# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-25T08:03:32+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 'Zeitschrift für Kristallographie - New Crystal Structures') AND volume = 220 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
"8101672","9.3197","0.0018","10.6761","0.0008","33.786","0.002","90","","90","","90","","3361.6","0.7","293","2","293","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","(3S,1'S)-2,2-dimethyl-3-[1,2-cyclohexylidenedioxyethyl]-tetrahydro-1,2-oxazolium tetrafluoroborate","","- C13 H24 B F4 N O3 -","- C13 H24 B F4 N O3 -","- C104 H192 B8 F32 N8 O24 -","8","1","","W. Frey; M. Henneböhle; V. Jäger","Crystal structure of (3S,1'S)-2,2-dimethyl-3-[1,2-cyclohexylidenedioxyethyl]- tetrahydro-1,2-oxazolium tetrafluoroborate, (C~13~H~24~NO~3~)[BF~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","149","150","","","","1.54178","CuKα","","0.0753","0.0638","","","0.1701","0.1849","","","","","","1.386","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101673","8.8739","0.0005","9.5664","0.0005","10.7489","0.0006","90","","90","","90","","912.49","0.09","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(5S,8S)-8-hydroxymethyl-1-methyl-2,7-dioxa-1-aza-spiro[4,4]nonan-6-one","","- C8 H13 N O4 -","- C8 H13 N O4 -","- C32 H52 N4 O16 -","4","1","","W. Frey; M. Imerhasan; Y. Bathich; V. Jäger","Crystal structure of (5S,8S)-8-hydroxymethyl-1-methyl-2,7-dioxa-1- aza-spiro[4,4]nonan-6-one, C~8~H~13~NO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","151","152","","","","1.54178","CuKα","","0.0503","0.0483","","","0.1302","0.1337","","","","","","1.061","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101674","15.915","0.003","8.23","0.002","10.189","0.002","90","","103.98","0.03","90","","1295","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,4-di(1-imidazolylbutane) dihydrochloride","","- C10 H16 Cl2 N4 -","- C10 H16 Cl2 N4 -","- C40 H64 Cl8 N16 -","4","0.5","","M. Królikowska; J. Garbarczyk","Crystal structures of 1,4-di(1-imidazolyl)butane dihydrochloride, (C~10~H~16~N~4~)Cl~2~, and 1,4-di(1-imidazolyl)butane dihydrate, C~10~H~14~N~4~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","103","104","","","","1.54178","CuKα","","0.0448","0.0375","","","0.1082","0.1129","","","","","","1.08","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101675","14.775","0.003","5.222","0.001","15.604","0.003","90","","90","","90","","1203.9","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,4-di(1-imidazolylbutan) dihydrate","","- C10 H18 N4 O2 -","- C10 H18 N4 O2 -","- C40 H72 N16 O8 -","4","0.5","","M. Królikowska; J. Garbarczyk","Crystal structures of 1,4-di(1-imidazolyl)butane dihydrochloride, (C~10~H~16~N~4~)Cl~2~, and 1,4-di(1-imidazolyl)butane dihydrate, C~10~H~14~N~4~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","103","104","","","","1.54178","CuKα","","0.154","0.0774","","","0.2224","0.3112","","","","","","1.076","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101676","11.931","0.001","14.313","0.001","14.804","0.001","91.63","0.01","102.74","0.01","102.52","0.01","2399.4","0.3","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","t-butylisocyanide-tricarbonyl-1,10-phenanthroline-rhenium(I)- trifluormethanesulfonate","","- C21 H17 F3 N3 O6 Re S -","- C21 H17 F3 N3 O6 Re S -","- C84 H68 F12 N12 O24 Re4 S4 -","4","2","","B. Aechter; J. Knizek; H. Nöth; W. Beck","Crystal structure of tert-butylisocyanide-tricarbonyl-1,10-phenanthroline- rhenium(I) trifluormethanesulfonate, [Re(C~5~H~9~N)(CO)~3~(C~12~H~8~N~2~)] (F~3~CSO~3~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","107","109","","","","0.71073","MoKα","","0.0781","0.0603","","0.2627","0.2023","","","","1.171","0.942","0.942","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"8101677","12.98","","18.1165","0.0002","14.437","","90","","109.41","","90","","3201.94","0.04","193","2","193","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","μ-2,2'-bipyrimidine-hexacarbonyl-bis(triphenyl-phosphine-dirhenium(I) bis(trifluormethanesulfonate) tetrakis(acetonitrile)","","- C60 H48 F6 N8 O12 P2 Re2 S2 -","- C60 H48 F6 N8 O12 P2 Re2 S2 -","- C120 H96 F12 N16 O24 P4 Re4 S4 -","2","0.5","","B. Aechter; J. Knizek; H. Nöth; W. Beck","Crystal structure of μ-2,2'-bipyrimidine-hexacarbonyl-bis(triphenylphosphine) dirhenium(I) bis(trifluormethanesulfonate) acetonitrile tetrasolvate, [Re~2~(C~8~H~6~N~4~)(CO)~6~(C~18~H~15~P)~2~](F~3~CSO~3~)~2~ · 4CH~3~CN","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","110","112","","","","0.71073","MoKα","","0.0315","0.0259","","0.0578","0.055","","","","1.158","1.164","1.164","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"8101678","20.269","0.005","9.858","0.002","12.641","0.003","90","","107.719","0.005","90","","2406","1","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","syn-4-(p-trifluoromethylphenyl)-2,4,6-triphenyl-4H-thiopyran-1-oxide","","- C30 H21 F3 O S -","- C30 H21 F3 O S -","- C120 H84 F12 O4 S4 -","4","1","","F. Jafarpour; H. Pirelahi","Crystal structure of syn-4-(p-trifluoromethylphenyl)-2,4,6-triphenyl- 4H-thiopyran-1-oxide, C~30~H~21~F~3~OS","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","15","16","","","","0.71073","MoKα","","0.1351","0.0809","","","0.123","0.1398","","","","","","0.999","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101679","14.954","0.003","8.088","0.002","11.973","0.002","90","","93.5","0.01","90","","1445.4","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","methyl (1R,2S,3R,4S)-1-phenyl-3,4-epoxi-1,2,3,4-tetrahydronaphthalene-2-carboxylate","","- C18 H16 O3 -","- C18 H16 O3 -","- C72 H64 O12 -","4","1","","K. Peters; E.-M. Peters; F. Rebien; T. Linker","Crystal structure of methyl (1R,2S,3R,4S)-1-phenyl-3,4-epoxi-1,2,3, 4-tetrahydronaphthalene-2-carboxylate, C~18~H~16~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","17","18","","","","0.71073","MoKα","","0.1113","0.0834","","","0.2238","0.2487","","","","","","1.018","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101680","15.801","0.001","7.92","0.001","21.055","0.002","90","","101.31","0.01","90","","2583.7","0.4","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,1,2,2-tetramethoxycarbonylethanol","","- C10 H14 O9 -","- C10 H14 O9 -","- C80 H112 O72 -","8","1","","K. Peters; E.-M. Peters; U. Linker; T. Linker","Crystal structure of 1,1,2,2-tetramethoxycarbonylethanol, C~2~H(CH~3~OCO) ~4~OH","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","19","20","","","","0.71073","MoKα","","0.0472","0.0435","","","0.1295","0.1337","","","","","","1.053","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101681","16.5888","0.0006","12.2537","0.0005","5.6054","0.0002","90","","90","","90","","1139.43","0.07","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Phenylbenzylsulfone","","- C13 H12 O2 S -","- C13 H12 O2 S -","- C52 H48 O8 S4 -","4","1","","M.-C. Liu; J.-C. Ding; W. Feng; H.-Y. Wu","Crystal structure of phenylbenzylsulfone, (C~6~H~5~)(C~7~H~7~)SO~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","23","24","","","","0.71073","MoKα","","0.0595","0.0591","","","0.1276","0.1278","","","","","","1.322","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101682","18.483","0.002","9.4125","0.001","10.0721","0.0011","90","","90","","90","","1752.3","0.3","293","2","293","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","(5R,10R)-2,7-dibromo-3,8-dihydroxy-5,10-dimethoxyl- 5,10-dihydro-chromeno[5,4,3-cde]chromene sequihydrate","","- C16 H15 Br2 O7.5 -","- C16 H15 Br2 O7.5 -","- C64 H60 Br8 O30 -","4","1","","Q.-W. Liu; X. Fan; C.-H. Tan; T. Zhang; L.-J. Han; D.-Y. Zhu","Crystal structure of (5R,10R)-2,7-dibromo-3,8-dihydroxy-5,10-dimethoxy- 5,10-dihydrochromeno[5,4,3-cde]chromene sesquihydrate, C~16~H~12~Br~2~O~6~ · 1.5H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","25","26","","","","0.71073","MoKα","","0.1192","0.0827","","","0.1911","0.202","","","","","","0.933","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101683","11.0749","0.0006","13.4572","0.0007","20.501","0.0011","80.666","0.001","86.561","0.001","72.516","0.001","2875.5","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","tris(triphenylphosphine)bis(phenylselenolato)disilver(I)","","- C66 H55 Ag2 P3 Se2 -","- C66 H55 Ag2 P3 Se2 -","- C132 H110 Ag4 P6 Se4 -","2","1","","R.-F. Wang; W.-G. Zhang; J. Fan; S.-L. Wang","Crystal structure of tris(triphenylphosphine)bis(μ-phenylselenolato) disilver(I), Ag~2~[P(C~6~H~5~)~3~]~3~(C~6~H~5~Se)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","58","60","","","","0.71073","MoKα","","0.0604","0.0385","","","0.0784","0.0896","","","","","","1.036","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101684","7.543","0.002","8.629","0.003","6.161","0.002","109.38","0.02","108.03","0.02","101.89","0.03","337.7","0.2","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C10 H14 Cl2 N2 O2 Pd -","- C10 H14 Cl2 N2 O2 Pd -","- C10 H14 Cl2 N2 O2 Pd -","1","0.5","","E. Horn; A. Horiuchi; K. Ito; T. Nakahodo; M. Watabe; T. T. Takahashi; C. A. Horiuchi","Crystal structure of dichlorobis(3,5-dimethylisoxazolato)palladium (II), PdCl~2~(C~5~H~7~NO)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","27","28","","","","0.7107","MoKα'","","","0.0323","","","0.0357","","","","","2.509","2.509","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101685","13.7322","0.0011","14.7879","0.0012","22.6406","0.0018","73.095","0.002","73.579","0.002","65.783","0.001","3940.9","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","bis(triphenylphosphine)hexakis(phenylselenido)tetramercury(II)","","- C84 H70 Hg4 P2 Se8 -","- C84 H70 Hg4 P2 Se8 -","- C168 H140 Hg8 P4 Se16 -","2","1","","R.-F. Wang; W.-G. Zhang; J. Fan; S.-L. Wang","Crystal structure of bis(triphenylphosphine)hexakis(μ-phenylselenido) bis(phenylselenido)tetramercury(II), Hg~4~[P(C~6~H~5~)~3~]~2~(C~6~H~5~Se) ~8~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","61","64","","","","0.71073","MoKα","","0.0451","0.0319","","","0.0651","0.0707","","","","","","0.937","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101686","10.659","0.003","12.29","0.004","13.93","0.004","70.253","0.005","82.368","0.005","68.698","0.004","1600.1","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","tetrakis(4-methylbenzoato)bis[(μ-4-methylbenzoato-O,O')(1,10-phenanthroline)] diholmium(III)","","- C72 H58 Ho2 N4 O12 -","- C72 H58 Ho2 N4 O12 -","- C72 H58 Ho2 N4 O12 -","1","0.5","","X. Li; Y.-Q. Zou","Crystal structure of bis(1,10-phenanthroline)tetrakis(4-methylbenzoato) bis(μ-4-methylbenzoato-O,O')diholmium(III), Ho~2~(C~8~H~7~O~2~)~6~(C~12~H~8~N~2~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","33","35","","","","0.71073","MoKα","","0.0392","0.0274","","","0.0596","0.0645","","","","","","1.042","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101687","18.623","0.004","9.702","0.0019","7.77","0.0016","90","","98.19","0.03","90","","1389.6","0.5","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","sesquiterpene spartidienedione","","- C15 H22 O2 -","- C15 H22 O2 -","- C60 H88 O8 -","4","1","","D. Ruiz; P. Rivera; I. Brito; M. Rodríguez; V. Manríquez","Crystal structure of sesquiterpene spartidienedione, C~15~H~22~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","87","88","","","","0.71073","MoKα","","0.0579","0.0575","","","0.1314","0.1326","","","","","","1.094","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101688","8.155","0.002","12.375","0.004","22.168","0.006","92.626","0.004","95.868","0.004","90.261","0.004","2223","1.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","catena-tris(μ-4-methylbenzoato)dysprosium(III)","","- C48 H42 Dy2 O12 -","- C48 H42 Dy2 O12 -","- C96 H84 Dy4 O24 -","2","1","","X. Li; Z.-Y. Zhang; D.-Y. Wang; Y.-Q. Zou","Crystal structure of catena-hexakis(μ-4-methylbenzoato)didysprosium (III), Dy~2~(C~8~H~7~O~2~)~6~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","36","38","","","","0.71073","MoKα","","0.0463","0.0329","","","0.0892","0.0979","","","","","","1.029","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101689","14.061","0.003","7.732","0.002","9.161","0.004","90","0.03","106.85","0.02","90","0.03","953.2","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2-chlorophenylamino)pyridine","","- C11 H9 Cl N2 -","- C11 H9 Cl N2 -","- C44 H36 Cl4 N8 -","4","1","","M. Talja; M. Polamo","Crystal structure of 2-(2-chlorophenylamino)pyridine, C~11~H~9~ClN~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","39","40","","","","0.71073","MoKα","","0.0641","0.0404","","","0.0867","0.0959","","","","","","1.002","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101690","10.705","0.002","14.654","0.003","19.558","0.004","90","","94.74","0.03","90","","3057.6","1.1","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2-[2,6-di(methylethyl)phenylamino]pyridine","","- C17 H22 N2 -","- C17 H22 N2 -","- C136 H176 N16 -","8","1","","M. Polamo; M. Talja; A. J. Piironen","Crystal structure of 2-[2,6-di(methylethyl)phenylamino]pyridine, C~17~H~22~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","41","42","","","","0.71073","MoKα","","0.0972","0.0789","","","0.185","0.1958","","","","","","1.06","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101691","8.855","0.002","14.313","0.003","16.214","0.003","106.73","0.03","102.93","0.03","97.82","0.03","1873.3","0.9","193","1","193","1","","","","","","","","5","P -1","-P 1","2","2-anilidopyridine-phenyl-imidotungsten","trichloro-2-(phenylamido)pyridine-phenyl-imido-tungsten","","- C17 H14 Cl3 N3 W -","- C17 H14 Cl3 N3 W -","- C68 H56 Cl12 N12 W4 -","4","2","","M. Polamo; M. Talja","Crystal structure of trichloro(phenyl-2-pyridylamido)phenylimidotungsten (VI), WCl~3~(C~6~H~5~N)(C~11~H~9~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","43","44","","","","0.71073","MoKα","","0.0594","0.0443","","","0.1081","0.1129","","","","","","1.046","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101692","8.2341","0.0015","10.4212","0.0019","9.3945","0.0017","90","","105.366","0.003","90","","777.3","0.2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-aminomethylepyridine-nitrate","","- C6 H9 N3 O3 -","- C6 H9 N3 O3 -","- C24 H36 N12 O12 -","4","1","","A. R. Mahjoub; A. Morsali; S. Nouryan Aval","Crystal structure of pyridyl-2-methylammonium nitrate, (C~6~H~9~N~2~) NO~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","45","46","","","","0.71073","MoKα","","0.051","0.0442","","","0.0939","0.0973","","","","","","0.986","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101693","11.3746","0.0015","15.383","0.0018","13.0256","0.0017","90","","94.718","0.002","90","","2271.4","0.5","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","chlorobis(1,10-phenanthroline)zinc(II) perchorate monohydrate","","- C24 H18 Cl2 N4 O5 Zn -","- C24 H18 Cl2 N4 O5 Zn -","- C96 H72 Cl8 N16 O20 Zn4 -","4","1","","A. R. Mahjoub; A. Morsali; Z. Talaei; A. Hosseinian","Crystal structure of chlorobis(1,10-phenanthroline)zinc(II) perchorate monohydrate, [ZnCl(C~12~H~8~N~2~)~2~]ClO~4~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","47","48","","","","0.71073","MoKα","","0.0852","0.0478","","","0.0943","0.1031","","","","","","1.087","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101694","14.8163","0.0001","16.1125","0.0001","20.1823","0.0001","92.7499","0.0003","96.5942","0.0003","111.648","0.0002","4427.28","0.05","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","tri[potassium([2.2.2]crypt)]nonastannide ethylenediamine hemisolvate","","- C55 H112 K3 N7 O18 Sn9 -","- C55 H112 K3 N7 O18 Sn9 -","- C110 H224 K6 N14 O36 Sn18 -","2","1","","L. Yong; S. D. Hoffmann; T. F. Fässler","Crystal structure of tris[([2.2.2]crypt)potassium] nonastannide ethylenediamine hemisolvate, [K(C~18~H~36~N~2~O~6~)]~3~Sn~9~ · ½C~2~H~8~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","49","52","","","","0.71073","MoKα","","0.0528","0.0391","","","0.1015","0.1064","","","","","","1.056","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101695","15.4208","0.0001","16.2851","0.0001","25.94","0.0002","80.2284","0.0003","79.1115","0.0003","63.2406","0.0002","5685.23","0.07","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","[K([2.2.2]crypt)]4[Sn9Mo(CO)3](C2H8N2)2","","- C79 H160 K4 Mo N12 O27 Sn9 -","- C79 H160 K4 Mo N12 O27 Sn9 -","- C158 H320 K8 Mo2 N24 O54 Sn18 -","2","1","","L. Yong; S. D. Hoffmann; T. F. Fässler","Crystal structure of tetrakis[([2.2.2]crypt)potassium]tricarbonylmolybdenum (0) nonastannide ethylenediamine disolvate, [K(C~18~H~36~O~6~N~2~)] ~4~[Mo(CO)~3~Sn~9~] · 2C~2~H~8~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","53","57","","","","0.71073","MoKα","","0.0349","0.0272","","","0.0638","0.0666","","","","","","1.058","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101696","24.714","0.005","7.3303","0.0014","11.98","0.002","90","","90","","90","","2170.3","0.7","120","2","120","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","N-4-Nitrophenyl phosphoramidic acid dimethyl ester","","- C8 H11 N2 O5 P -","- C8 H11 N2 O5 P -","- C64 H88 N16 O40 P8 -","8","1","","K. Gholivand; Z. Shariatinia; M. Pourayoubi","Refinement of the crystal structure of N-4-nitrophenylphosphoramidic acid dimethyl ester, (CH~3~O)~2~PONHC~6~H~4~NO~2~, at 120 K","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","65","66","","","","0.71073","MoKα","","0.0705","0.0537","","","0.1224","0.1284","","","","","","0.984","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101697","7.914","0.0001","16.509","0.0003","10.522","0.0002","90","","92.484","0.0012","90","","1373.43","0.04","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","cyclo(2-hydroxy-i-valeryl-isoleucyl-2-hydroxy-i-valeryl-alanyl-threonyl) dihydrate","","- C23 H43 N3 O10 -","- C23 H43 N3 O10 -","- C46 H86 N6 O20 -","2","1","","A. Jegorov; V. Havlícek; M. Husák; B. Kratochvíl; I. Císarová; J. Satke; M. Zabka","Crystal structure of cyclo(2-hydroxy-i-valeryl-isoleucyl-2-hydroxy- i-valeryl-alanyl-threonyl) dihydrate, C~23~H~39~N~3~O~8~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","113","115","","","","0.71073","MoKα","","0.0296","0.0252","","0.0327","0.0279","0.0279","","","","","","1.1408","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101698","8.3073","0.0008","17.07","0.002","16.176","0.002","90","","95.566","0.008","90","","2283","0.4","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","bis[potassium(18-crown-6)] hexathiodiphosphate(V) acetonitrile disolvate","","- C28 H54 K2 N2 O12 P2 S6 -","- C28 H54 K2 N2 O12 P2 S6 -","- C56 H108 K4 N4 O24 P4 S12 -","2","0.5","","Gjikaj, M.; Adam, A.; Duewel, M.; Brockner, W.","Crystal structure of bis[(18-crown-6)potassium] hexathiodiphosphate(V) acetonitrile disolvate, [K(C~12~H~24~O~6~)]~2~(P~2~S~6~) · 2CH~3~CN","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","67","68","","","","0.71073","MoKα","","0.0779","0.0488","","","0.0832","0.0898","","","","","","1.1","","","","has coordinates","187017","2020-10-21","18:00:00",""
