","0.07","","","200","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","p-bromophenacyl bromide","","","- C8 H6 Br2 O -","- C8 H6 Br2 O -","- C32 H24 Br8 O4 -","4","1","","Hosten, Eric C.; Betz, Richard","Redetermination of the crystal structure of p-bromophenacyl bromide at 200 K – Localization of hydrogen atoms, C8H6Br2O","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","2","59","60","10.1515/ncrs-2014-9027","","x-ray","0.71073","MoKα","","","0.0208","","","0.0492","","","","","","","","","","","has coordinates","288116","2023-12-07","09:04:36",""
"8107716","8.2038","0.0003","19.881","0.0007","24.0661","0.0008","90","","90","","90","","3925.2","0.2","","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","(E)-3-(4-methoxyphenyl)-1-(thiophen-2-yl)-2- tosylprop-2-en-1-one","","","- C21 H18 O4 S2 -","- C21 H18 O4 S2 -","- C168 H144 O32 S16 -","8","1","","Abdel-Aziz, Hatem A.; Ghabbour, Hazem A.; Fun, Hoong-Kun","Crystal structure of (E)-3-(4-methoxyphenyl)-1-(thiophen-2-yl)-2- tosylprop-2-en-1-one, C21H18O4S2","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","2","61","62","10.1515/ncrs-2014-9040","","x-ray","1.54178","MoKα","","","0.049","","","0.1426","","","","","","","","","","","has coordinates","288212","2023-12-11","09:19:41",""
"8107717","4.501","0.002","16.229","0.008","24.2","0.01","90","","90","","90","","1767.7","1.4","","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","3-bromo-4-(2-bromo-ethyl)-5-(4-chloro-phenyl)-2-p- tolyl-furan","","","- C19 H15 Br2 Cl O -","- C19 H15 Br2 Cl O -","- C76 H60 Br8 Cl4 O4 -","4","1","","Li, Shi-Hui; Zhao, Yan; Zhang, Meng-Yin","Crystal structure of 3-bromo-4-(2-bromo-ethyl)-5-(4-chloro-phenyl)-2-ptolyl- furan, C19H15Br2ClO","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","2","63","64","10.1515/ncrs-2014-9050","","x-ray","0.71073","MoKα","","","0.035","","","0.0637","","","","","","","","","","","has coordinates","288213","2023-12-11","09:41:03",""
"8107718","6.8195","0.0005","9.6727","0.0008","13.268","0.001","98.491","0.002","100.571","0.002","107.434","0.002","801.44","0.11","","","296","","","","","","","","","5","P -1","-P 1","2","2-benzoyl-3-(3,4-dichlorophenyl)cyclopropane-1,1- dicarbonitrile","","","- C18 H10 Cl2 N2 O -","- C18 H10 Cl2 N2 O -","- C36 H20 Cl4 N4 O2 -","2","1","","Yanping, Yi","Crystal structure of 2-benzoyl-3-(3,4-dichlorophenyl)cyclopropane-1,1- dicarbonitrile, C18H10Cl2N2O","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","2","65","66","10.1515/ncrs-2014-9063","","x-ray","0.71073","MoKα","","","0.0436","","","0.1224","","","","","","","","","","","has coordinates","288214","2023-12-11","10:34:52",""
"8107719","8.561","0.0002","11.012","0.0003","13.214","0.0004","90","","107.345","0.001","90","","1189.09","0.06","","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","4-(4-bromophenyl)-1-(propan-2-ylidene)thiosemi- carbazide","","","- C10 H12 Br N3 S -","- C10 H12 Br N3 S -","- C40 H48 Br4 N12 S4 -","4","1","","Madanhire, Tatenda; Abrahams, Abubak'r; Hosten, Eric C.; Betz, Richard","Crystal structure of 4-(4-bromophenyl)-1-(propan-2-ylidene)thiosemicarbazide, C10H12BrN3S","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","2","67","68","10.1515/ncrs-2014-9025","","x-ray","0.71069","MoKα","","","0.0249","","","0.065","","","","","","","","","","","has coordinates","288215","2023-12-11","10:54:07",""
"8107720","15.771","0.004","11.101","0.003","22.072","0.006","90","","101.986","0.009","90","","3780","1.7","","","200","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","(6E)-2-[(ortho-hydroxy)benzylidene]-1-[4,5-dihydro- 5-(ortho-hydroxy-phenyl)-1,3,4-thiadiazo-2-yl-4-isoproylidenonium]- hydrazine chloride","","","- C18 H19 Cl N4 O2 S -","- C18 H19 Cl N4 O2 S -","- C144 H152 Cl8 N32 O16 S8 -","8","1","","Schmitt, Bonell; Gerber, Thomas I. A.; Hosten, Eric C.; Betz, Richard","Crystal structure of (6E)-2-[(ortho-hydroxy)benzylidene]-1-[4,5-dihydro- 5-(ortho-hydroxy-phenyl)-1,3,4-thiadiazo-2-yl-4-isoproylidenonium]- hydrazine chloride, C18H19ClN4O2S","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","2","69","70","10.1515/ncrs-2014-0229","","x-ray","0.71073","MoKα","","","0.0551","","","0.1538","","","","","","","","","","","has coordinates","288302","2023-12-14","09:11:45",""
"8107721","18.692","0.004","5.8557","0.0013","12.575","0.003","90","","106.875","0.003","90","","1317.1","0.5","","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","alpha-(4-(hydroxyimino)-2,5-dichloro-2,5-cyclohexadien- 1-ylidene)-benzeneacetonitrile","","","- C14 H8 Cl2 N2 O -","- C14 H8 Cl2 N2 O -","- C56 H32 Cl8 N8 O4 -","4","1","","Hong, Zhi; Chen, Guang; Jiang, Hua-Jiang; Chen, Ren-Er; Su, Wei-Ke","Crystal structure of α-(4-(hydroxyimino)-2,5-dichloro-2,5-cyclohexadien- 1-ylidene)-benzeneacetonitrile, C14H8Cl2N2O","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","2","71","72","10.1515/ncrs-2014-9033","","x-ray","0.71073","MoKα","","","0.0392","","","0.1127","","","","","","","","","","","has coordinates","288303","2023-12-14","09:37:41",""