"8101699","8.2384","0.0008","10.1299","0.0009","12.9685","0.0012","102","0.002","101.049","0.002","113.453","0.001","924.65","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis[diaqua(1,10-phenanthroline)(μ-4-sulfobenzoato)cadmium(II)]","","- C38 H32 Cd2 N4 O14 S2 -","- C38 H32 Cd2 N4 O14 S2 -","- C38 H32 Cd2 N4 O14 S2 -","1","0.5","","S.-R. Fan; L.-P. Zhang; H.-P. Xiao; G.-Q. Cai; L.-G. Zhu","Crystal structure of bis[diaqua(1,10-phenanthroline)(μ-4-sulfobenzoato) cadmium(II)], [Cd(H~2~O)~2~(C~12~H~8~N~2~)(C~7~H~4~O~5~S)]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","69","70","","","","0.71073","MoKα","","0.0533","0.0518","","","0.0995","0.1001","","","","","","1.261","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101700","19.6794","0.0005","20.7759","0.0006","12.6899","0.0003","90","","90","","90","","5188.4","0.2","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","pentafluorophenyl ferrocene","","- C16 H9 F5 Fe -","- C16 H9 F5 Fe -","- C256 H144 F80 Fe16 -","16","1","","K. Boubekeur; J.-L. Syssa-Magalé; P. Palvadeau; B. Schöllhorn","Crystal structure of pentafluorophenyl ferrocene, Fe(C~5~H~5~)(C~11~H~4~F~5~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","71","72","","","","0.71073","MoKα","","0.0963","0.0423","","","0.0781","0.0953","","","","","","1.023","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101701","8.5229","0.0017","9.5084","0.0019","10.709","0.002","95.55","0.03","91.46","0.03","92.36","0.03","862.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis[mue-chloro(2,2'-bipyridine-N,N')(2-chloro-benzoato)lead(II)]","","- C17 H12 Cl2 N2 O2 Pb -","- C17 H12 Cl2 N2 O2 Pb -","- C34 H24 Cl4 N4 O4 Pb2 -","2","1","","B.-S. Zhang","Crystal structure of bis[μ-chloro(2,2'-bipyridine-N,N')(μ- 2-chlorobenzoato)lead(II)], [Pb(Cl)(C~10~H~8~N~2~)(ClC~6~H~4~COO)] ~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","73","74","","","","0.71073","MoKα","","0.0334","0.0253","","","0.0548","0.0565","","","","","","1.028","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101702","9.4313","0.0019","10.95","0.002","11.609","0.002","80.9","0.03","84.41","0.03","73.36","0.03","1132.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(1,10-phenanthroline-N,N')bis(2-fluorobenzoato)lead(II)","","- C26 H16 F2 N2 O4 Pb -","- C26 H16 F2 N2 O4 Pb -","- C52 H32 F4 N4 O8 Pb2 -","2","1","","B.-S. Zhang; X.-R. Zeng; Y.-Y. Yu; X.-N. Fang; C.-F. Huang","Crystal structure of (1,10-phenanthroline-N,N')bis(2-fluorobenzoato) lead(II), Pb(FC~6~H~4~COO)~2~(C~12~H~8~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","75","76","","","","0.71073","MoKα","","0.0414","0.0346","","","0.0948","0.0984","","","","","","1.036","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101703","8.181","0.001","11.604","0.002","10.193","0.001","90","","101.59","0.01","90","","947.9","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","ethyl (3aR,4R,5R,6R,7aR)-4,5-diacetoxy-6-acetoxymethyl- 2-oxy-3a,5,6,7a-tetrahydro-4H-pyrano[3,2-d]isoxazole-3-carboxylate","","- C16 H21 N O11 -","- C16 H21 N O11 -","- C32 H42 N2 O22 -","2","1","","K. Peters; E.-M. Peters; B. G. Kim; T. Linker","Crystal structure of ethyl (3aR,4R,5R,6R,7aR)-4,5-diacetoxy-6-acetoxymethyl- 2-oxy-3a,5,6,7a-tetrahydro-4H-pyrano[3,2-d]isoxazole-3-carboxylate, C~16~H~21~NO~11~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","21","22","","","","0.71073","MoKα","","0.0716","0.068","","","0.1721","0.177","","","","","","1.192","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101704","9.8202","0.0003","8.4511","0.0004","18.0106","0.0007","90","","96.528","0.002","90","","1485.04","0.1","233","2","233","2","","","","","","","","5","P 1 21 1","P 2yb","4","","17-(cyclopropylmethyl)-6,7-didehydro-4,5α-epoxy-3-hydroxy-14β-(3- phenylpropyloxy)indolo[2,3:6,7]morphinan hydroiodide","","- C35 H37 I N2 O3 -","- C35 H37 I N2 O3 -","- C70 H74 I2 N4 O6 -","2","1","","F. Schüllner; G. Laus; K. Wurst; H. Schmidhammer","Crystal structure of 17-(cyclopropylmethyl)-6,7-didehydro-4,5α- epoxy-3-hydroxy-14β-(3-phenylpropyloxy)indolo[2,3:6,7]morphinan hydroiodide, (C~35~H~37~N~2~O~3~)I","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","77","78","","","","0.71073","MoKα","","0.0337","0.0304","","","0.0659","0.068","","","","","","1.078","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101705","11.179","0.001","11.907","0.001","14.761","0.002","88.94","0.01","78.8","0.01","64.14","0.01","1729.5","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,2-bis[bis(trimethylsilyl)amino]-1,2-dimethyl-1,2-diphenyl-disilane","","- C26 H52 N2 Si6 -","- C26 H52 N2 Si6 -","- C52 H104 N4 Si12 -","2","1","","E. Popowski; I. Rietz; H. Reinke; M. Köckerling","Crystal structure of 1,2-bis[bis(trimethylsilyl)amino]-1,2-dimethyl- 1,2-diphenyl-disilane, [{[(CH~3~)~3~Si]~2~N}(CH~3~)(C~6~H~5~)Si]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","83","84","","","","0.71073","MoKα","","0.1331","0.0683","","","0.1486","0.1801","","","","","","1.009","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101706","7.246","0.002","9.134","0.002","30.518","0.003","90","","90","","90","","2019.8","0.7","296","","296","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C7 H11 Cl N O4 P -","- C7 H11 Cl N O4 P -","- C56 H88 Cl8 N8 O32 P8 -","8","1","","H. Dhaouadi; H. Marouani; M. Rzaigui","Crystal structure of 4-chlorobenzylammonium dihydrogenmonophosphate, (ClC~7~H~6~NH~3~)~H2~PO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","135","136","","","","0.5608","AgKα","","0.0586","0.059","","0.078","","0.078","","","1.96","","","1.96","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101707","7.553","0.003","9.381","0.004","11.071","0.004","66.506","0.005","79.991","0.005","82.466","0.005","706.8","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","hexaaqua-bis{2-[N-(4-pyridylcarbonyl)hydrazido]propionato}dimanganese(II) dihydrate","","- C9 H17 Mn N3 O8 -","- C9 H17 Mn N3 O8 -","- C18 H34 Mn2 N6 O16 -","2","1","","Z.-P. Kong; R.-L. Bao; X.-G. Zhou; Z. Pang; L. Jiang; Z.-X. Chen; B. Yue","Crystal structure of hexaaquabis{2-[N-(4-pyridylcarbonyl)hydrazido] propionato}dimanganese(II) tetrahydrate, Mn~2~(H~2~O)~6~(C~9~H~7~N~3~O~3~) ~2~ · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","85","86","","","","0.71073","MoKα","","0.062","0.0451","","","0.1003","0.108","","","","","","1.049","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101708","26.759","0.005","26.759","0.005","7.431","0.002","90","","90","","120","","4608.1","1.7","300","2","300","2","","","","","","","synthetic starting from a natural product","5","R 3 :H","R 3","146","quinineborane ethanol hemisolvate","(1S,3R,4S,8S,9R)-1N-boranyl-6'-methoxy-cinchonan-9-ol ethanol hemisolvate","","- C21 H30 B N2 O2.5 -","- C21 H30 B N2 O2.5 -","- C189 H270 B9 N18 O22.5 -","9","1","","R. Wartchow; S. Roeper; H. M. R. Hoffmann","Crystal structures of ethanol hemisolvates of (1S,3R,4S,8S,9R)-1N-boranyl-6'- methoxy-cinchonan-9-ol, C~20~H~27~BN~2~O~2~ · ½C~2~H~5~OH, and (1S,3S,4S,8S,9R)-1N-boranyl-10,11-didehydro-6'-methoxy-cinchonan-9-ol, C~20~H~25~BN~2~O~2~ · ½C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","89","92","","","","0.71073","MoKα","","0.0656","0.0412","","0.0979","","0.0942","","","1.162","","","1.419","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101709","26.465","0.006","26.465","0.006","7.375","0.002","90","","90","","120","","4473.4","1.9","300","2","300","2","","","","","","","synthetic starting from a natural product","5","R 3 :H","R 3","146","10,11-Didehydroquinineborane ethanol hemisolvate","(1S,3S,4S,8S,9R)-1N-Boranyl-10,11-didehydro-6'-methoxy-cinchonan-9-ol ethanol hemisolvate","","- C21 H28 B N2 O2.5 -","- C21 H28 B N2 O2.5 -","- C189 H252 B9 N18 O22.5 -","9","1","","R. Wartchow; S. Roeper; H. M. R. Hoffmann","Crystal structures of ethanol hemisolvates of (1S,3R,4S,8S,9R)-1N- boranyl-6'-methoxy-cinchonan-9-ol, C~20~H~27~BN~2~O~2~ · ½C~2~H~5~OH, and (1S,3S,4S,8S,9R)-1N-boranyl-10,11-didehydro-6'-methoxy- cinchonan-9-ol, C~20~H~25~BN~2~O~2~ · ½C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","89","92","","","","0.71073","MoKα","","0.0871","0.0391","","0.0654","","0.062","","","1.088","","","1.475","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101710","13.0064","0.0002","11.6547","0.0002","18.9931","0.0004","90","","90.542","0.001","90","","2878.95","0.09","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","ditetrabutylammonium tetradecabromohexamolybdate","","- C32 H72 Br14 Mo6 N2 -","- C32 H72 Br14 Mo6 N2 -","- C64 H144 Br28 Mo12 N4 -","2","0.5","","K. Kirakci; S. Cordier; T. Roisnel; S. Golhen; C. Perrin","Crystal structure of bis(tetrabutylammonium) tetradecabromohexamolybdate, [(C~4~H~9~)~4~N]~2~[Mo~6~Br~14~], at 100 K and 293 K","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","116","118","","","x-ray","0.71069","MoKα","","","0.0564","","","","0.1516","","","","","","1.072","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101711","13.211","0.0002","11.853","0.0002","18.928","0.0004","90","","90.843","0.001","90","","2963.61","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(tetrabutylammonium) tetradecabromohexamolybdate","","- C32 H72 Br14 Mo6 N2 -","- C32 H72 Br14 Mo6 N2 -","- C64 H144 Br28 Mo12 N4 -","2","0.5","","K. Kirakci; S. Cordier; T. Roisnel; S. Golhen; C. Perrin","Crystal structure of bis(tetrabutylammonium) tetradecabromohexamolybdate, [(C~4~H~9~)~4~N]~2~[Mo~6~Br~14~], at 100 K and 293 K","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","116","118","","","x-ray","0.71069","MoKα","","0.0972","0.0382","","","0.0574","0.0719","","","","","","1.017","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101712","8.8812","0.0005","20.295","0.0012","14.3945","0.0008","90","","107.882","0.001","90","","2469.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N-phthaloylpicoloylhydrazide","","- C14 H9 N3 O3 -","- C14 H9 N3 O3 -","- C112 H72 N24 O24 -","8","2","","L.-X. Shi; W.-S. Wu; J.-C. Dai; J.-M. Lin","Crystal structure of N,N-phthaloylpicoloylhydrazide, C~14~H~9~N~3~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","93","94","","","","0.71073","MoKα","","0.0664","0.0422","","","0.1082","0.1231","","","","","","1.045","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101713","23.241","0.003","23.241","0.003","17.08","0.003","90","","90","","120","","7990","2","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","N,O-(1-methyl-3-oxobutyliden)-N',N""-(1-methyl-2-isonitroso- 3-oxo-3-phenyl-propyliden)ethylenediaminenickel(II)","","- C17 H19 N3 Ni O3 -","- C51 H57 N9 Ni3 O9 -","- C306 H342 N54 Ni18 O54 -","6","0.333333","","Y.-L. Feng; G.-J. Zhang","Crystal structure of N,O-(1-methyl-3-oxobutyliden)-N',N""-(1-methyl- 2-isonitroso-3-oxo-3-phenyl-propyliden)ethylenediaminenickel(II), Ni(C~17~H~19~N~3~O~3~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","97","98","","","","0.71073","MoKα","","0.1644","0.0883","","","0.205","0.243","","","","","","1.022","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101714","7.2466","0.0006","14.2417","0.0011","14.5062","0.0011","90","","90","","90","","1497.1","0.2","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","2,6-Lutidine hydrochloride","2,6-dimethylpyridinium hydrochloride","","- C7 H10 Cl N -","- C7 H10 Cl N -","- C56 H80 Cl8 N8 -","8","1","","H. Nuss; J. Nuss; M. Jansen","Crystal structure of 2,6-dimethylpyridinium hydrochloride, (C~7~H~10~N)Cl","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","95","96","","","","0.71073","MoKα","","0.0665","0.0489","","","0.1233","0.1366","","","","","","1.08","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101715","7.7843","0.0016","21.977","0.004","11.129","0.002","90","","90","","90","","1903.9","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","triaquabis(vanillin-O,O')nitritogadolinium(III)","","- C16 H20 Gd N O11 -","- C16 H20 Gd N O11 -","- C64 H80 Gd4 N4 O44 -","4","0.5","","G.-L. Zhao; Y.-L. Feng","Crystal structure of triaquabis(vanillin-O,O')nitritogadolinium(III), Gd(H~2~O)~3~(C~8~H~7~O~3~)~2~(NO~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","99","100","","","","0.71073","MoKα","","0.0197","0.0183","","","0.0476","0.0483","","","","","","1.043","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101716","24.348","0.004","8.088","0.002","7.623","0.004","90","","90","","90","","1501.2","0.9","296","","296","","","","","","","","","5","P c a 21","P 2c -2ac","29","2-ethyl-6-methylanilinium dihydrogenphosphate phosphoric acid","","","- C9 H19 N O8 P2 -","- C9 H19 N O8 P2 -","- C36 H76 N4 O32 P8 -","4","1","","Belam, W.; Khedhiri, L.; Daoud, A.","Crystal structure of 2-ethyl-6-methylanilinium dihydrogenphosphate phosphoric acid, (C~9~H~14~N)H~2~PO~4~ · H~3~PO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","147","148","10.1524/ncrs.2005.220.14.157","","","0.5608","AgKα","","0.0386","0.039","","","","0.049","","","1.325","","","1.32","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101717","8.4352","0.0016","10.4102","0.0011","13.802","0.002","106.367","0.014","99.843","0.016","96.037","0.018","1130.6","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","N,N,N',N'-tetraphenyl-1,4-benzenediamine","","- C30 H24 N2 -","- C30 H24 N2 -","- C60 H48 N4 -","2","1","","H.-G. Zhang; W.-T. Yu; L. Wang; J.-X. Yang; Z. Liu; X.-T. Tao; M.-H. Jiang","Crystal structure of N,N,N',N'-tetraphenyl-1,4-benzenediamine, C~30~H~24~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","101","102","","","","0.71073","MoKα","","0.15","0.0501","","","0.0952","0.1317","","","","","","0.889","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101718","6.465","0.003","10.658","0.004","11.08","0.004","85.153","0.006","78.525","0.006","79.65","0.006","735.1","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","5-phenylmethylidene-3-(2'-fluorobenzyl)-2-thio-4-imidazolidinone","","- C17 H13 F N2 O S -","- C17 H13 F N2 O S -","- C34 H26 F2 N4 O2 S2 -","2","1","","F.-L. Yang; S.-J. Cao; Z.-J. Liu; M.-W. Ding","Crystal structure of 5-phenylmethylidene-3-(2'-fluorobenzyl)-2-thio- 4-imidazolidinone, C~17~H~13~FN~2~OS","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","119","120","","","","0.71073","MoKα","","","0.038","","","","0.0951","","","","","","1.068","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101719","10.8683","0.0006","11.5289","0.0007","13.0918","0.0007","70.242","0.001","70.51","0.001","70.808","0.001","1411.59","0.14","294","","294","","","","","","","","","5","P -1","-P 1","2","","tetrakis(isopropyldiphenylphosphine)di(μ-iodo)dicopper(I)","","- C60 H68 Cu2 I2 P4 -","- C60 H68 Cu2 I2 P4 -","- C60 H68 Cu2 I2 P4 -","1","0.5","","M. Fettouhi; Z. S. Seddigi","Crystal structure of tetrakis(isopropyldiphenylphosphine)di(μ- iodo)dicopper(I), Cu~2~I~2~(PC~17~H~17~)~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","137","138","","","","0.71073","MoKα","","0.0373","0.0328","","","0.0826","0.0842","","","","","","1.002","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101720","10.898","0.0007","23.4492","0.0017","14.8137","0.001","90","","110.57","0.03","90","","3544.3","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","aquabis(1,10-phenanthroline)-μ-(1,1'-biphenyl-2,2'- dicarboxylato)dinitratodilead(II)","","- C38 H26 N6 O11 Pb2 -","- C152 H104 N24 O44 Pb8 -","- C152 H104 N24 O44 Pb8 -","1","0.25","","Miao, Q.; Zhao, Y.-J.; Cheng, Y.-Q.; Hu, M.-L.","Crystal structure of aquabis(1,10-phenanthroline)-μ-(1,1'-biphenyl-2,2'- dicarboxylato)dinitratodilead(II), Pb~2~(C~12~H~8~N~2~)~2~(C~14~H~8~O~4~) (H~2~O)(NO~3~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","159","161","","","","0.71073","MoKα","","0.0419","0.029","","","0.0646","0.0702","","","","","","0.989","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101721","8.9752","0.0007","10.3522","0.0009","12.0167","0.001","95.275","0.001","94.078","0.002","93.317","0.002","1106.63","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","aqua(1,10-phenanthroline)(2-amino-1,4-benzenedicarboxylato)copper(II) N,N'-dimethylformamide solvate","","- C23 H22 Cu N4 O6 -","- C23 H22 Cu N4 O6 -","- C46 H44 Cu2 N8 O12 -","2","1","","Ma, A.-Q.; Cai, G.-Q.; Zhu, L.-G.","Crystal structure of aqua(1,10-phenanthroline)(2-amino-1,4- benzenedicarboxylato)copper(II) dimethylformamide solvate, Cu(H~2~O)(C~12~H~8~N~2~)(C~8~H~5~NO~4~) · (CH~3~)~2~NCHO","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","139","140","","","","0.71073","MoKα","","0.0453","0.0408","","","0.106","0.108","","","","","","1.075","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101722","10.0098","0.0002","8.7334","0.0002","19.445","0.0006","90","","97.046","0.001","90","","1687.04","0.07","173","0.2","173","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Ind*(CO)3MoRu(CO)2Cp","(η^5^-indenyl) (η^5^-cyclopentadienyl) pentacarbonylcarbonyl molybdenum ruthenium","","- C19 H12 Mo O5 Ru -","- C19 H12 Mo O5 Ru -","- C76 H48 Mo4 O20 Ru4 -","4","1","","T. Straub; M. Nissinen","Crystal structure of (η^5^-indenyl) (η^5^-cyclopentadienyl) pentacarbonyl molybdenum ruthenium (Mo-Ru), (C~5~H~5~)(CO)~2~MoRu (CO)~3~(C~9~H~7~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","133","134","","","","0.71073","MoKα","","0.0262","0.0229","","","0.055","0.0565","","","","","","1.043","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101723","8.4763","0.0007","13.135","0.002","15.418","0.003","83.99","0.02","76.596","0.013","86.558","0.012","1659.5","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","dichloro-triethylphosphine-12-(3,4-dimethoxyphenyl)-4,5-dimethoxy- 11,13-diaza-tricyclo[7.3.1.0^2,7^]trideca-2(7),3,5-trien-10-one- palladium(II)","","- C29 H45 Cl2 N2 O6 P Pd -","- C29 H45 Cl2 N2 O6 P Pd -","- C58 H90 Cl4 N4 O12 P2 Pd2 -","2","1","","B. Miller; M. Rüth; K. Polborn; W. Steglich; W. Beck","Crystal structure of dichlorotriethylphosphine{12- (3,4-dimethoxyphenyl)- 4,5-dimethoxy-11,14-diaza-tricyclo[7.4.1.0^2,7^]tetradeca-2(7),3,5- trien-10-one}palladium(II) methanol solvate, PdCl~2~[P(C~2~H~5~)~3~] (C~22~H~26~N~2~O~5~) · CH~3~OH","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","145","146","","","","0.71073","MoKα","","0.043","0.0336","","0.0865","0.0803","","","","1.044","1.054","1.054","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101724","9.8316","0.0002","10.0682","0.0002","22.5002","0.0005","90","","90","","90","","2227.22","0.08","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","aqua(2,2'-bipyridine-N,N')bis(2-fluorobenzoato)cadmium(II)","","- C24 H18 Cd F2 N2 O5 -","- C24 H18 Cd F2 N2 O5 -","- C96 H72 Cd4 F8 N8 O20 -","4","1","","Zhang, B.-S.; Zeng, X.-R.; Fang, X.-N.; Huang, C.-F.","Crystal structure of aqua(2,2'-bipyridine-N,N')bis(2-fluorobenzoato) cadmium(II), Cd(H~2~O)(C~10~H~8~N~2~)(C~7~H~4~FO~2~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","141","142","","","","0.71073","MoKα","","0.1008","0.0271","","","0.0656","0.0692","","","","","","1.005","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101725","10.1931","0.0008","11.9627","0.0007","20.2987","0.0015","90","","95.131","0.004","90","","2465.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,1'-bis(4-hydroxy-pyrimid-6-on-2-thion-5-yl)-1""-(4-nitrophenyl)methane pyridinium salt methanol solvate monohydrate","","- C21 H22 N6 O8 S2 -","- C21 H22 N6 O8 S2 -","- C84 H88 N24 O32 S8 -","4","1","","K. Van Hecke; P. Nockemann; L. Van Meervelt","Crystal structure of pyridinium 1,1'-bis(4-hydroxy- pyrimid-6-on-2- thion-5-yl)-1''-(4-nitrophenyl)methane methanol solvate monohydrate, (C~5~H~6~N)(C~15~H~10~N~5~O~6~S~2~) · CH~3~OH · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","155","156","","","","1.54178","CuKα","","0.1058","0.0791","","","0.2078","0.2292","","","","","","1.082","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101726","5.117","0.005","8.054","0.005","11.9","0.005","75.44","0.005","80.553","0.005","78.135","0.005","461.2","0.6","100","2","100","2","","","","","","","","3","P -1","-P 1","2","phenoxy-2-acetic 2,4-dimethyl acid","","","- C10 H12 O3 -","- C10 H12 O3 -","- C20 H24 O6 -","2","1","","Adohi-Krou, A.; Coulibaly, V.; Sissouma, D.; Tenon, A. J.; Porcher, F.","Crystal structure of 2,4-dimethyl-phenoxy-2-acetic acid, C~10~H~12~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","157","158","","","","0.71069","MoKα","","0.0691","0.0639","","","0.1742","0.1825","","","","","","1.052","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101727","23.318","0.005","12.097","0.002","19.446","0.004","90","","114.34","0.03","90","","4998","2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","tris(1,10-phenanthroline-N,N')iron(II) suberate tetradecahydrate","","- C44 H64 Fe N6 O18 -","- C44 H64 Fe N6 O18 -","- C176 H256 Fe4 N24 O72 -","4","0.5","","Z.-F. Li; Y.-Q. Zheng","Crystal structure of tris(1,10-phenanthroline-N,N')iron(II) suberate tetradecahydrate, [Fe(C~12~H~8~N~2~)~3~](C~8~H~12~O~4~) · 14H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","162","164","","","","0.71073","MoKα","","0.0765","0.0488","","","0.1153","0.1284","","","","","","1.011","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101728","10.725","0.003","14.328","0.003","23.814","0.006","90","","90","","90","","3659.4","1.6","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","cis-4-methyl-2,4,6-triphenyl-4H-thiopyran-1-oxide","","- C24 H20 O S -","- C24 H20 O S -","- C192 H160 O8 S8 -","8","2","","Jafarpour, F.; Pirelahi, H.","Crystal structures of cis- and trans-4-methyl-2,4,6-triphenyl-4H-thiopyran- 1-oxide, C~24~H~20~OS","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","165","168","","","","0.71073","MoKα","","0.0752","0.0542","","","0.0925","0.0983","","","","","","1.006","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101729","10.879","0.016","16.9","0.02","13.211","0.018","90","","110.47","0.02","90","","2276","5","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Pd{Na[(C~15~H~22~O~5~)(H~2~O)]}~2~(SCN)~4~","bis(μ-thiocyanato-N,S)bis[aqua-(3-methylbenzo-15-crown-5)sodium]bis (thiocyanato-S)palladium(II)","","- C34 H48 N4 Na2 O12 Pd S4 -","- C34 H48 N4 Na2 O12 Pd S4 -","- C68 H96 N8 Na4 O24 Pd2 S8 -","2","0.5","","M.-J. Niu; D.-C. Li; J.-M. Dou; D.-Q. Wang","Crystal structure of bis(μ-thiocyanato-N,S)bis[aqua-(3-methylbenzo- 15-crown-5)sodium]bis(thiocyanato-S)-palladium(II), [Na(C~15~H~22~O~5~) (H~2~O)]~2~[Pd(SCN)~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","185","187","","","","0.71073","MoKα","","0.0882","0.0427","","","0.0788","0.0913","","","","","","0.898","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101730","21.194","0.011","16.814","0.008","13.218","0.007","90","","105.33","0.007","90","","4543","4","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","bis(μ-thiocyanato-N,S)bis[aqua-(3-methylbenzo-15-crown-5)sodium]bis (thiocyanato-S)platinum(II)","","- C34 H48 N4 Na2 O12 Pt S4 -","- C34 H48 N4 Na2 O12 Pt S4 -","- C136 H192 N16 Na8 O48 Pt4 S16 -","4","1","","M.-J. Niu; D.-C. Li; J.-M. Dou; D.-Q. Wang","Crystal structure of bis(μ-thiocyanato-N,S)bis[aqua(3-methylbenzo- 15-crown-5)sodium]bis(thiocyanato-S)platinum(II), [Na(C~15~H~22~O~5~) (H~2~O)]~2~[Pt(SCN)~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","188","190","","","","0.71073","MoKα","","0.0605","0.0319","","","0.0635","0.0722","","","","","","1.002","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101731","10.53","0.004","11.955","0.005","13.698","0.006","85.036","0.007","74.511","0.006","89.404","0.007","1655.4","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","tetranitropalladato(II)tetrakis[(15-crown-5)sodium] tetranitropalladate(II)","","- C40 H80 N8 Na4 O36 Pd2 -","- C40 H80 N8 Na4 O36 Pd2 -","- C40 H80 N8 Na4 O36 Pd2 -","1","0.5","","Y. Liu; D.-C. Li; J.-M. Dou; D.-Q. Wang","Crystal structure of tetranitropalladato(II)tetrakis[(15-crown-5)sodium] tetranitropalladate(II), {[Na(C~10~H~20~O~5~)]~4~Pd(NO~2~)~4~}[Pd (NO~2~)~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","191","193","","","","0.71073","MoKα","","0.1003","0.0618","","","0.1384","0.1519","","","","","","1.001","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101732","7.342","0.002","23.138","0.008","15.896","0.005","90","","99.257","0.006","90","","2665.2","1.4","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","aqua-15-crown-5-sodium bis(1,2-dicyanoethene-1,2-dithiolato-S,S')cuprate(II)","","- C18 H22 Cu N4 Na O6 S4 -","- C18 H22 Cu N4 Na O6 S4 -","- C72 H88 Cu4 N16 Na4 O24 S16 -","4","1","","Feng, S.-C.; Li, D.-C.","Crystal structure of aqua-15-crown-5-sodium bis(1,2-dicyanoethene-1,2- dithiolato-S,S')cuprate(II), [Na(C~10~H~20~O~5~)(H~2~O)][Cu(C~4~N~2~S~2~)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","194","196","","","","0.71073","MoKα","","0.1043","0.0438","","","0.0887","0.1343","","","","","","0.852","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101733","9.703","0.004","13.621","0.006","15.181","0.007","78.287","0.006","77.735","0.006","82.941","0.006","1913.1","1.5","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","bis(15-crown-5)potassium bis(1,2-dicyanoethene-1,2-dithiolate-S,S')aurate(I)","","- C28 H40 Au K N4 O10 S4 -","- C28 H40 Au K N4 O10 S4 -","- C56 H80 Au2 K2 N8 O20 S8 -","2","1","","Niu, M.-J.; Kong, L.-Q.; Li, D.-C.; Dou, J.-M.","Crystal structure of bis(15-crown-5)potassium bis(1,2-dicyanoethene- 1,2-dithiolate-S,S')aurate(I), [K(C~10~H~20~O~5~)~2~][Au(C~4~N~2~S~2~)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","327","329","","","","0.71073","MoKα","","0.0564","0.04","","","0.1003","0.1084","","","","","","1.052","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101734","12.241","0.007","12.583","0.008","12.585","0.008","88.711","0.009","65.351","0.009","65.629","0.009","1578.4","1.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","bis{[acetonitrile-N-(3,6'-dimethyldibenzo-18-crown-6)]potassium-bis(1,1- dicyanoethenedithiolato-S,S')]nickel(II)","","- C56 H62 K2 N6 Ni O12 S4 -","- C56 H62 K2 N6 Ni O12 S4 -","- C56 H62 K2 N6 Ni O12 S4 -","1","0.5","","D.-C. Li; S.-C. Feng; J.-M. Dou; D.-Q. Wang","Crystal structure of bis[{acetonitrile-N-3,6'-bis(methylbenzo)-18- crown-6}potassium]bis(1,1-dicyanoethene- 2,2-dithiolato-S,S')nickel (II), [{K(C~22~H~28~O~6~)(CH~3~CN)}~2~{Ni(C~4~N~2~S~2~)}~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","330","332","","","","0.71073","MoKα","","0.1097","0.0729","","","0.179","0.2045","","","","","","0.946","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101735","7.859","0.003","7.902","0.003","7.993","0.003","106.786","0.006","95.475","0.005","113.452","0.005","423.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","tetraaquabis(μ-fumarato)oxalatodiyttrium hydrate","","- C5 H7 O8.5 Y -","- C5 H7 O8.5 Y -","- C10 H14 O17 Y2 -","2","1","","X. Li; Y.-Q. Zou","Crystal structure of tetraaquabis(μ~4~-fumarato)- μ~2~- oxalatodiyttrium(III) hydrate, Y~2~(H~2~O)~4~(C~2~O~4~)(C~4~H~2~O~4~) ~2~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","169","170","","","","0.71073","MoKα","","0.0515","0.0474","","","0.1263","0.1295","","","","","","1.062","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101736","10.151","0.0014","28.659","0.004","9.286","0.002","90","","110.175","0.011","90","","2535.7","0.8","293","2","293","2","","","","","","","","5","P 1 c 1","P -2yc","7","","bis(tetra-n-butylammonium)bis(1,3-dithiole-2-thione-4,5-dithiolato)mercury(II)","","- C38 H72 Hg N2 S10 -","- C38 H72 Hg N2 S10 -","- C76 H144 Hg2 N4 S20 -","2","1","","Wang, X.-Q.; Yu, W.-T.; Xu, D.; Li, T.-B.; Wang, Y.-L.; Zhang, G.-H.; Xue, G.; Yang, H.-L.; Ren, Q.","Crystal structure of bis(tetra-n-butylammonium) bis(1,3-dithiole-2- thione-4,5-dithiolato)mercurate(II), [(C~4~H~9~)~4~N]~2~[Hg(C~3~S~5~)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","177","179","","","","0.71073","MoKα","","0.195","0.0727","","","0.1445","0.1942","","","","","","0.967","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101737","8.644","0.001","9.94","0.001","13.915","0.001","74.954","0.007","85.014","0.004","86.633","0.007","1149.4","0.2","293","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H21 F N6 O10 -","- C22 H21 F N6 O10 -","- C44 H42 F2 N12 O20 -","2","1","","R.-D. Hu; Q.-S. Yu","Crystal structure of norfloxacin picrate, (C~16~H~19~FN~3~O~3~)[C~6~H~2~ (NO~2~)~3~O]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","171","172","","","","0.7107","MoKα","","","0.059","","","","0.167","","","","","","1.005","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101738","15.196","0.003","13.43","0.003","7.36","0.0015","90","","97.83","0.03","90","","1488","0.5","120","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-chloro-3-(N-acetyl)phenylamino-1,4-naphthoquinone","","- C18 H12 Cl N O3 -","- C18 H12 Cl N O3 -","- C72 H48 Cl4 N4 O12 -","4","1","","F.-L. Yang; T. Win; S. Bittner","Crystal structure of 2-chloro-3-(N-acetyl)phenylamino- 1,4-naphthoquinone, C~18~H~12~ClNO~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","173","174","","","","0.71073","MoKα","","0.0588","0.042","","","0.0998","0.1091","","","","","","1.041","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101739","12.388","0.002","19.225","0.003","18.534","0.003","90","","90","","90","","4414","1.2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(R,R,R~S~;S,S,S~S~) 4-bromobenzylsulfinylacetic acid N,N-bis-1-(phenylethyl)amide","","- C24 H24 Br N O2 S -","- C24 H24 Br N O2 S -","- C192 H192 Br8 N8 O16 S8 -","8","1","","Jablonska-Pikus, T.; Kosior, J.; Kurys, K.; Koziol, A. E.","Crystal structure of (R,R,R~S~;S,S,S~S~)-4-bromobenzyl-sulfinylacetic acid N,N-bis-1-(phenylethyl)amide, C~24~H~24~BrNO~2~S","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","175","176","","","","1.54178","CuKα","","0.1669","0.0538","","","0.0887","0.1147","","","","","","0.97","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101740","6.894","0.003","9.185","0.002","12.07","0.004","76.01","0.02","88.34","0.02","86.87","0.03","740.4","0.4","173","2","173","2","","","","","","","","5","P 1","P 1","1","R-(-)-clenbuterol","R-(-)-1-(4-amino-3,5-dichloro-phenyl)-2-tert-butylaminoethanol hydrochloride","","- C12 H19 Cl3 N2 O -","- C12 H19 Cl3 N2 O -","- C24 H38 Cl6 N4 O2 -","2","2","","G.-V. Röschenthaler; E. Lork; D. V. Sevenard; W. Greb","Crystal structures of R-(-)- and S-(+)-1-(4-amino-3,5-dichlorophenyl)- 2-tert-butylaminoethanol hydrochloride, (C~12~H~19~Cl~2~N~2~O)Cl","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","180","182","","","","0.71073","MoKα","","0.079","0.0576","","","0.1538","0.1704","","","","","","1.045","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101741","7.048","0.001","7.149","0.001","13.733","0.002","90.73","0.01","90.55","0.01","118.79","0.01","606.27","0.16","293","2","293","2","","","","","","","synthesis","5","P -1","-P 1","2","hexaaquacobalt(II) bis(3-carboxy-4-hydroxy-benzenesulfonate) dihydrate","hexaaquacobalt(II) bis(3-carboxy-4-hydroxy-benzenesulfonate) dihydrate","","- C14 H26 Co O20 S2 -","- C14 H26 Co O20 S2 -","- C14 H26 Co O20 S2 -","1","0.5","","Abdelhak, J.; Namouchi Cherni, S.; Jouini, T.","Crystal structure of hexaaquacobalt(II) bis(3-carboxy-4-hydroxy- benzenesulfonate) dihydrate, [Co(H~2~O)~6~][C~7~H~5~O~3~SO~3~]~2~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","183","184","","","","0.71073","MoKα","","0.0275","0.0254","","","0.0687","0.0699","","","","","","1.161","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101742","27.444","0.006","6.5791","0.0013","16.574","0.003","90","","106.89","0.03","90","","2863.5","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N-4-chloro-benzaldene-1-aminoadamantane","N-(4-chlorobenzylidene)-1-adamantylamine","","- C17 H20 Cl N -","- C17 H20 Cl N -","- C136 H160 Cl8 N8 -","8","1","","Zhao, G.-L.; Feng, Y.-L.","Crystal structure of N-(4-chlorobenzylidene)-1-adamantylamine, C~17~H~20~ClN, a Schiff base","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","197","198","","","","0.71073","MoKα","","0.0523","0.0446","","","0.1191","0.1247","","","","","","1.021","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101743","15.017","0.003","15.107","0.003","10.015","0.002","90","","118.68","0.03","90","","1993.3","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(nitrito-N)(1,10-phenanthroline-N,N')(2,4-pentanedionato-O,O')cobalt(III)","","- C17 H15 Co N4 O6 -","- C17 H15 Co N4 O6 -","- C68 H60 Co4 N16 O24 -","4","0.5","","Y.-L. Feng; H. Lin","Crystal structure of bis(nitrito-N)(1,10-phenanthroline-N,N') (2,4- pentanedionato-O,O')cobalt(III), Co(NO~2~)~2~(C~12~H~8~N~2~)(C~5~H~7~O~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","199","200","","","","0.71069","MoKα","","0.0696","0.0563","","","0.1738","0.1881","","","","","","1.046","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101744","8.014","0.0016","11.822","0.002","15.795","0.003","94.26","0.03","93.87","0.03","98.53","0.03","1471.1","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","tetrachloro-bis(1,10-phenanthroline-N,N')(μ-oxo)diiron(III) trichloromethane solvate","","- C25 H17 Cl7 Fe2 N4 O -","- C25 H17 Cl7 Fe2 N4 O -","- C50 H34 Cl14 Fe4 N8 O2 -","2","1","","Feng, Y.-L.","Crystal structure of bis(1,10-phenanthroline-1κN,κN')-tetrachloro- 1κCl,2κ^3^Cl-μ-oxo-1:2κ^2^O-diiron(III) trichloromethane solvate, [FeCl(C~12~H~8~N~4~)~2~]O(FeCl~3~) · CHCl~3~, a dinuclear iron(III) complex with an unsymmetrical μ-oxo bridge","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","201","202","","","","0.71069","MoKα","","0.0767","0.0659","","","0.1642","0.1714","","","","","","1.054","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101745","7.612","0.004","12.857","0.006","16.753","0.008","111.856","0.006","100.449","0.006","92.35","0.007","1485.9","1.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","cyclo-bis{[(15-crown-5)sodium][1,2-dicyanoethene-1,2-dithiolato-aurate(I)]} 1,2-dichloroethane solvate","","- C46 H44 Au2 Cl2 N8 Na2 O10 S8 -","- C46 H44 Au2 Cl2 N8 Na2 O10 S8 -","- C46 H44 Au2 Cl2 N8 Na2 O10 S8 -","1","0.5","","Song, X.-M.; Li, D.-C.; Wei, J.-F.; Dou, J.-M.","Crystal structure of cyclo-bis{[(benzo-15-crown-5)-sodium] [1,2-dicyanoethene- 1,2-dithiolato-aurate(I)]} 1,2-dichloroethane solvate, {[Na(C~14~H~20~O~5~)] [Au(C~4~N~2~S~2~)~2~]}~2~ · C~2~H~4~Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","231","233","","","","0.71073","MoKα","","0.0384","0.0288","","","0.0475","0.0491","","","","","","1.052","","","","has coordinates","211402","2020-10-21","18:00:00",""
"8101746","9.5259","0.0018","11.078","0.002","17.245","0.003","99.475","0.003","102.564","0.003","102.145","0.003","1693.8","0.5","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","2,6-dithiopurinato-bis[chlorodiphenyltin(IV)] ethanol solvate","","- C31 H28 Cl2 N4 O S2 Sn2 -","- C31 H28 Cl2 N4 O S2 Sn2 -","- C62 H56 Cl4 N8 O2 S4 Sn4 -","2","1","","C.-L. Ma; Y. Shi; R.-F. Zhang","Crystal structure of 2,6-dithiopurinato-bis[chloro-diphenyltin(IV)] ethanol solvate, [(C~6~H~5~)~2~SnCl]~2~(C~5~H~2~N~4~S~2~) · C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","203","204","","","","0.71073","MoKα","","0.0657","0.0389","","","0.1037","0.1248","","","","","","0.996","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101747","11.981","0.002","14.89","0.004","17.239","0.004","90","","90","","90","","3075.4","1.2","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","3-(4-chlorophenyl)-2-[(4-nitro phenyl)imino]-1,3-thiazolan-4-one","","- C15 H10 Cl N3 O3 S -","- C15 H10 Cl N3 O3 S -","- C120 H80 Cl8 N24 O24 S8 -","8","1","","F. Matloubi Moghaddam; L. Hojabri","Crystal structure of 3-(4-chlorophenyl)-2-[(4-nitro-phenyl)imino]- 1,3-thiazolan-4-one, C~15~H~10~ClN~3~O~3~S","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","205","206","","","","0.71073","MoKα","","0.0793","0.0532","","","0.1133","0.123","","","","","","1.012","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101748","9.8053","0.0007","10.9184","0.0008","15.3758","0.0015","90","","90","","90","","1646.1","0.2","293","","293","","","","","","","","IVAX Pharmaceuticals, Czech Republic","4","P 21 21 21","P 2ac 2ab","19","","1-methyl-10α-methoxy-9,10-dihydrolysergol","","- C18 H24 N2 O2 -","- C18 H24 N2 O2 -","- C72 H96 N8 O8 -","4","1","","Cejka, J.; Kratochvíl, B.; Cvak, L.; Jegorov, A.","Crystal structure of 1-methyl-10α-methoxy-9,10-dihydrolysergol, C~18~H~24~N~2~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","207","208","","","","1.5418","CuKα","","0.0368","0.0362","","0.0457","0.0449","0.0449","","","","","","1.0856","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101749","10.22","0.008","13.827","0.011","16.361","0.013","92.442","0.013","95.633","0.014","111.052","0.012","2140","3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","heptaaqua-7-methoxy-4'-hydroxyisoflavone-3'-sulfonato-strontium(II) 7-methoxy-4'-hydroxyisoflavone-3'-sulfonate hexahydrate","","- C32 H48 O27 S2 Sr -","- C32 H48 O27 S2 Sr -","- C64 H96 O54 S4 Sr2 -","2","1","","X.-B. Wang; Z.-T. Zhang","Crystal structure of heptaaqua-7-methoxy-4'-hydroxy-isoflavone-3'- sulfonato-strontium(II) 7-methoxy-4'-hydroxyisoflavone-3'-sulfonate hexahydrate, [Sr(H~2~O)~7~(C~16~H~11~O~4~SO~3~)][C~16~H~11~O~4~SO~3~] · 6H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","223","225","","","","0.71073","MoKα","","0.1356","0.0536","","","0.0962","0.1213","","","","","","0.996","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101750","16.9339","0.0018","10.5113","0.0011","7.2284","0.0007","90","","110.643","0.002","90","","1204","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(mu-chloro)(1,10-phenanthroline)cadmium(II)","","- C12 H8 Cd Cl2 N2 -","- C12 H8 Cd Cl2 N2 -","- C48 H32 Cd4 Cl8 N8 -","4","0.5","","H.-Y. He; Y.-L. Zhou; J. Chen; L.-G. Zhu","Crystal structure of bis(μ-chloro)(1,10-phenanthroline-N,N') cadmium(II), CdCl~2~(C~12~H~8~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","209","210","","","","0.71073","MoKα","","0.0347","0.0293","","","0.0463","0.0477","","","","","","0.925","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101751","11.368","0.002","12.212","0.002","13.944","0.003","110.73","0.03","105.02","0.03","104.02","0.03","1624.7","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis[(2-bromobenzoato)(1,10-phenanthroline-N,N')bis(μ-2-bromobenzoato) holmium(III)]","","- C66 H40 Br6 Ho2 N4 O12 -","- C66 H40 Br6 Ho2 N4 O12 -","- C66 H40 Br6 Ho2 N4 O12 -","1","0.5","","B.-S. Zhang; X.-C. Zhu; Y.-Y. Yu; L. Chen; Z.-B. Chen; Y.-M. Hu","Crystal structure of bis[(1,10-phenanthroline-N,N')-(2-bromobenzoato) bis(μ-2-bromobenzoato)holmium(III)], [Ho(C~12~H~8~N~2~)(BrC~7~H~4~O~2~) ~3~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","211","212","","","","0.71073","MoKα","","0.0718","0.0563","","","0.1598","0.171","","","","","","1.065","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101752","12.284","0.002","17.594","0.003","6.1338","0.0007","90","","94.67","0.01","90","","1321.3","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-1-(1-nitrobutylidene)-2-(2,4-dinitrophenyl)hydrazine","","- C10 H11 N5 O6 -","- C10 H11 N5 O6 -","- C40 H44 N20 O24 -","4","1","","D.-S. Yang","Crystal structure of (E)-1-(1-nitrobutylidene)-2-(2,4-dinitrophenyl)- hydrazine, C~1~0H~11~N~5~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","213","214","","","","0.71073","MoKα","","0.0594","0.0356","","","0.0891","0.0956","","","","","","0.954","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101753","14.794","0.0007","5.461","0.0001","18.042","0.0009","90","","93.812","0.001","90","","1454.39","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","diethyl 2-(1-methyl-5-nitro-1H-imidazol-4-ylmethylene)malonate","","- C12 H15 N3 O6 -","- C12 H15 N3 O6 -","- C48 H60 N12 O24 -","4","1","","M. D. Crozet; M. Giorgi; T. Terme; P. Vanelle","Crystal structure of diethyl 2-(1-methyl-5-nitro-1H-imidazol-4-ylmethylene) malonate, C~12~H~15~N~3~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","217","218","","","x-ray","0.71073","MoKα","","0.0538","0.0453","","","0.1132","0.1206","","","","","","1.05","","","","has coordinates","211332","2020-10-21","18:00:00",""
"8101754","8.017","0.0001","23.673","0.0004","8.83","0.0001","90","","115.759","0.001","90","","1509.29","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diethyl 2-(2-methyl-5-nitrothiazol-4-ylmethylene)malonate","","- C12 H14 N2 O6 S -","- C12 H14 N2 O6 S -","- C48 H56 N8 O24 S4 -","4","1","","M. D. Crozet; M. Giorgi; T. Terme; P. Vanelle","Crystal structure of diethyl 2-(2-methyl-5-nitrothiazol-4-ylmethylene) malonate, C~12~H~14~N~2~O~6~S","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","219","220","","","","0.71073","MoKα","","0.0527","0.0476","","","0.1294","0.1335","","","","","","1.085","","","","has coordinates","211332","2020-10-21","18:00:00",""
"8101755","10.748","0.001","16.038","0.001","18.019","0.002","90","","90","","90","","3106.1","0.5","273.2","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","μ~3~-chloro-μ~3~-hydroxo-tri(μ-chloro)- tris[tetramethylethylenediaminenickel(II)] chloride","","- C18 H49 Cl5 N6 Ni3 O -","- C18 H49 Cl5 N6 Ni3 O -","- C72 H196 Cl20 N24 Ni12 O4 -","4","1","","K. Miyamoto; R. Koizumi; E. Horn; Y. Fukuda","Refinement of the crystal structure of μ3-chloro-μ3- hydroxo-tris(μ-chloro)-tris[tetramethylethylenediamine-nickel (II)] chloride, {[Ni(C~6~H~16~N~2~)]~3~Cl~4~OH}Cl","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","226","228","","","","0.7107","MoKα","","","0.0432","","","","0.0492","","","","","","0.136","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101756","6.3676","0.0002","9.8475","0.0004","15.2298","0.0006","90","","93.015","0.002","90","","953.66","0.06","228","2","228","2","","","","","","","","4","P 1 c 1","P -2yc","7","","iodoferrocene","","- C10 H9 Fe I -","- C10 H9 Fe I -","- C40 H36 Fe4 I4 -","4","2","","G. Laus; K. Wurst; W. Stolz; H. Schottenberger","Crystal structure of iodoferrocene, Fe(C~5~H~4~I)(C~5~H~5~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","229","230","","","","0.71073","MoKα","","0.0202","0.0184","","","0.0375","0.0382","","","","","","1.082","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101757","7.924","0.002","13.2874","0.0012","16.138","0.004","90","","90","","90","","1699.2","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","triphenyl thiophosphate","","- C18 H15 O3 P S -","- C18 H15 O3 P S -","- C72 H60 O12 P4 S4 -","4","1","","J. Clade; M. Jansen","Crystal structures of triphenyl thiophosphate and selenophosphate, (C~6~H~5~)~3~PO~3~X (X = S, Se)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","234","236","","","","0.71073","MoKα","","0.0426","0.0269","","0.0974","0.0738","","","","1.325","1.107","1.107","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101758","8.1012","0.0009","21.113","0.002","14.014","0.002","90","","90","","90","","2397","0.5","273.2","","","","","","","","","","","6","P c c n","-P 2ab 2ac","56","","cis-dichlorobis(5-methylisoxazole)platinum(II)","","- C8 H10 Cl2 N2 O2 Pt -","- C8 H10 Cl2 N2 O2 Pt -","- C64 H80 Cl16 N16 O16 Pt8 -","8","1","","E. Horn; A. Horiuchi; M. Yamanaka; M. Murakami; C. A. Horiuchi","Crystal structure of cis-dichlorobis(5-methyl-isoxazole)platinum(II), PtCl~2~(C~4~H~5~NO)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","239","240","","","","0.7107","MoKα","","","0.0353","","","","0.0402","","","","","","0.079","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101759","11.1122","0.0013","17.939","0.003","12.612","0.003","90","","92.407","0.002","90","","2511.9","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis((ethanol-O)[μ-2-(salicylhydrazono)propionato-N,O,O']di(2- fluorobenzyl)tin(IV)","","- C52 H52 F4 N4 O10 Sn2 -","- C52 H52 F4 N4 O10 Sn2 -","- C104 H104 F8 N8 O20 Sn4 -","2","0.5","","Feng, S.-C.; Yin, H.-D.; Li, D.-C.","Crystal structure of bis{(ethanol)[2-(salicylhydrazono)-propionato] di(2-fluorobenzyl)tin(IV)}, [(FC~6~H~4~CH~2~)~2~Sn(C~2~H~5~OH)(C~10~H~8~N~2~O~4~)]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","247","249","","","","0.71073","MoKα","","0.0634","0.0462","","","0.1121","0.1241","","","","","","1.065","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101760","7.768","0.003","20.393","0.003","9.615","0.006","90","","104.75","0.04","90","","1472.9","1.1","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","phenylpiperazinium tetrachlorozincate","","- C10 H16 Cl4 N2 Zn -","- C10 H16 Cl4 N2 Zn -","- C40 H64 Cl16 N8 Zn4 -","4","1","","I. Ben Garbia; R. Kefi; A. Rayes; C. Ben Nasr","Crystal structure of phenylpiperazinium tetrachlorozincate, (C~10~H~16~N~2~) [ZnCl~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","333","334","","","","0.7107","MoKα","","0.0232","0.023","","0.035","","0.035","","","1.895","","","1.9","","","","has coordinates","193981","2020-10-21","18:00:00",""
"8101761","6.5459","0.001","12.705","0.005","13.949","0.002","90","0.02","92.92","0.01","90","0.02","1158.6","0.5","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","piperazinium tetrachlorozincate monohydrate","","- C4 H14 Cl4 N2 O Zn -","- C4 H14 Cl4 N2 O Zn -","- C16 H56 Cl16 N8 O4 Zn4 -","4","1","","R. Kefi; C. Ben Nasr","Crystal structure of piperazinium tetrachlorozincate monohydrate, (C~4~H~12~N~2~)[ZnCl~4~] · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","241","242","","","","0.5608","AgKα","","0.0367","0.037","","0.039","","0.039","","","3.587","","","3.59","","","","has coordinates","193981","2020-10-21","18:00:00",""
"8101762","8.1835","0.0014","8.3545","0.0014","10.5287","0.0017","106.504","0.003","97.948","0.003","110.631","0.003","622.71","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5-methyl-4-(methylthio)-2-(4-nitrobenzyl)oxazole","","- C12 H12 N2 O3 S -","- C12 H12 N2 O3 S -","- C24 H24 N4 O6 S2 -","2","1","","Herrera, A.; Martínez-Álvarez, R.; Ramiro, P.; Rosario Torres, M.","Crystal structure of 5-methyl-4-(methylthio)-2-(4-nitrobenzyl)oxazole, C~12~H~12~N~2~O~3~S","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","243","244","","","","0.71073","MoKα","","0.0862","0.045","","","0.0964","0.1113","","","","","","0.889","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101763","11.5889","0.0006","7.8521","0.0004","15.712","0.0008","90","","108.816","0.002","90","","1353.34","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","rubidium bis(salicylato)borate","","- C14 H8 B O6 Rb -","- C14 H8 B O6 Rb -","- C56 H32 B4 O24 Rb4 -","4","1","","Zhang, J.; Wang, J.; Huang, X.-Y.; Chen, J.-T.","Crystal structure of rubidium bis(salicylato)borate, Rb[B(OC~7~H~4~COO)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","261","262","","","","0.71073","MoKα","","0.0767","0.0617","","","0.1564","0.1736","","","","","","1.133","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101764","12.47","0.003","9.498","0.0019","17.043","0.003","90","","108.23","0.03","90","","1917.3","0.8","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-[diaqua-hexapyridinyl-bis(μ-sulfato)diiron(II)] tetrahydrate","","- C30 H42 Fe2 N6 O14 S2 -","- C30 H42 Fe2 N6 O14 S2 -","- C60 H84 Fe4 N12 O28 S4 -","2","0.5","","H.-Z. Shi; Z.-L. Li; Y.-K. Shan","Crystal structure of catena-[diaqua-hexapyridinyl-bis(μ-sulfato) diiron(II)] tetrahydrate, [Fe(C~5~H~5~N)~4~][Fe(H~2~O)~2~(C~5~H~5~N) ~2~](SO~4~)~2 ~· 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","245","246","","","","0.71073","MoKα","","0.0563","0.043","","","0.0822","0.086","","","","","","1.075","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101765","9.903","0.002","11.279","0.002","20.231","0.004","90","","92.43","0.03","90","","2257.7","0.8","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[1,2-ethylene-1,1'-bis(η^5^-tetrahydroindenyl)]-chloro-[η^2^-N,C-3,4,5,6- tetrafluoropyridyl]zirconium(IV)","","- C25 H24 Cl F4 N Zr -","- C25 H24 Cl F4 N Zr -","- C100 H96 Cl4 F16 N4 Zr4 -","4","1","","Spannenberg, A.; Jäger-Fiedler, U.; Arndt, P.; Rosenthal, U.","Crystal structure of [1,2-ethylene-1,1'-bis(η^5^-tetrahydroindenyl)]- chloro-[η^2^-N,C-3,4,5,6-tetrafluoropyridyl]zirconium(IV), ZrCl (C~5~F~4~N)(C~20~H~24~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","253","254","","","","0.71073","MoKα","","0.0515","0.0347","","","0.0764","0.0811","","","","","","1.004","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101766","17.875","0.004","6.8775","0.0016","29.747","0.007","90","","101.01","0.004","90","","3589.6","1.4","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-{[1-(4-dimethylaminophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2- dihydropyrazol-3-one","","- C20 H22 N4 O -","- C20 H22 N4 O -","- C160 H176 N32 O8 -","8","1","","X.-L. Zhang; Z.-X. Li","Crystal structure of 4-{[1-(4-dimethylaminophenyl)-methylidene]amino}- 1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one, C~20~H~22~N~4~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","263","264","","","","0.71073","MoKα","","0.1197","0.0697","","","0.1491","0.1719","","","","","","1.044","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101767","13.412","0.002","9.16","0.002","18.128","0.003","90","","104.41","0.01","90","","2157","0.7","296","","296","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","tetrakis(4-methoxybenzylammonium) cyclotetraphosphate tetrahydrate","","- C32 H56 N4 O20 P4 -","- C32 H56 N4 O20 P4 -","- C64 H112 N8 O40 P8 -","2","0.5","","H. Hemissi; S. Abid; M. Rzaigui","Crystal structure of tetrakis(4-methoxybenzyl-ammonium) cyclotetraphosphate tetrahydrate, (C~8~H~12~NO)~4~[P~4~O~12~] · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","265","266","","","","0.5608","AgKα","","0.0392","0.039","","0.043","","0.043","","","1.756","","","1.76","","","","has coordinates","193981","2020-10-21","18:00:00",""
"8101768","13.454","0.005","8.999","0.004","15.719","0.006","90","","90.232","0.009","90","","1903.1","1.3","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","dimethyl 2-(tert-butylamino)-5,7,7-trimethyl-5,6,7,8- tetrahydro-4H-chromene-3,4-dicarboxylate","","- C20 H30 N O5 -","- C20 H30 N O5 -","- C80 H120 N4 O20 -","4","1","","Zonouzi, A.; Rahmani, H.; Samareh Afsari, H.; Nezamabadi, M.","Crystal structure of dimethyl 2-(tert-butylamino)-5,7,7-trimethyl- 5,6,7,8-tetrahydro-4H-chromene-3,4-dicarboxylate, C~20~H~30~NO~5~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","267","268","","","","0.71073","MoKα","","0.1046","0.073","","","0.1511","0.1609","","","","","","0.99","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101769","10.369","0.002","27.528","0.006","10.815","0.002","90","","107.98","0.03","90","","2936.3","1.1","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","isocalamendiol","","- C15 H26 O2 -","- C15 H26 O2 -","- C120 H208 O16 -","8","4","","D. Ruiz-León; P. Rivera; I. Brito; M. Rodríguez; V. Manríquez","Crystal structure of isocalamendiol, C~15~H~26~O~2~, from Baccharis marginalis","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","355","357","","","","0.71073","MoKα","","0.1568","0.0413","","","0.0807","0.1052","","","","","","0.978","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101770","7.4861","0.0002","9.8257","0.0003","11.6947","0.0002","100.175","0.001","90.199","0.001","101.054","0.001","830.36","0.04","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","piperidinium 5-cyano-6-(3-chlorophenyl)-4-oxo-2-thiopyrimidinate","","- C16 H17 Cl N4 O S -","- C16 H17 Cl N4 O S -","- C32 H34 Cl2 N8 O2 S2 -","2","1","","Balalaie, S.; Bararjanian, M.; Rominger, F.","Crystal structure of piperidinium 5-cyano-6-(3-chlorophenyl)-4-oxo- 2-thiopyrimidinate, (C~5~H~12~N)[C~11~H~5~ClN~3~OS]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","269","270","","","","0.71073","MoKα","","0.0455","0.0331","","","0.0813","0.0872","","","","","","1.023","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101771","5.0299","0.001","18.894","0.004","36.178","0.007","90","","90","","90","","3438.2","1.2","100","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","p-methyl-N-(2-phenyl-1H-indol-7-yl)-benzene-sulfonamide","","- C21 H18 N2 O2 S -","- C21 H18 N2 O2 S -","- C168 H144 N16 O16 S8 -","8","1","","X.-H. Huang; Q.-F. Zhang; H. H. Y. Sung","Crystal structures of p-methyl-N-(2-phenyl-1H-indol-7-yl)-benzene- sulfonamide, C~21~H~18~N~2~O~2~S, and p-methoxy-N-(2-phenyl-1H-indol- 7-yl)-benzene-sulfonamide, C~21~H~18~N~2~O~3~S","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","258","260","","","","0.71073","MoKα","","0.073","0.0515","","","0.0942","0.1202","","","","","","0.963","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101772","10.4236","0.0012","10.8499","0.0009","11.4483","0.0015","109.435","0.006","92.016","0.004","112.162","0.003","1111.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","diaquabis(1,10-phenanthroline)lanthanum(III) tris(1,4-benzenedicarboxylate)","","- C24 H16 La N2 O7 -","- C24 H16 La N2 O7 -","- C48 H32 La2 N4 O14 -","2","1","","Li, X.; Wang, D.-Y.; Hu, H.-M.","Crystal structure of diaquabis(1,10-phenanthroline)-dilanthanum(III) tris(μ-1,4-benzenedicarboxylate), La~2~(H~2~O)~2~(C~12~H~8~N~2~) ~2~(C~8~H~4~O~4~)~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","271","272","","","","0.71073","MoKα","","0.0304","0.0292","","","0.0701","0.071","","","","","","1.043","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101773","12.66","0.006","13.8928","0.0013","13.448","0.008","90","","104.26","0.05","90","","2292.4","1.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrole","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C96 H96 N16 O16 -","8","2","","Ramos Silva, M.; Matos Beja, A.; Paixão, J. A.; Cabral, A. M. T. D. V.; Barradas, F. I. F.; Paliteiro, C.; Sobral, A. J. F. N.","Crystal structure of 2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrole, C~24~H~24~N~4~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","273","274","","","","0.71073","MoKα","","0.3948","0.0747","","","0.1323","0.1994","","","","","","0.954","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101774","7.7011","0.0015","8.6774","0.0017","8.9183","0.0018","99.45","0.03","106.11","0.03","105.66","0.03","532.6","0.3","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","tetrakis(μ~2~-acetato)bis(2-aminopyrimidine)dizinc(II)","","- C16 H22 N6 O8 Zn2 -","- C16 H22 N6 O8 Zn2 -","- C16 H22 N6 O8 Zn2 -","1","0.5","","X.-S. Tai; L.-T. Wang; Y.-C. Zhang; Q.-G. Meng; C.-X. Du","Crystal structure of tetrakis(μ~2~-acetato)bis(2-amino-pyrimidine) dizinc(II), Zn~2~(CH~3~COO)~4~(C~4~H~3~N~2~NH~2~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","277","278","","","","0.71073","MoKα","","0.0361","0.0331","","","0.0872","0.0888","","","","","","1.087","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101775","10.6353","0.0009","8.4605","0.0007","11.2031","0.001","90","","100.799","0.004","90","","990.2","0.15","150","1","150","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,3,4,5-pentabromocyclopentane","","- C5 H5 Br5 -","- C5 H5 Br5 -","- C20 H20 Br20 -","4","1","","R. D. Ernst; C. Li; A. M. Arif","Crystal structure of 1,2,3,4,5-pentabromocyclopentane, C~5~H~5~Br~5~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","279","280","","","","0.71073","MoKα","","0.073","0.0474","","","0.1048","0.1198","","","","","","1.034","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101776","13.9659","0.0003","8.2642","0.0002","15.8814","0.0003","90","","101.184","0.0012","90","","1798.18","0.07","200","1","200","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","tetrachloro-bis(pyrazole)tungsten dimethoxyethane solvate","","- C10 H18 Cl4 N4 O2 W -","- C10 H18 Cl4 N4 O2 W -","- C40 H72 Cl16 N16 O8 W4 -","4","0.5","","R. D. Ernst; B. G. Harvey; A. M. Arif","Crystal structure of tetrachloro-bis(pyrazole)tungsten(IV) dimethoxyethane solvate, WCl~4~(C~3~H~4~N~2~)~2~ · (CH~3~OCH~2~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","281","282","","","","0.71073","MoKα","","0.0428","0.0366","","","0.0881","0.0915","","","","","","1.123","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101777","11.8613","0.0001","13.2907","0.0002","13.3311","0.0002","113.246","0.0007","97.4903","0.0009","111.045","0.0008","1709.05","0.04","200","1","200","1","","","","","","","","4","P -1","-P 1","2","","bis(μ-oxo)hexakis(2,6-diisopropylphenoxy)ditantalum(V)","","- C72 H102 O8 Ta2 -","- C72 H102 O8 Ta2 -","- C72 H102 O8 Ta2 -","1","0.5","","R. D. Ernst; B. G. Harvey; A. M. Arif","Crystal structure of bis(μ-oxo)hexakis(2,6-diisopropyl-phenoxy) ditantalum(V), Ta~2~O~2~(C~12~H~17~O)~6~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","283","284","","","","0.71073","MoKα","","0.0336","0.0286","","","0.0633","0.0655","","","","","","1.065","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101778","8.196","0.0001","17.83","0.0004","41.908","0.001","90","","90","","90","","6124.2","0.2","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-benzoylmorphin-6-one-17-carboxamide","","- C74 H66 N6 O16 -","- C24.6667 H22 N2 O5.33333 -","- C296 H264 N24 O64 -","12","3","","M. Chudik; A. Jegorov; H. Petrickova; B. Kratochvil; I. Cisarova","Crystal structure of 3-benzoylmorphin-6-one-17-carboxamide ethanol solvate (1:0.333), C~24~H~20~N~2~O~5~ · 0.333 C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","348","350","","","","0.71073","MoKα","","0.0901","0.0659","","0.0914","0.0731","0.0731","","","","","","1.147","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101779","18.8003","0.0008","12.8757","0.0006","18.3032","0.0008","90","","97.416","0.001","90","","4393.5","0.3","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tris(pyrrolinedithiocarbamato)arsenic(III)","","- C15 H24 As N3 S6 -","- C15 H24 As N3 S6 -","- C120 H192 As8 N24 S48 -","8","2","","Y. Liu; E. R. T. Tiekink","Crystal structure of tris(pyrrolinedithiocarbamato)arsenic(III), As[S~2~CN(CH~2~)~4~]~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","339","341","","","","0.71069","MoKα","","0.085","0.068","","","0.146","0.153","","","","","","1.22","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101780","19.895","0.004","8.431","0.0017","16.394","0.003","90","","108.65","0.03","90","","2605.4","1","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-(9,10-dioxo-anthracene-1-ylamino-1,4-dienylamino))- 5-dimethylaminonaphthalene-sulfonamide","","- C32 H25 N3 O4 S -","- C32 H25 N3 O4 S -","- C128 H100 N12 O16 S4 -","4","1","","Illos, R. A.; Ergaz, I.; Bittner, S.","Crystal structure of N-[4-(9,10-dioxo-anthracene-1-yl-amino-1,4-dienylamino)]- 5-dimethylaminonaphthalene-sulfonamide, C~32~H~25~N~3~O~4~S","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","285","286","","","","0.71073","MoKα","","0.0709","0.0451","","","0.097","0.1046","","","","","","1.051","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101781","6.806","0.0002","16.7719","0.0006","6.813","0.0002","90","","106.621","0.001","90","","745.21","0.04","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","D-2-deoxy-2-fluoro-chiro-inositol","","- C6 H11 F O5 -","- C6 H11 F O5 -","- C24 H44 F4 O20 -","4","2","","H. Reinke; T. Pundt; R. Miethchen","Crystal structure of D-2-deoxy-2-fluoro-chiro-inositol, C~6~H~11~FO~5~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","287","288","","","","0.71073","MoKα","","0.0351","0.0302","","","0.0641","0.0649","","","","","","0.994","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101782","5.8984","0.0012","17.148","0.003","12.5058","0.0019","90","","94.411","0.014","90","","1261.2","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","7-Chloro-3-isopropylamino-4H-1,2,4-benzothiadiazine 1,1-dioxide","","- C10 H12 Cl N3 O2 S -","- C10 H12 Cl N3 O2 S -","- C40 H48 Cl4 N12 O8 S4 -","4","1","","L. Dupont; B. Pirotte; P. de Tullio","Crystal structure of 7-chloro-3-isopropylamino-4H-1,2,4-benzothiadiazine 1,1-dioxide, C~10~H~12~ClN~3~O~2~S","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","353","354","","","","1.5418","CuKα","","0.1015","0.0425","","","0.0977","0.1095","","","","","","0.809","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101783","25.573","0.003","10.4527","0.0013","14.159","0.002","90","","113.674","0.008","90","","3466.3","0.8","120","2","120","2","","","","","","","","3","C 1 2 1","C 2y","5","","3β-[5-phenyl-(2E,4E)-penta-2,4-dienoyloxy]-olean-12-ene","","- C41 H58 O2 -","- C41 H58 O2 -","- C164 H232 O8 -","4","1","","Humberto, M. M. S.; Da Silva, V. R. M.; Sant'Ana, A. E. G.; De Simone, C. A.; Malta, V. R. S.; Pereira, M. A.","Crystal structure of 3β-[5-phenyl-(2E,4E)-penta-2,4-dienoyloxy]- olean-12-ene, C~41~H~58~O~2~, from Peltastes peltatus","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","358","360","","","","0.71073","MoKα","","0.1004","0.0689","","","0.1533","0.1798","","","","","","1.004","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101784","18.4439","0.0008","11.0999","0.0005","25.183","0.001","90","","97.037","0.001","90","","5116.8","0.4","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","hexacarbonyl-bis(μ~2~-4-chlorophenylthiolato-S,S)diiron(I) diethyl ether hemisolvate","","- C20 H13 Cl2 Fe2 O6.5 S2 -","- C20 H13 Cl2 Fe2 O6.5 S2 -","- C160 H104 Cl16 Fe16 O52 S16 -","8","1","","C.-B. Ma; C.-N. Chen; Q.-T. Liu","Crystal structure of hexacarbonyl-bis(μ~2~-4-chlorophenylthiolato- S,S)-diiron(I) diethyl ether hemisolvate, Fe~2~(CO)~6~(ClC~6~H~4~S) ~2~ · ½(C~2~H~5~)~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","361","362","","","","0.71073","MoKα","","","0.0545","","","0.1454","0.1723","","","","","","1.067","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101785","9.581","0.001","16.381","0.002","17.803","0.002","90","","100.92","0.005","90","","2743.5","0.5","293","2","293","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","N,N'-bis(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin-7-yl)-1,3-diaminopropane","","- C31 H32 N8 -","- C31 H32 N8 -","- C124 H128 N32 -","4","1","","T. Irrgang; R. Kempe","Crystal structure of N,N'-bis(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin- 7-yl)-1,3-diaminopropane, C~31~H~32~N~8~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","403","404","","","","0.71069","MoKα","","0.1118","0.0478","","","0.0971","0.1111","","","","","","0.79","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101786","9.4241","0.0003","26.1147","0.0016","13.5769","0.0009","90","","90","","90","","3341.4","0.3","150","1","150","1","","","","","","","","4","C 2 c b","C -2ac 2","41","","1-chloromethyl-1,4,7-trimethyl-triazonan-1-ium chloride dichloromethane solvate","","- C11 H25 Cl4 N3 -","- C11 H25 Cl4 N3 -","- C88 H200 Cl32 N24 -","8","","","R. D. Ernst; B. G. Harvey; O. J. Oteri; A. M. Arif","Crystal structures of dichloromethane solvate and ethanol solvate of 1-chloromethyl-1,4,7-trimethyltriazonan-1-ium chloride, (C~10~H~23~N~3~Cl) Cl · CH~2~Cl~2~, (C~10~H~23~N~3~Cl)Cl · C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","373","375","","","","0.71073","MoKα","","0.0906","0.0661","","","0.147","0.1686","","","","","","1.058","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101787","9.3788","0.0002","25.5188","0.0009","13.8489","0.0005","90","","90","","90","","3314.54","0.18","150","1","150","1","","","","","","","","5","C 2 c b","C -2ac 2","41","","1-chloromethyl-1,4,7-trimethyl-triazonan-1-ium chloride ethanol solvate","","- C12 H29 Cl2 N3 O -","- C12 H29 Cl2 N3 O -","- C96 H232 Cl16 N24 O8 -","8","","","R. D. Ernst; B. G. Harvey; O. J. Oteri; A. M. Arif","Crystal structures of dichloromethane solvate and ethanol solvate of 1-chloromethyl-1,4,7-trimethyltriazonan-1-ium chloride, (C~10~H~23~N~3~Cl) Cl · CH~2~Cl~2~, (C~10~H~23~N~3~Cl)Cl · C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","373","375","","","","0.71073","MoKα","","0.0667","0.0554","","","0.1326","0.1395","","","","","","1.132","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101789","9.108","0.002","6.5314","0.001","13.3063","0.0019","90","","105.11","0.016","90","","764.2","0.2","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","aqua-bis(betaine)sodium bromide","aqua-bis(N,N,N-trimethylammonioacetato)sodium bromide","","- C10 H24 Br N2 Na O5 -","- C10 H24 Br N2 Na O5 -","- C20 H48 Br2 N4 Na2 O10 -","2","0.5","","V. H. Rodrigues; M. M. R. Costa; A. Klöpperpieper; M. R. Chaves; A. Almeida; J. Agostinho Moreira","Crystal structure of aqua-bis(N,N,N-trimethylammonioacetato)sodium bromide, [Na(H~2~O){(CH~3~)~3~NCH~2~COO}~2~]Br","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","363","364","","","","0.71073","MoKα","","0.0382","0.0317","","","0.0887","0.092","","","","","","1.065","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101790","5.658","0.005","15.406","0.009","8.234","0.008","90","","93.18","0.09","90","","716.6","1","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","o-cyanoaniline hydrochloride","","- C7 H7 Cl N2 -","- C7 H7 Cl N2 -","- C28 H28 Cl4 N8 -","4","1","","Oueslati, A.; Kefi, R.; Akriche, S.; Ben Nasr, C.","Crystal structure of o-cyanoaniline hydrochloride, (NCC~6~H~4~NH~3~)Cl","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","365","366","","","","0.7107","MoKα","","0.0205","0.0204","","","0.0524","0.0524","","","","","","1.103","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101791","21.727","0.004","10.954","0.002","22.073","0.004","90","","116.609","0.004","90","","4696.9","1.5","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","bis(tert-butyl) 2-(tert-butylamino)-5-acetyl-6-methyl-4H-pyran-3,4-dicarboxylate","","- C22 H35 N O6 -","- C22 H35 N O6 -","- C176 H280 N8 O48 -","8","1","","Zonouzi, A.; Rahmani, H.; Kazemi, D.","Crystal structure of bis(tert-butyl) 2-(tert-butylamino)-5-acetyl- 6-methyl-4H-pyran-3,4-dicarboxylate, C~22~H~35~NO~6~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","367","368","","","","0.71073","MoKα","","0.0556","0.046","","","0.1193","0.128","","","","","","0.988","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101792","16.837","0.008","7.368","0.004","13.07","0.007","90","0.006","111.005","0.004","90","0.005","1513.7","1.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-benzyl-N-1,3,4-tetramethyl-2,5-dioxo-4-imidazolidinecarboxamide","","- C15 H19 N3 O3 -","- C15 H19 N3 O3 -","- C60 H76 N12 O12 -","4","1","","Euler, H.; Kirfel, A.; Meusel, M.; Gütschow, M.","Crystal structure of N-benzyl-N-1,3,4-tetramethyl-2,5-dioxo-4- imidazolidinecarboxamide, C~15~H~19~N~3~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","369","370","","","","0.71069","MoKα","","0.1308","0.0501","","","0.0963","0.1197","","","","","","0.99","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101793","9.8679","0.001","10.8765","0.001","15.458","0.002","90","","90","","90","","1659.1","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-hydroxymethyl-10α-methoxy-9,10-dihydrolysergol","","- C18 H24 N2 O3 -","- C18 H24 N2 O3 -","- C72 H96 N8 O12 -","4","1","","J. Cejka; B. Kratochvíl; L. Cvak; A. Jegorov","Crystal structure of 1-hydroxymethyl-10α-methoxy-9,10-dihydrolysergol, C~18~H~24~N~2~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","351","352","","","","1.5418","CuKα","","0.0664","0.0654","","0.0802","0.0794","","","","","","","1.1145","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101794","3.9221","0.0011","5.7229","0.0017","17.208","0.005","90","","95.447","0.006","90","","384.5","0.19","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","6-bromochromone","6-bromochromone","","- C9 H5 Br O2 -","- C9 H5 Br O2 -","- C18 H10 Br2 O4 -","2","1","","R. J. Staples; W. Lea","Crystal structure of 6-bromochromone, C~9~H~5~BrO~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","371","372","","","x-ray","0.71073","MoKα","","0.0398","0.038","","","0.1043","0.1059","","","","","","1.026","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101795","13.8965","0.0018","19.237","0.002","22.753","0.003","90","","90","","90","","6082.5","1.3","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","diaqua(4,4'-bipyridine)(5-hydroxy-1,3-benzenedicarboxylato)cobalt(II) 4,4'-bipyridine dimethylsulfoxide solvate","","- C30 H30 Co N4 O8 S -","- C30 H30 Co N4 O8 S -","- C240 H240 Co8 N32 O64 S8 -","8","1","","He, H.-Y.; Zhou, Y.-L.; Zhu, L.-G.","Crystal structure of diaqua(4,4'-bipyridine)(5-hydroxy-1,3-benzenedicarboxylato) cobalt(II) 4,4'-bipyridine dimethylsulfoxide solvate, Co(H~2~O)~2~(C~10~H~8~N~2~)[C~6~H~3~OH(COO)~2~] · C~10~H~8~N~2~ · (CH~3~)~2~SO","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","445","447","","","","0.71073","MoKα","","0.1394","0.0782","","","0.1885","0.2195","","","","","","0.98","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101796","12.5366","0.0012","11.9016","0.0013","12.573","0.0014","90","","93.229","0.004","90","","1873","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","ethyl[6-(2-fluorobenzoyl)-2-oxobenzothiazolin-3-yl]butanoate","","- C20 H18 F N O4 S -","- C20 H18 F N O4 S -","- C80 H72 F4 N4 O16 S4 -","4","1","","A. Aydin; Y. Dündar; C. Arici","Crystal structure of ethyl [6-(2-fluorobenzoyl)-2-oxo-benzothiazolin- 3-yl]-butanoate, C~20~H~18~FNO~4~S","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","379","380","","","","0.71073","MoKα","","0.0811","0.0438","","","0.1183","0.1354","","","","","","1.019","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101797","9.7712","0.0009","10.7343","0.0011","15.4568","0.0015","90","","98.136","0.002","90","","1604.9","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","hemi(1,4-diazabicyclo[2.2.2]octane)bis(2-thiopheneacetato)copper(II)","","- C30 H32 Cu2 N2 O8 S4 -","- C30 H32 Cu2 N2 O8 S4 -","- C60 H64 Cu4 N4 O16 S8 -","2","0.5","","Zhou, Y.-L.; He, H.-Y.; Zhu, L.-G.","Crystal structure of catena-poly[(1,4-diazabicyclo[2.2.2]-octane)tetrakis (2-thiopheneacetato)dicopper(II)], Cu~2~(C~6~H~12~N~2~)(C~6~H~5~O~2~S)~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","381","382","","","","0.71073","MoKα","","0.0754","0.0609","","","0.1782","0.1905","","","","","","1.054","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101798","11.1101","0.0005","13.5725","0.0006","21.9454","0.0011","90","","90.057","0.001","90","","3309.2","0.3","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(diethyldithiocarbamato)(triethylphosphine)gold(I)","","- C11 H25 Au N P S2 -","- C11 H25 Au N P S2 -","- C88 H200 Au8 N8 P8 S16 -","8","2","","Ho, S. Y.; Tiekink, E. R. T.","Crystal structure of (diethyldithiocarbamato)(triethylphosphine)gold(I), Au[P(C~2~H~5~)~3~][S~2~CN(C~2~H~5~)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","342","344","","","","0.71069","MoKα","","0.068","0.039","","","0.071","0.079","","","","","","0.97","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101799","12.614","0.001","10.142","0.001","12.967","0.001","90","","98","0.01","90","","1642.7","0.2","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,3-di(1-naphthalyl)propan-2-one","1,3-di(1-naphthalyl)propan-2-one","","- C23 H18 O -","- C23 H18 O -","- C92 H72 O4 -","4","1","","A. Schwarzer; M. Nieger; D. Klomfaß; E. Weber","Crystal structure of 1,3-di(1-naphthalyl)propan-2-one, C~23~H~18~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","385","386","","","","1.54178","CuKα","","0.0854","0.0585","","","0.1528","0.1725","","","","","","1.054","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101800","10.523","0.003","16.082","0.005","17.382","0.005","65.12","0.005","86.867","0.005","78.073","0.005","2609.2","1.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","tert-butylammonium trifluoroacetyl-N-(tert-butylamino)dioxophosphate acetronitrile solvate hydrate (1 : 0.333 : 0.333)","","- C10.67 H24.67 F3 N3.33 O3.33 P -","- C10.6667 H24.6667 F3 N3.33333 O3.33333 P -","- C64 H148 F18 N20 O20 P6 -","6","3","","K. Gholivand; M. Pourayoubi; Z. Shariatinia; S. Molani","Crystal structure of tert-butylammonium trifluoroacetyl-N-(tert-butylamino) dioxophosphate acetonitrile solvate hydrate (1:0.333:0.333), (C~4~H~9~NH~3~) [(F~3~C~2~ONH)(C~4~H~9~NH)PO~2~)] · 0.333CH~3~CN · 0.333H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","387","389","","","","0.71073","MoKα","","0.1156","0.0624","","","0.131","0.1485","","","","","","0.994","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"8101801","6.8872","0.0017","8.251","0.002","9.419","0.002","114.18","0.005","101.572","0.005","98.849","0.005","461.38","0.19","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","O-Methyl N-(o-tolyl)thiocarbamate","","- C9 H11 N O S -","- C9 H11 N O S -","- C18 H22 N2 O2 S2 -","2","1","","F. S. Kuan; P. Tadbuppa; E. R. T. Tiekink","Crystal structure of o-methyl N-(o-tolyl)thiocarbamate, SC(OCH~3~) NH(C~6~H~4~CH~3~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","393","394","","","","0.71069","MoKα","","0.055","0.045","","","0.13","0.14","","","","","","1.05","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101802","17.975","0.002","7.2265","0.0009","17.343","0.002","90","","110.687","0.003","90","","2107.5","0.4","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","O-ethyl N-(m-tolyl)thiocarbamate","","- C10 H13 N O S -","- C10 H13 N O S -","- C80 H104 N8 O8 S8 -","8","1","","P. Tadbuppa; E. R. T. Tiekink","Crystal structure of o-ethyl N-(m-tolyl)thiocarbamate, SC(OC~2~H~5~) NH(C~6~H~4~CH~3~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","395","396","","","","0.71069","MoKα","","0.071","0.054","","","0.14","0.151","","","","","","1.03","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101803","7.2528","0.0008","12.3005","0.001","15.2083","0.0012","90","","90","","90","","1356.8","0.2","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","naphthalen-1-yl-(4-nitro-benzylidene)-amine","","- C17 H12 N2 O2 -","- C17 H12 N2 O2 -","- C68 H48 N8 O8 -","4","1","","Wen, P.-H.","Crystal structure of naphthalen-1-yl-(4-nitro-benzylidene)amine, C~17~H~12~N~2~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","397","398","","","","0.71073","MoKα","","0.0759","0.0457","","","0.0962","0.1074","","","","","","1.019","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101804","8.1732","0.0001","10.864","0.0002","16.2532","0.0003","109.03","0.0008","94.68","0.0007","96.1267","0.001","1346.07","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","dinitratobis(4-methyl-5-formyl-imidazolfuranoylhydrazone)gadolinium(III) mononitrate","","- C20 H20 Gd N11 O13 -","- C20 H20 Gd N11 O13 -","- C40 H40 Gd2 N22 O26 -","2","1","","P. M. Haba; O. Diouf; M. Gaye; A. S. Sall; A. H. Barry; R. Weller; B. Chahrazed","Crystal structure of dinitratobis(4-methyl-5-formylimidazolfuranoylhydrazone) gadolinium(III) mononitrate, [Gd{(OC(C~4~H3O)NHNCH(CH~3~)C~3~H~2~N~2~) }~2~(NO~3~)~2~][NO~3~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","401","402","","","","0.71069","MoKα","","0.0704","0.0482","","","0.1162","0.1324","","","","","","1.077","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101805","29.968","0.002","8.156","0.001","21.365","0.002","90","","132.154","0.007","90","","3871.3","0.8","193","2","193","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(2,4,6-trimethyl-phenyl)-[6-(2,4,6-trimethyl-phenyl)-pyridin-2-yl]-amine","","- C23 H26 N2 -","- C23 H26 N2 -","- C184 H208 N16 -","8","1","","T. Schmalz; J. Burkhardt; T. Irrgang; R. Kempe","Crystal structure of (2,4,6-trimethyl-phenyl)-[6-(2,4,6-trimethyl- phenyl)-pyridin-2-yl]-amine, C~23~H~26~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","405","406","","","","0.71069","MoKα","","0.0956","0.0578","","","0.1314","0.146","","","","","","1.018","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101806","8.688","0.0008","18.893","0.0016","15.5853","0.0014","90","","99.199","0.002","90","","2525.3","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","aqua(2,2'-bipyridine-N,N')bis(3-hydroxy-trans-cinnamato-O,O')cadmium(II)","","- C28 H24 Cd N2 O7 -","- C28 H24 Cd N2 O7 -","- C112 H96 Cd4 N8 O28 -","4","1","","Cheng, Y.-Q.; Cai, X.-Q.; Hu, M.-L.","Crystal structure of aqua(2,2'-bipyridine-N,N')bis(3-hydroxy-trans- cinnamato-O,O')cadmium(II), Cd(H~2~O)(C~10~H~8~N~2~)(C~9~H~7~O~3~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","390","392","","","","0.71073","MoKα","","0.1445","0.1131","","","0.1821","0.194","","","","","","1.282","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101807","23.366","0.003","10.448","0.0012","24.236","0.003","90","","109.439","0.002","90","","5579.4","1.2","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(1,10-phenanthroline)bis(μ-2-methoxybenzoato-O,O')- bis(μ-2-methoxybenzoato-O,O':O')dinitrato-dineodymium(III)","","- C56 H44 N6 Nd2 O18 -","- C56 H44 N6 Nd2 O18 -","- C224 H176 N24 Nd8 O72 -","4","0.5","","Li, X.","Crystal structure of bis(1,10-phenanthroline)bis(μ-2-methoxybenzoato- O,O')bis(μ-2-methoxybenzoato- O,O':O')dinitrato-dineodymium (III), Nd~2~(C~8~O~3~H~7~)~4~(NO~3~)~2~(C~12~H~8~N~2~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","407","408","","","","0.71073","MoKα","","0.0541","0.0301","","","0.059","0.0663","","","","","","1.03","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101808","13.273","0.011","6.226","0.002","17.835","0.013","90","","102.24","0.12","90","","1440.3","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","disodium sym-diethyl etidronate dihydrate","disodium [1-(ethoxy-hydroxy-phosphoryl)-1-hydroxy-ethyl]-phosphonic acid diethyl ester dihydrate","","- C6 H18 Na2 O9 P2 -","- C6 H18 Na2 O9 P2 -","- C24 H72 Na8 O36 P8 -","4","1","","Monteil, M.; Barbey, C.; Neuman, A.; Prangé, T.; Lecouvey, M.","Crystal structure of diaquadisodium [1-(ethoxy-hydroxyphosphoryl)-1-hydroxy- ethyl]phosphonic acid diethyl ester, Na~2~(H~2~O)~2~[(C~2~H~5~OPO~2~) ~2~C(CH~3~)OH], a pro-drug derivative for etidronate","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","411","412","","","","1.5418","CuKα","","0.0709","0.0697","","","0.1878","0.1894","","","","","","1.061","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101809","36.562","0.002","9.5395","0.0006","19.8918","0.0012","90","","103.501","0.001","90","","6746.2","0.7","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(pyridine-N)[bis(N,N-dibenzyldithiocarbamato)cadmium(II)","","- C35 H33 Cd N3 S4 -","- C35 H33 Cd N3 S4 -","- C280 H264 Cd8 N24 S32 -","8","1","","F.-X. Wei; X. Yin; W.-G. Zhang; J. Fan; X.-H. Jiang; S.-L. Wang","Crystal structure of (pyridine-N)bis(N,N-dibenzyldithiocarbamato)cadmium (II), Cd(C~5~H~5~N)[S~2~CN(C~6~H~5~CH~2~)~2~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","417","419","","","","0.71073","MoKα","","0.0481","0.0428","","","0.1111","0.1144","","","","","","1.107","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101810","18.496","0.003","18.496","0.003","9.939","0.002","90","","90","","120","","2944.6","0.9","180","2","180","2","","","","","","","","7","R -3 :H","-R 3","148","","hexakis(N,N-dimethylformamide-O)silicon(IV) tris(tri-bromide) chloride","","- C18 H42 Br9 Cl N6 O6 Si -","- C18 H42 Br9 Cl N6 O6 Si -","- C54 H126 Br27 Cl3 N18 O18 Si3 -","3","0.166667","","A. Bekaert; P. Lemoine; J. D. Brion; B. Viossat","Crystal structure of hexakis(N,N-dimethylformamide-O)silicon(IV) tris (tribromide) chloride, [Si{(CH~3~)~2~NCHO}~6~][Br~3~]~3~Cl","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","425","426","","","","0.71073","MoKα","","0.0606","0.056","","","0.1695","0.1764","","","","","","1.451","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101811","9.6786","0.0016","13.663","0.002","15.348","0.002","90","","106.233","0.005","90","","1948.7","0.5","210","2","210","2","","","","","","","","4","P 1 21 1","P 2yb","4","","cis-4-benzyl-4-methyl-2,6-diphenyl-4H-thiopyran-1-oxide","","- C25 H22 O S -","- C25 H22 O S -","- C100 H88 O4 S4 -","4","2","","F. Jafarpour; H. Pirelahi","Crystal structures of cis- and trans-4-benzyl-4-methyl-2,6-diphenyl- 4H-thiopyran-1-oxide, C~25~H~22~OS","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","420","424","","","","0.71073","MoKα","","0.0546","0.0472","","","0.1139","0.1191","","","","","","0.995","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101812","19.7176","0.0012","11.8772","0.0007","19.6879","0.0012","90","","118.942","0.005","90","","4034.9","0.5","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-4-benzyl-4-methyl-2,6-diphenyl-4H-thiopyran-1-oxide","","- C25 H22 O S -","- C25 H22 O S -","- C200 H176 O8 S8 -","8","2","","F. Jafarpour; H. Pirelahi","Crystal structures of cis- and trans-4-benzyl-4-methyl-2,6-diphenyl- 4H-thiopyran-1-oxide, C~25~H~22~OS","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","420","424","","","","0.71073","MoKα","","0.0706","0.0549","","","0.1245","0.1331","","","","","","1.013","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101813","15.412","0.002","7.474","0.002","14.733","0.002","90","","116.703","0.002","90","","1516.1","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diaquabis(5-chlorosalicylaldehydato)cobalt(II)","","- C14 H12 Cl2 Co O6 -","- C14 H12 Cl2 Co O6 -","- C56 H48 Cl8 Co4 O24 -","4","1","","Z.-X. Li; X.-L. Zhang","Crystal structure of diaquabis(5-chlorosalicylaldehydato)cobalt(II), Co(H~2~O)~2~(C~7~H~4~ClO~2~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","427","428","","","","0.71073","MoKα","","0.0643","0.0393","","","0.0906","0.1006","","","","","","1.022","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101814","8.4228","0.0004","19.7169","0.0007","12.4746","0.0005","90","","91.041","0.002","90","","2071.33","0.15","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","aqua(1,10-phenanthroline)bis(2-thiophenecarboxylato)copper(II)","","- C22 H16 Cu N2 O5 S2 -","- C22 H16 Cu N2 O5 S2 -","- C88 H64 Cu4 N8 O20 S8 -","4","1","","D.-M. Feng; H.-Y. He; H.-X. Jin; L.-G. Zhu","Crystal structure of aqua(1,10-phenanthroline)bis(2-thiophenecarboxylato) copper(II), Cu(H~2~O)(C~12~H~8~N~2~)(C~4~H~3~SCOO)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","429","430","","","","0.71073","MoKα","","0.0991","0.0666","","","0.1809","0.1985","","","","","","0.968","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101815","7.9467","0.0011","12.0563","0.0014","9.0826","0.0012","90","","106.012","0.011","90","","836.42","0.19","210","2","210","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","(15-crown-5)(trifluoromethanesulfonato-O,O')sodium","(1,4,7,10,13-pentaoxacyclopentadecane-O,O',O'',O''',O'''')- (trifluoromethanesulfonato-O,O')-sodium","","- C11 H20 F3 Na O8 S -","- C11 H20 F3 Na O8 S -","- C22 H40 F6 Na2 O16 S2 -","2","0.5","","D. Peikow; C.-M. Matern; M. G. Peter; U. Schilde","Crystal structure of (1,4,7,10,13-pentaoxacyclopentadecane-O,O',O'', O''',O'''')(trifluoromethanesulfonato- O,O')sodium, Na(C~10~H~20~O~5~) (CF~3~SO~3~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","431","432","","","","0.71073","MoKα","","0.0696","0.0434","","","0.1111","0.1202","","","","","","0.867","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101816","9.476","0.0019","16.223","0.003","18.615","0.004","90","","90","","90","","2861.7","1","200","2","200","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","Me-Butiphane Rh (NBD)","(η^4^-norborna-2,5-dien)-(2,3-bis((S,S)-2,5-dimethyl- phospholanyl)-benzothiophene)-rhodium(I) tetrafluoroborate","","- C27 H36 B F4 P2 Rh S -","- C27 H36 B F4 P2 Rh S -","- C108 H144 B4 F16 P8 Rh4 S4 -","4","1","","H.-J. Drexler; J.-T. Sun; D. Heller; U. Berens; M. Kesselgruber","Crystal structure of (h^4^-norborna-2,5-dien){2,3-bis[(S,S)-2,5-dimethyl- phospholanyl]benzothiophene}rhodium(I) tetrafluoroborate, [Rh(C~7~H~8~) (C~20~H~28~P~2~S)][BF~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","435","436","","","","0.71073","MoKα","","0.0602","0.0446","","","0.1021","0.1083","","","","","","0.765","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101817","16.508","0.005","6.11","0.0018","11.165","0.003","90","","110.206","0.005","90","","1056.8","0.5","193","2","193","2","","","","","","","","4","C 1 2 1","C 2y","5","S,R-(+)-N-Methylephedrine","S,R-(+)-N-Methylephedrine","","- C11 H17 N O -","- C11 H17 N O -","- C44 H68 N4 O4 -","4","1","","R. J. Staples; A. A. Spencer","Crystal structure of S,R-(+)-N-methylephedrine, C~11~H~17~NO","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","437","438","","","x-ray","0.71073","MoKα","","0.0382","0.0321","","","0.084","0.0897","","","","","","1.055","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101818","8.7958","0.0013","9.8436","0.0013","14.718","0.002","94.33","0.006","98.546","0.006","99.258","0.007","1237.3","0.3","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","bis[μ2-(3-benzimidazol-2-yl)-2-ethanethiolato-N,S,S)-chloro-palladium(II)]","","- C20 H24 Cl2 N4 O Pd2 S2 -","- C20 H24 Cl2 N4 O Pd2 S2 -","- C40 H48 Cl4 N8 O2 Pd4 S4 -","2","1","","M. Somer; D. Haciu; N. M. Agh-Atabay; H. Borrmann","Crystal structure of bis[μ~2~-(3-benzimidazol-2-yl)-2-ethanethiolato- N,S,S)-chloro-palladium(II)], [(C~6~H~4~N~2~HCCH~2~CH~2~S)PdCl]~2~ · C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","441","442","","","","0.71073","MoKα","","0.0869","0.0683","","","0.1353","0.1418","","","","","","1.14","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101819","12.8849","0.0014","15.007","0.002","10.8625","0.0015","90","","109.46","0.008","90","","1980.4","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-(4-(1H-imidazol-1-yl)phenyl)-2,6-diphenylpyridine","","- C26 H19 N3 -","- C26 H19 N3 -","- C104 H76 N12 -","4","1","","Y.-Z. Wu; C.-X. Wang; W.-T. Yu; J.-X. Yang","Crystal structure of 4-(4-(1H-imidazol-1-yl)phenyl)-2,6-diphenylpyridine, C~26~H~19~N~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","443","444","","","","0.71073","MoKα","","0.2269","0.0603","","","0.1197","0.1844","","","","","","0.857","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101820","8.8868","0.0018","16.192","0.003","16.228","0.003","90","","97.08","0.03","90","","2317.3","0.8","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dichloro[1,3-bis(5-methyl-3-phenylpyrazol-1-yl)propan-2-ol]palladium(II)","","- C23 H24 Cl2 N4 O Pd -","- C23 H24 Cl2 N4 O Pd -","- C92 H96 Cl8 N16 O4 Pd4 -","4","1","","G.-F. Zhang; Y.-L. Dou; X.-Z. Fan","Crystal structure of dichloro[1,3-bis(5-methyl-3-phenylpyrazol-1-yl) propan-2-ol]palladium(II), Pd[(C~10~H~9~N~2~)~2~C~3~H~5~OH]Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","451","452","","","","0.71073","MoKα","","0.0422","0.0289","","","0.0742","0.0776","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101821","10.158","0.003","21.971","0.005","19.301","0.003","90","","104.13","0.02","90","","4177.3","1.7","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tris[bis(penthamethylene)urea]trinitrato-lanthanum(III)","","- C33 H60 La N9 O12 -","- C33 H60 La N9 O12 -","- C132 H240 La4 N36 O48 -","4","1","","R. Artali; G. Beretta; D. M. Arújo Melo","Crystal structure of tris[bis(pentamethylene)urea]trinitrato-lanthanum (III), La(NO~3~)~3~[(C~5~H~10~N)~2~CO]~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","457","459","","","x-ray","0.71073","mokα","","","0.0446","","","","0.1399","","","","","","1.051","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101822","15.38","0.003","11.466","0.002","17.15","0.003","90","","109.99","0.03","90","","2842.1","1","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[chlorobis(1,10-phenanthroline)copper(II)] chloride 3,5-dihydroxybenzoic acid solvate hydrate","","- C31 H24 Cl2 Cu N4 O5 -","- C31 H24 Cl2 Cu N4 O5 -","- C124 H96 Cl8 Cu4 N16 O20 -","4","1","","H.-Y. He; Y.-L. Zhou; Y.-N. Chen; L.-G. Zhu","Crystal structure of [chlorobis(1,10-phenanthroline)-copper(II)] chloride 3,5-dihydroxybenzoic acid solvate monohydrate, [CuCl(C~12~H~8~N~2~) ~2~]Cl · C~6~H~3~(OH)~2~COOH · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","448","450","","","","0.71073","MoKα","","0.1312","0.066","","","0.1552","0.1974","","","","","","0.965","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101823","7.3522","0.0015","8.8559","0.0018","29.34","0.006","90","","90","","90","","1910.3","0.7","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","7α-acetyl-6,14-endo-ethanotetrahydrothebaine","","- C23 H29 N O4 -","- C23 H29 N O4 -","- C92 H116 N4 O16 -","4","1","","A. Amani; G. Rezanejade Bardajee; G. Samavati; R. Mansouri","Crystal structure of 7α-acetyl-6,14-endo-ethanotetrahydrothebaine, C~23~H~29~NO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","453","454","","","","0.71073","MoKα","","0.0742","0.0483","","","0.0887","0.097","","","","","","1.003","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101824","7.8357","0.0008","8.2543","0.0008","14.7908","0.0015","90","","95.76","0.01","90","","951.81","0.17","293","2","295.15","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","1,2-ethylenediaminedizinc diphosphonate","","- C8 H40 N8 O24 P8 Zn8 -","- C2 H10 N2 O6 P2 Zn2 -","- C8 H40 N8 O24 P8 Zn8 -","4","1","","S. Natarajan; Yu. Prots; R. Niewa; R. Kniep","Crystal structure of 1,2-ethylenediamine-dizinc diphosphate(III), Zn~2~(C~2~H~8~N~2~)(HPO~3~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","455","456","","","","0.7107","MoKα","","0.062","0.0392","","","0.0953","0.1058","","","","","","1.118","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101825","9.7444","0.0013","10.0592","0.0014","18.012","0.002","91.663","0.01","99.064","0.01","104.536","0.009","1683.3","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5,17-Dibromo-25,27-dimethoxy-26-benzoyloxy-28-hydroxycalix[4]arene","","- C37 H34 Br2 O7 -","- C37 H34 Br2 O7 -","- C74 H68 Br4 O14 -","2","1","","F.-J. Yu; X.-J. Hu; Y. Li; H.-J. Yang; R.-J. Wang","Crystal structure of 5,17-dibromo-25,27-dimethoxy-26-benzoyloxy-28- hydroxycalix[4]arene dihydrate, C~37~H~34~Br~2~O~5~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","460","462","","","","0.71073","MoKα","","0.1471","0.0707","","","0.1537","0.1801","","","","","","1.012","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101826","20.434","0.002","8.551","0.001","26.498","0.002","90","","102.889","0.001","90","","4513.4","0.8","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(2,6-diisopropyl-phenyl)-[6-(2,6-dimethyl-phenyl)-pyridin-2-yl-metylene]-amine","","- C26 H30 N2 -","- C26 H30 N2 -","- C208 H240 N16 -","8","1","","H. Maisel; S. Keller; T. Irrgang; R. Kempe","Crystal structure of (2,6-diisopropyl-phenyl)-[6-(2,6-dimethyl-phenyl)- pyridin-2-yl-methylene]-amine, C~26~H~30~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","463","464","","","","0.71069","MoKα","","0.0802","0.0621","","","0.1748","0.1874","","","","","","1.038","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101827","16.546","0.0008","17.995","0.0011","11.817","0.0014","90","","90","","90","","3518.5","0.5","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2,6-diisopropyl-phenyl)-[6-(2,6-dimethyl-phenyl)- pyridin-2-yl-methylene]amino-palladium(II)","","- C29 H36 Cl8 N2 Pd -","- C29 H36 Cl8 N2 Pd -","- C116 H144 Cl32 N8 Pd4 -","4","1","","H. Maisel; S. Keller; T. Irrgang; R. Kempe","Crystal structure of (2,6-diisopropyl-phenyl)-[6-(2,6-dimethyl-phenyl)- pyridin-2-yl-methylene]-aminopalladium(II) dichloromethane trisolvate, Pd(C~26~H~30~N~2~)Cl~2~ · 3CH~2~Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","465","466","","","","0.71069","MoKα","","0.0387","0.0371","","","0.0983","0.099","","","","","","1.155","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101828","8.5908","0.0005","12.0056","0.0008","24.2133","0.0013","90","","90","","90","","2497.3","0.3","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","7-Chloro-3-isopropylsulfanyl-4H-1,2,4-benzothiadiazine 1,1-dioxide","","- C10 H11 Cl N2 O2 S2 -","- C10 H11 Cl N2 O2 S2 -","- C80 H88 Cl8 N16 O16 S16 -","8","1","","L. Dupont; S. Boverie; P. de Tullio; B. Pirotte","Crystal structure of 7-chloro-3-isopropylsulfanyl-4H-1,2,4-benzothiadiazine 1,1-dioxide, C~10~H~11~ClN~2~O~2~S~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","467","468","","","","1.5418","CuKα","","0.0807","0.0576","","","0.1597","0.1691","","","","","","0.945","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101829","7.866","0.0016","8.11","0.0016","14.21","0.003","96.88","0.03","97.01","0.03","103.61","0.03","864","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","dipraseodymium trisuccinate dihydrate","","- C12 H16 O14 Pr2 -","- C12 H16 O14 Pr2 -","- C24 H32 O28 Pr4 -","2","1","","Wei, D.-Y.; Xie, H.-Z.; Huang, S.-J.; Zheng, Y.-Q.","Crystal structure of bis(aquapraseodymium) trisuccinate, Pr~2~(H~2~O) ~2~[O~2~C(CH~2~)~2~CO~2~]~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","471","472","","","","0.71073","MoKα","","0.0429","0.0423","","","0.1154","0.1163","","","","","","1.132","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101830","9.3909","0.0019","10.769","0.002","31.959","0.006","90","","90","","90","","3232","1.1","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","benzyltrimethylammonium dithiobenzoate","benzyltrimethylammonium dithiobenzoate","","- C17 H21 N S2 -","- C17 H21 N S2 -","- C136 H168 N8 S16 -","8","1","","A. Mahjoub","Crystal structure of benzyltrimethylammonium dithiobenzoate, [C~6~H~5~CH~2~N (CH~3~)~3~][C~6~H~5~CS~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","473","474","","","","0.71073","MoKα","","0.1807","0.0316","","","0.0744","0.0789","","","","","","0.748","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101831","10.5006","0.0016","10.1454","0.0016","24.085","0.004","90","","92.546","0.004","90","","2563.3","0.7","223","2","223","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H56 Au2 N2 O6 P2 S2 -","- C52 H56 Au2 N2 O6 P2 S2 -","- C104 H112 Au4 N4 O12 P4 S4 -","2","0.5","","S. Y. Ho; E. R. T. Tiekink","Crystal structure of bis(μ-diphenylphosphino)butane-P,P'-bis [(N-(4-ethylcarboxyphenyl)-O-ethylthiocarbamato)gold(I)], [(CH~2~) ~4~(C~6~H~5~)~2~P)~2~][Au(SCNC~6~H~4~CO~2~C~2~H~5~)]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","475","476","","","","0.71069","MoKα","","0.07","0.045","","","0.117","0.146","","","","","","1.08","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101832","7.2663","0.0007","18.6061","0.0018","24.01","0.002","90","","90","","90","","3246.1","0.5","223","2","223","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","bis[(N-benzyl,N-hydroxyethyl)dithiocarbamato](1,10-phenanthroline)cadmium(II)","","- C32 H32 Cd N4 O2 S4 -","- C32 H32 Cd N4 O2 S4 -","- C128 H128 Cd4 N16 O8 S16 -","4","0.5","","M. Saravanan; R. Ramalingam; B. Arulprakasam; G. Bocelli; A. Cantoni; E. R. T. Tiekink","Crystal structure of bis[(N-benzyl,N-hydroxyethyl)dithiocarbamato] (1,10-phenanthroline)cadmium(II), Cd[S~2~CN(C~7~H~7~)(C~2~H~2~OH)] ~2~(C~12~H~8~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","477","478","","","","0.71069","MoKα","","0.036","0.029","","","0.064","0.066","","","","","","1.06","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101833","16.8789","0.0018","6.5076","0.0007","16.8929","0.0018","90","","111.259","0.001","90","","1729.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","ethylenediammonium bis[(2-oxo-1-naphthaldehyde-isonicotinyl-hydrazonato-O,N,O')dioxovanadate(V)]","","- C36 H62 N8 O8 V2 -","- C36 H32 N8 O8 V2 -","- C72 H64 N16 O16 V4 -","2","0.5","","Y.-Z. Zhou; R.-J. Chen; D.-D. Hu; S.-J. Tu","Crystal structure of ethylenediammonium bis[(2-oxo-1-naphthaldehyde- isonicotinyl hydrazonato-O,N,O')dioxovanadate(V)], (CH~2~NH~3~)~2~ [(C~16~H~11~N~3~O~2~)VO~2~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","509","510","","","","0.71073","MoKα","","0.0574","0.0408","","","0.0983","0.115","","","","","","1.081","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101834","9.1455","0.0018","14.113","0.003","18.998","0.004","90","","90","","90","","2452.1","0.9","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","1,3-bis(1-methyl-1H-tetrazol-5-ylthio)propane,","","- C7 H12 N8 S2 -","- C7 H12 N8 S2 -","- C56 H96 N64 S16 -","8","1","","Dou, Y.-L.; Zhang, G.-F.; Lei, Y.-J.; Fan, X.-Z.","Crystal structure of 1,3-bis(1-methyl-1H-tetrazol-5-ylthio)propane, C~3~H~6~(SCN~4~CH~3~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","485","486","","","","0.71073","MoKα","","0.0622","0.0372","","","0.1021","0.1113","","","","","","1.026","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101835","5.5442","0.0006","8.3603","0.0004","27.427","0.003","90","","90","","90","","1271.3","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","L-tryptophanium phosphite","","- C11 H15 N2 O5 P -","- C11 H15 N2 O5 P -","- C44 H60 N8 O20 P4 -","4","1","","M. Ramos Silva; J. A. Paixão; A. Matos Beja","Crystal structure of L-tryptophanium phosphite, (C~11~H~13~N~2~O~2~) [H~2~PO~3~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","487","488","","","","0.71073","MoKα","","0.1343","0.0529","","","0.1207","0.1462","","","","","","1.013","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101836","20.196","0.004","6.2154","0.0013","11.243","0.002","90","","90","","90","","1411.3","0.5","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2'-(4-dimethylaminobenzylidene)-2-hydroxybenzoylhydrazide","","- C16 H17 N3 O2 -","- C16 H17 N3 O2 -","- C64 H68 N12 O8 -","4","1","","Yang, J.-G.; Pan, F.-Y.","Crystal structure of 2'-(4-dimethylaminobenzylidene)-2-hydroxybenzoylhydrazide, (CH~3~)~2~N(C~6~H~4~)(CH)N(NH)(CO)(C~6~H~4~OH)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","515","516","","","","0.71073","MoKα","","0.0595","0.0477","","","0.105","0.1133","","","","","","0.978","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101837","9.589","0.005","10.144","0.007","11.312","0.005","87.11","0.02","72.38","0.02","64.96","0.02","946.3","0.9","173.1","","","","","","","","","","","5","P -1","-P 1","2","","poly[[aqua(1,10-phenanthroline-κ^2^N,N')nickel(II)]- μ-(dihydrogen-benzene-1,2,4,5-tetracarboxylato)-κ^3^O^1^:O^2^:O^3^]","","- C22 H14 N2 Ni O9 -","- C22 H14 N2 Ni O9 -","- C44 H28 N4 Ni2 O18 -","2","1","","J.-C. Lee; H. Takahashi; Y. Matsui","Crystal structure of poly[{aqua(1,10-phenanthroline-k^2^N,N')nickel (II)}-μ-(dihydrogen-benzene-1,2,4,5-tetracarboxylate)-k^3^O:O':O''], Ni(C10H4O8)(C12H8N2)(H2O)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","489","490","","","","0.71073","MoKα","","0.0367","0.0347","","0.0863","0.0854","0.0854","","","","","","0.8459","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101838","7.68","0.0015","14.873","0.003","14.011","0.003","90","","90","","90","","1600.4","0.6","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","aqua-(2,9-dimethyl-1,10-phenanthroline-N,N')diformato-copper(II)","","- C16 H16 Cu N2 O5 -","- C16 H16 Cu N2 O5 -","- C64 H64 Cu4 N8 O20 -","4","1","","Pan, J.-G.; Lin, J.-L.; Zheng, Y.-Q.","Crystal structure of aqua-(2,9-dimethyl-1,10-phenanthroline-N,N')- diformato-copper(II), Cu(C~14~H~12~N~2~)(H~2~O)(HCOO)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","495","496","","","","0.71073","MoKα","","0.0468","0.0399","","","0.0975","0.1024","","","","","","1.045","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101839","16.44","0.005","16.586","0.005","15.332","0.005","90","","115.695","0.005","90","","3767","2","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tetraammoninium bis[(pyridine-2,6-dicarboxylato-O,O',N)cadmate(II)] pentahydrate","","- C14 H19 Cd N4 O10.5 -","- C14 H19 Cd N4 O10.5 -","- C112 H152 Cd8 N32 O84 -","8","2","","A.-Y. Fu; D.-Q. Wang","Crystal structure of tetraammonium bis[(pyridine-2,6-dicarboxylato- O,N,O')cadmate(II)] pentahydrate, (NH~4~)~4~[Cd(C~7~H~3~NO~4~)~2~] ~2~ · 5H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","503","505","","","","0.71073","MoKα","","0.106","0.0508","","","0.1116","0.1386","","","","","","1.006","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101840","10.623","0.003","7.187","0.003","29.912","0.008","90","","90","","90","","2283.7","1.3","173.1","","173.1","","","","","","","","see text","6","P b c a","-P 2ac 2ab","61","","diaquabis(ethylenediamine-κ^2^N,N')copper(II) bis(p-chlorobenzoate)","","- C18 H28 Cl2 Cu N4 O6 -","- C18 H28 Cl2 Cu N4 O6 -","- C72 H112 Cl8 Cu4 N16 O24 -","4","0.5","","J.-C. Lee; H. Takahashi; Y. Matsui","Crystal structure of diaquabis(ethylenediamine-k^2^N,N')copper(II) bis(p-chlorobenzoate), [Cu(C~2~H~8~N~2~)~2~(H~2~O)~2~](C~7~H~4~ClO~2~) ~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","491","492","","","x-ray","0.71073","MoKα","","0.0375","0.0236","","","0.0243","0.0282","","","","","","1.013","","","","has coordinates","194598","2020-10-21","18:00:00",""
"8101841","3.6146","0.0008","7.146","0.001","11.258","0.002","90","","92.02","0.01","90","","290.61","0.09","233","2","233","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","sodium 4-azido-1,2,3-triazolide monohydrate","","- C2 H3 N6 Na O -","- C2 H3 N6 Na O -","- C4 H6 N12 Na2 O2 -","2","0.5","","Laus, G.; Reitsamer, C.; Wurst, K.; Schottenberger, H.","Crystal structure of sodium 4-azido-1,2,3-triazolide monohydrate, Na(N~3~C~2~HN~3~) · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","575","576","","","","0.71073","MoKα","","0.0477","0.0416","","","0.1068","0.1103","","","","","","1.096","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101842","9.7086","0.0009","21.743","0.002","10.8014","0.001","90","","109.594","0.001","90","","2148.1","0.3","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","pentacarbonyl[(ethoxycarbonyl)(N-diphenylmethylenamino)methylene]chromium(0)","","- C22 H15 Cr N O7 -","- C22 H15 Cr N O7 -","- C88 H60 Cr4 N4 O28 -","4","1","","W. Ponikwar; H. Nöth; H. Dialer; W. Beck","Crystal structure of pentacarbonyl[(ethoxycarbonyl)(N-diphenylmethylenamino) methylene]chromium(0), Cr(CO)~5~[C(COOC~2~H~5~){NC(C~6~H~5~)~2~}]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","499","500","","","","0.71073","MoKα","","0.0673","0.0376","","","0.0912","0.0984","","","","","","0.96","","","","has coordinates","211332","2020-10-21","18:00:00",""
"8101843","7.584","0.0015","13.468","0.003","16.36","0.003","90","","98.21","0.03","90","","1653.9","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","1,2-bis(4-pyridinium)ethane tetrachlorocobaltate(II) monohydrate","","- C12 H16 Cl4 Co N2 O -","- C12 H16 Cl4 Co N2 O -","- C48 H64 Cl16 Co4 N8 O4 -","4","0.5","","Wei, D.-Y.; Xie, H.-Z.; Zheng, Y.-Q.","Crystal structure of 1,2-bis(4-pyridinium)ethane tetrachlorocobaltate (II) monohydrate, (C~12~H~14~N~2~)[CoCl~4~] · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","497","498","","","","0.71073","MoKα","","0.0615","0.0388","","","0.0919","0.1004","","","","","","1.03","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101844","8.686","0.003","15.568","0.005","36.521","0.011","90","","90","","90","","4939","3","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Crystal structure of poly-[{bis(cyanide-C)iron(II)}tetra(μ~2~cyanide-C:N)- bis{bis(ethylenediamine-N,N)cadmium(II)}], Cd~2~Fe(CN)~6~(C~2~H~8~N~2~)~4~","","- C14 H32 Cd2 Fe N14 -","- C14 H32 Cd2 Fe N14 -","- C112 H256 Cd16 Fe8 N112 -","8","0.25","","A.-Y. Fu; D.-Q. Wang","Crystal structure of poly[{bis(cyanide-C)iron(II)}tetra(μ^2 ^-cyanide-C:N)bis{bis(ethylenediamine-N,N')cadmium(II)}], Cd~2~Fe (CN)~6~(C~2~H~8~N~2~)~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","501","502","","","","0.71073","MoKα","","0.0371","0.0269","","","0.0605","0.0646","","","","","","1.005","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101845","11.909","0.002","13.046","0.002","15.144","0.003","99.617","0.004","96.925","0.004","96.039","0.003","2283.9","0.7","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","[N-benzoyl-N'-(2-pyridylmethylene)hydrazine]bis(trimethylphosphine)copper(I) tetrafluoroborate","","- C48 H40 B Cu F4 N4 O P2 -","- C48 H40 B Cu F4 N4 O P2 -","- C96 H80 B2 Cu2 F8 N8 O2 P4 -","2","1","","T.-J. Cai; Y.-F. Long; Q. Deng; Z.-S. Peng","Crystal structure of (N-benzoyl-N'-(2-pyridylmethylene)hydrazine)bis (trimethylphosphine)copper(I) tetrafluoro- borate, [Cu(C~12~H~10~N~4~O) {P(C~6~H~5~)~3~}~2~]BF~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","506","508","","","","0.71073","MoKα","","0.0843","0.0481","","","0.1087","0.1226","","","","","","1.046","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101846","14.935","0.002","7.1297","0.001","17.573","0.002","90","","97.084","0.002","90","","1856.9","0.4","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(N-(2-hydroxyl-1-naphthal)ethylenediamine)(isonicotinyl hydrazide)oxovanadium","","- C17 H16 N5 O3 V -","- C19 H18 N5 O3 V -","- C76 H72 N20 O12 V4 -","4","1","","Y.-Z. Zhou; R.-J. Chen; S.-J. Tu; D.-D. Hu","Crystal structure of (N-(2-hydroxyl-1-naphthal)ethylenediamine)(isonicotinyl hydrazide)oxovanadium(V), [VO(C~6~H~5~N~3~O)(C~13~H~13~N~2~O)]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","511","514","","","","0.71073","MoKα","","0.0473","0.0354","","","0.0916","0.0968","","","","","","1.113","","","","has coordinates","288217","2023-12-11","20:43:00",""
"8101847","5.8157","0.0011","13.426","0.003","17.801","0.003","90","","90","","90","","1389.9","0.5","173.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-poly[(p-hydroxybenzoato)silver(I)- μ-(1R,2R)-(-)-1,2-cyclohexanediamine-κ^2^N:N']","","- C13 H19 Ag N2 O3 -","- C13 H19 Ag N2 O3 -","- C52 H76 Ag4 N8 O12 -","4","1","","J.-C. Lee; H. Takahashi; Y. Matsui","Crystal structure of catena-poly[(p-hydroxybenzoato)-silver(I)-μ- (1R,2R)-(-)-1,2-cyclohexanediamine-k^2^N,N'], Ag(C~7~H~5~O~3~)(C~6~H~14~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","493","494","","","","0.71073","MoKα","","0.0339","0.0292","","0.0667","0.0656","0.0667","","","","","","0.9745","","","","has coordinates","194598","2020-10-21","18:00:00",""
"8101848","8.974","0.002","5.933","0.001","8.994","0.002","90","","96.29","0.03","90","","475.98","0.17","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C10 H16 O2 -","- C10 H16 O2 -","- C20 H32 O4 -","2","1","","Torres, R.; Faini, F.; Rodilla, J. M. L.; Silva, L. A.; Sanz, F.","Crystal structure of taedol, C~10~H~16~O~2~, from Haplopappus taeda","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","537","538","","","","1.5418","CuKα","","0.0666","0.0517","","","0.131","0.1475","","","","","","0.968","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101849","6.4942","0.0006","10.2918","0.001","12.8293","0.0012","90","","94.535","0.001","90","","854.79","0.14","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-diaquabis(pyridine-2-carboxamide-N,O)nickel dibromide","","- C12 H16 Br2 N4 Ni O4 -","- C12 H16 Br2 N4 Ni O4 -","- C24 H32 Br4 N8 Ni2 O8 -","2","0.5","","Du, Q.-Y.; Li, Y.-P.; Xin, L.-Y.; Han, M.-L.","Crystal structure of trans-diaquabis(pyridine-2-carboxamide-N,O)nickel (II) dibromide, [Ni(H~2~O)~2~{(OC(NH~2~)(C~5~H~4~N)}~2~]Br~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","539","540","","","","0.71073","MoKα","","0.0192","0.0179","","","0.045","0.0456","","","","","","1.044","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101850","12.008","0.003","6.05","0.002","17.858","0.005","90","","99.34","0.02","90","","1280.2","0.6","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","trans-2,4-bis(sec-butyl)-2,4-bis((2-methyl-1-thioxo)butylsufanyl)-1,3- dithietane","","- C20 H36 S6 -","- C20 H36 S6 -","- C40 H72 S12 -","2","0.5","","Mahjoub, A.; Durif, A.","Crystal structure of trans-2,4-bis(sec-butyl)-2,4-bis((2-methyl-1- thioxo)butylsulfanyl)-1,3-dithietane, C~2~S~2~(C~4~H~9~)~2~(C~4~H~9~CS~2~) ~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","541","542","","","","0.7107","MoKα","","0.0504","0.0504","","0.0804","","0.0804","","","1.992","","","1.992","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101851","13.7555","0.0002","20.4059","0.0003","12.3696","0.0002","90","","106.568","0.001","90","","3327.91","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis(2,2'-bipyridine-N,N')bis(4-chlorobenzoato)cadmium(II) trihydrate","","- C34 H30 Cd Cl2 N4 O7 -","- C34 H30 Cd Cl2 N4 O7 -","- C136 H120 Cd4 Cl8 N16 O28 -","4","1","","B.-S. Zhang; Y.-H. Huang; H.-M. Gao","Crystal structure of bis(2,2'-bipyridine-N,N')-bis(4-chlorobenzoato) cadmium(II) trihydrate, [Cd(C~7~H~4~O~2~Cl)~2~(C~10~H~8~N~2~)~2~] · 3H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","376","378","","","","0.71073","MoKα","","0.0508","0.0298","","","0.064","0.0682","","","","","","1.027","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101852","8.0754","0.0013","8.8987","0.0014","14.571","0.002","90","","90","","90","","1047.1","0.3","193","2","193","2","","","","","","","Aldirch","4","P 21 21 21","P 2ac 2ab","19","R,S-(-)-N-methylephedrine","R,S-(-)-N-methylephedrine","","- C11 H17 N O -","- C11 H17 N O -","- C44 H68 N4 O4 -","4","1","","Staples, R. J.; Cho, E.","Crystal structure of R,S-(-)-N-methylephedrine, C~11~H~17~NO","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","543","544","","","x-ray","0.71073","MoKα","","0.0409","0.0381","","","0.1011","0.1051","","","","","","1.054","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101853","13.457","0.003","8.978","0.002","15.79","0.004","90","","90.32","0.02","90","","1907.7","0.8","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","dimethyl 2-(tert-butylamino)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H- chromene-3,4-dicarboxylate","","- C19 H27 N O6 -","- C19 H27 N O6 -","- C76 H108 N4 O24 -","4","1","","Zonouzi, A.; Rahmani, H.; Samareh Afsari, H.; Nezamabadi, M.","Crystal structure of dimethyl 2-(tert-butylamino)-7,7-dimethyl-5-oxo- 5,6,7,8-tetrahydro-4H-chromene-3,4-dicarboxylate, C~19~H~27~NO~6~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","545","546","","","","0.71073","MoKα","","0.064","0.0431","","","0.103","0.1116","","","","","","1.011","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101854","9.2002","0.0016","10.844","0.002","12.3","0.002","82.66","0.003","82.26","0.004","71.73","0.004","1149.9","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","diethyl 1-(cyclohexyl carbamoyl)-3-methyl-6-nitro-1H-indene-1,2-dicarboxylate","","- C23 H28 N2 O7 -","- C23 H28 N2 O7 -","- C46 H56 N4 O14 -","2","1","","Zonouzi, A.; Rahmani, H.; Samareh Afsari, H.","Crystal structure of diethyl 1-(cyclohexyl carbamoyl)-3-methyl-6-nitro- 1~H~-indene-1,2-dicarboxylate, C~23~H~28~N~2~O~7~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","547","548","","","","0.71073","MoKα","","0.0874","0.0549","","","0.0953","0.1091","","","","","","1.024","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101855","8.6358","0.0013","15.162","0.002","12.807","0.002","90","","106.599","0.003","90","","1607","0.4","120","2","120","2","","","","","","","","3","C 1 c 1","C -2yc","9","","2,2-diphenyl-4-dimethylaminopentanenitrile","","- C19 H22 N2 -","- C19 H22 N2 -","- C76 H88 N8 -","4","1","","Amani, A.; Rezanejade Bardajee, G.; Jafarpour, F.; Razaghi, M. O.; Yousefi Behzadi, M.; Haeri, A.","Crystal structure of 2,2-diphenyl-4-dimethyl-aminopentanenitrile, C~19~H~22~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","549","550","","","","0.71073","MoKα","","0.0493","0.044","","","0.0858","0.088","","","","","","1.037","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101856","10.4277","0.0015","12.785","0.002","13.838","0.002","68.583","0.002","73.664","0.002","77.367","0.002","1634.2","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","bis(2,2'-bipyridine-N,N')(N-tosyl-β-alaninato-O)copper(II) chloride tetrahydrate","","- C30 H36 Cl Cu N5 O8 S -","- C30 H36 Cl Cu N5 O8 S -","- C60 H72 Cl2 Cu2 N10 O16 S2 -","2","1","","Ma, L.-F.; Zhang, Y.-H.; Wang, J.-G.; Wang, L.-Y.","Crystal structure of bis(2,2'-bipyridine-N,N')(N-tosyl-β-alaninato- O)copper(II) chloride tetra-hydrate, [Cu(C~10~H^8^N~2~)~2~(C~10~H~12~NO~4~S)] Cl · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","603","605","","","","0.71073","MoKα","","0.0553","0.0502","","","0.1492","0.1526","","","","","","1.075","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101858","13.752","0.004","12.18","0.004","12.468","0.003","90","","92.42","0.02","90","","2086.5","1","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","5-ferrocenylsalicylate titanocene","(5-ferrocenyl-2-hydroxybenzenecarboxylato-O,O')titanocene(IV)","","- C27 H22 Fe O3 Ti -","- C27 H22 Fe O3 Ti -","- C108 H88 Fe4 O12 Ti4 -","4","1","","Gao, Z.-W.; Wang, G.-F.; Gao, L.-X.; Zhang, C.-Y.; Wu, D.-H.; Yu, W.-R.; Liu, Z.-T.","Crystal structure of (5-ferrocenyl-2-hydroxy-benzenecarboxylato-O, O')titanocene(IV), (C~5~H~5~)Fe(C~12~H~7~O~3~)Ti(C~5~H~5~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","551","552","","","","0.71073","MoKα","","0.1899","0.0643","","","0.1288","0.1581","","","","","","0.776","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101859","8.5507","0.0019","11.77","0.003","14.508","0.003","90","","91.169","0.003","90","","1459.8","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis(diethylenetriamine)cobalt(II) tetrahydroxypentaborate","","- C8 H34 B10 Co N6 O20 -","- C8 H34 B10 Co N6 O20 -","- C16 H68 B20 Co2 N12 O40 -","2","0.5","","Liu, Z.-H.; Zhang, J.-J.; Zhang, W.-J.","Crystal structure of bis(diethylenetriamine)cobalt(II) tetrahydroxypentaborate, [Co(C~4~H~13~N~3~)~2~][B~5~O~6~(OH)~4~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","555","556","","","","0.71073","MoKα","","0.0666","0.0513","","","0.1296","0.1438","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101860","11.127","0.002","12.31","0.003","14.266","0.006","80.58","0.03","69.8","0.03","73.53","0.02","1753.9","1","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","brevifolin carboxylic acid pyridine pentasolvate","","- C38 H33 N5 O8 -","- C38 H33 N5 O8 -","- C76 H66 N10 O16 -","2","1","","Lin, H.-W.; Xu, W.-D.; Wang, Q.-H.; Qiu, F.; Chen, W.-S.","Crystal structure of brevifolincarboxylic acid pyridine pentasolvate, C~13~H~8~O~8~ · 5C~5~H~5~N","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","557","559","10.1524/ncrs.2005.220.4.557","","","0.71073","MoKα","","0.1757","0.0466","","","0.116","0.1572","","","","","","0.997","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101861","9.8368","0.0003","11.6034","0.0003","12.9067","0.0003","76.607","0.001","82.218","0.001","77.622","0.001","1394.09","0.06","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","aquaphenanthroline(pyridine-2,6-dicarboxylato)cobalt(II) pyridine-2,6-dicarboxylic acid monosolvate tetrahydrate","","- C26 H26 Co N4 O13 -","- C26 H26 Co N4 O13 -","- C52 H52 Co2 N8 O26 -","2","1","","Su, H.; Wen, Y.-H.; Feng, Y.-L.","Crystal structure of aquaphenanthroline(pyridine-2,6-dicarboxylato) cobalt(II) pyridine-2,6-dicarboxylic acid monosolvate tetrahydrate, [Co(H~2~O)(C~12~H~8~N~2~){NC~5~H~3~(COO)~2~}] · NC~5~H~3~(COOH)~2~ · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","560","562","","","","0.71073","MoKα","","","0.0748","","","0.1539","0.18","","","","","","1.107","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101862","10.2989","0.0008","11.5069","0.0009","11.8211","0.001","96.048","0.002","103.245","0.001","109.525","0.001","1259.69","0.18","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","aqua(1,10-phenanthroline-N,N')(2-nitrobenzoato-O)(2-nitrobenzoato- O,O')cadmium(II)","","- C26 H18 Cd N4 O9 -","- C26 H18 Cd N4 O9 -","- C52 H36 Cd2 N8 O18 -","2","1","","Zhao, G.-L.; Wen, Y.-H.; Feng, Y.-L.","Crystal structure of aqua(1,10-phenanthroline-N,N')(2-nitrobenzoato- O)(2-nitrobenzoato-O,O')cadmium(II), Cd(H~2~O)(NO~2~C~6~H~4~COO)~2~ (C~12~H~8~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","563","564","","","","0.71073","MoKα","","","0.0475","","","0.1082","0.1099","","","","","","1.024","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101863","16.6352","0.0006","6.8145","0.0007","12.2805","0.0006","90","","107.921","0.003","90","","1324.58","0.16","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","7-chloro-3-isopropoxy-4H-1,2,4-benzothiadiazine 1,1-dioxide monohydrate","","- C10 H13 Cl N2 O4 S -","- C10 H13 Cl N2 O4 S -","- C40 H52 Cl4 N8 O16 S4 -","4","0.5","","Dupont, L.; Boverie, S.; Pirotte, B.; de Tullio, P.","Crystal structure of 7-chloro-3-isopropoxy-4H-1,2,4-benzothiadiazine 1,1-dioxide monohydrate, C~10~H~11~ClN~2~O~3~S · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","565","566","","","","1.5418","CuKα","","0.051","0.0425","","","0.121","0.1255","","","","","","1.049","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101864","10.7855","0.0007","8.3439","0.0006","22.9603","0.0018","90","","101.62","0.006","90","","2023.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3,5-tris(4-methoxyphenyl)-1H-1,2,4-triazole-2-oxide","","- C23 H21 N3 O4 -","- C23 H21 N3 O4 -","- C92 H84 N12 O16 -","4","1","","Frey, W.; Lee, J. Y.; Jäger, V.","Crystal structure of 1,3,5-tris(4-methoxyphenyl)-1H-1,2,4-triazole- 2-oxide, C~23~H~21~N~3~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","567","568","","","","1.54178","CuKα","","0.0807","0.0558","","","0.1418","0.1851","","","","","","1.076","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101865","10.5503","0.0007","17.0555","0.0011","13.9358","0.0009","90","","98.316","0.001","90","","2481.3","0.3","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2,2'-bipyridine)bis(n-butyl dithiocarbonato-S,S')cadmium(II)","","- C20 H26 Cd N2 O2 S4 -","- C20 H26 Cd N2 O2 S4 -","- C80 H104 Cd4 N8 O8 S16 -","4","1","","Jiang, X.-H.; Zhang, W.-G.; Zhong, Y.; Wang, S.-L.","Crystal structure of (2,2'-bipyridine)bis(n-butyldithiocarbonato-S, S')cadmium(II), Cd(C~4~H~9~COS~2~)~2~(C~10~H~8~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","569","570","","","","0.71073","MoKα","","0.0808","0.0336","","","0.0738","0.0839","","","","","","0.873","","","","has coordinates","211332","2020-10-21","18:00:00",""
"8101866","12.061","0.003","7.704","0.0017","14.734","0.004","90","","90.022","0.006","90","","1369.1","0.6","193","2","193","2","","","","","","","","5","P 1 n 1","P -2yac","7","","meso-5,5,7,12,12,14-hexamethyl-4,11-diaza- 1,8-diazoniacyclotetradecane bis(dicyanoargentate) dihydrate","","- C20 H42 Ag2 N8 O2 -","- C20 H42 Ag2 N8 O2 -","- C40 H84 Ag4 N16 O4 -","2","1","","Ding, J.-G.","Crystal structure of meso-5,5,7,12,12,14-hexamethyl-4,11-diaza-1,8- diazoniacyclotetradecane bis(dicyano-argentate) dihydrate, (C~16~H~38~N~4~) [Ag(CN)~2~]~2~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","571","572","","","","0.71073","MoKα","","0.0329","0.029","","","0.0662","0.0689","","","","","","1.013","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101867","5.164","0.0002","19.979","0.001","7.584","0.0004","90","","104.54","0.002","90","","757.39","0.06","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-hydroxy-6-propenyl-5,6-dihydro-pyran-2-one","","- C8 H10 O3 -","- C8 H10 O3 -","- C32 H40 O12 -","4","1","","Souza, L. C.; Imbroisi, D. O.; De Simone, C. A.; Pereira, M. A.; Malta, V. R. S.; Oliveira, J. F. T.","Crystal structure of 4-hydroxy-6-propenyl-5,6-dihydro-pyran-2-one, C~8~H~10~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","573","574","","","","0.71073","MoKα","","0.0709","0.0485","","","0.1333","0.1688","","","","","","1.123","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101868","12.8243","0.0004","9.2932","0.0002","14.3634","0.0005","90","","100.572","0.002","90","","1682.75","0.09","233","2","233","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(1-butyl-3-methylimidazolium)hexachlorotitanate(IV) bis(dichloromethane) solvate","","- C18 H34 Cl10 N4 Ti -","- C18 H34 Cl10 N4 Ti -","- C36 H68 Cl20 N8 Ti2 -","2","0.5","","Laus, G.; Bentivoglio, G.; Wurst, K.; Schottenberger, H.; Nauer, G.","Crystal structure of bis(1-butyl-3-methylimidazolium) hexachlorotitanate (IV) bis(dichloromethane) solvate, (C~8~H~15~N~2~)~2~[TiCl~6~] · 2CH~2~Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","577","578","","","","0.71073","MoKα","","0.05","0.0409","","","0.1064","0.1122","","","","","","1.063","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101869","6.4404","0.0012","7.2718","0.0015","9.8189","0.0019","100.327","0.004","98.781","0.003","110.274","0.003","412.72","0.14","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","bis(N,N-dimethylformamido)tetra(μ-formato)dicopper","","- C10 H18 Cu2 N2 O10 -","- C10 H18 Cu2 N2 O10 -","- C10 H18 Cu2 N2 O10 -","1","0.5","","Zhu, L.-M.","Refinement of the crystal structure of bis(N,N-dimethylformamide)tetra (μ-formato)dicopper(II), Cu~2~(HCOO)~4~[(CH~3~)~2~NCHO]~2~, at 193 K","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","579","580","","","","0.71073","MoKα","","0.0253","0.0242","","","0.0674","0.0679","","","","","","1.035","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101870","24.392","0.005","12.632","0.002","23.709","0.005","90","","100.97","0.03","90","","7172","3","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","tris[{((diphenylphosphino)methylene)diphenylphosphoranyl}methyl]yttrium ethyl ether monosolvate","","- C82 H79 O P6 Y -","- C82 H79 O P6 Y -","- C328 H316 O4 P24 Y4 -","4","1","","Spannenberg, A.; Müller, B.; Rosenthal, U.","Crystal structure of tris[(diphenylphosphino)methylene) diphenylphosphoranylmethyl]yttrium diethyl ether monosolvate, [Y{P(C~6~H~5~)~2~CHP(C~6~H~5~)~2~CH~2~}~3~] · (C~2~H~5~)~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","581","584","","","","0.71073","MoKα","","0.1679","0.0543","","","0.0918","0.1121","","","","","","0.762","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101871","25.765","0.004","11.185","0.0016","5.9115","0.0008","90","","90","","90","","1703.6","0.4","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","2'-(3-benzoxy-4-fluorobenzylidene)-2-hydroxybenzoylhydrazide","","- C20 H15 F N2 O3 -","- C20 H15 F N2 O3 -","- C80 H60 F4 N8 O12 -","4","1","","Liang, H.-D.; Yang, J.-G.; Yan, H.; Pan, F.-Y.","Crystal structure of 2'-(3-benzoxy-4-fluorobenzylidene)-2- hydroxybenzoylhydrazide, C~20~H~15~FN~2~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","585","586","","","","0.71073","MoKα","","0.1095","0.0518","","","0.1113","0.1254","","","","","","0.759","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101872","10.9246","0.0012","7.7412","0.0008","21.788","0.002","90","","96.572","0.002","90","","1830.5","0.3","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N,N'-ethylene(bis(benzoylacetoniminato)copper(II)","","- C22 H22 Cu N2 O2 -","- C22 H22 Cu N2 O2 -","- C88 H88 Cu4 N8 O8 -","4","1","","Dehghanpour, S.; Mojahed, F.; Farzaneh, F.","Refinement of the crystal structure of N,N'-ethylene-bis(benzoylacetoniminato) copper(II), Cu(C~22~H~22~N~2~O~2~), at 110 K","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","587","588","","","","0.71073","MoKα","","0.0539","0.0502","","","0.108","0.11","","","","","","1.005","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101873","35.97","0.004","11.627","0.0015","22.081","0.003","90","","114.341","0.007","90","","8413.9","1.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","trans-4-[4-(N,N-diethylamino)-2-hydroxy-styryl]-N-methylpyridinium iodide monohydrate acetonitrile hemisolvate","","- C19 H26.5 I N2.5 O2 -","- C19 H26.5 I N2.5 O2 -","- C304 H424 I16 N40 O32 -","16","2","","Cao, D.-X.; Chen, H.-Y.; Li, G.-Z.; Wang, Y.-H.; Liu, Z.-Q.","Crystal structure of trans-4-[4-(N,N-diethylamino)-2-hydroxystyryl]- N-methylpyridinium iodide monohydrate acetonitrile hemisolvate, (C~18~H~23~N~2~O)I · H~2~O · ½CH~3~CN","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","591","593","","","","0.71073","MoKα","","0.1514","0.0501","","","0.0928","0.1241","","","","","","0.903","","","","has coordinates,has disorder","176466","2020-10-21","18:00:00",""
"8101874","7.68","0.0015","19.87","0.004","10.65","0.002","90","","95.15","0.03","90","","1618.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[(μ-pyridine-3,4-dicarboxylato-O,O',O"")(1,10- phenanthroline-N,N')cobalt(II)]","","- C19 H11 Co N3 O4 -","- C19 H11 Co N3 O4 -","- C76 H44 Co4 N12 O16 -","4","1","","Weng, D.; Yao, Y.-W.; Cai, Q.; Tang, G.-Y.","Crystal structure of poly[(1,10-phenanthroline-N,N')(μ~3~-pyridyl- 3,4-dicarboxylato-N,O,O',O'')cobalt(II)], Co(C~12~H~8~N~2~)[NC~5~H~3~ (COO)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","589","590","","","","0.71073","MoKα","","0.0399","0.035","","","0.0905","0.0925","","","","","","1.033","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101875","19.709","0.003","14.83","0.003","15.208","0.003","90","","103.096","0.002","90","","4329.5","1.4","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(1,10-phenanthroline)copper(I) dichlorocuprate(I)","","- C24 H16 Cl2 Cu2 N4 -","- C24 H16 Cl2 Cu2 N4 -","- C192 H128 Cl16 Cu16 N32 -","8","1","","Wang, J.-G.; Kang, H.-X.; Zheng, X.-Y.","Crystal structure of bis(1,10-phenanthroline)copper(I) dichlorocuprate (I), [Cu(C~12~H~8~N~2~)~2~][CuCl~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","597","598","","","","0.71073","MoKα","","0.0377","0.0273","","","0.0828","0.0891","","","","","","1.045","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101876","19.1711","0.0001","19.1711","0.0001","29.6004","0.0001","90","","90","","120","","9421.55","0.08","200","2","200","2","","","","","","","","7","R -3 :H","-R 3","148","Ph3Te-F-SiF6-BF4","","","- C57 H48 B Cl9 F8 Si0.5 Te3 -","- C57 H48 B Cl9 F8 Si0.5 Te3 -","- C342 H288 B6 Cl54 F48 Si3 Te18 -","6","0.333333","","Klapötke, T. M.; Krumm, B.; Schwab, I.","Crystal structure of tris(triphenyltelluronium) fluoride tetrafluoroborate hemi(hexafluorosilicate) chloroform trisolvate, [Te(C~6~H~5~)~3~]~3~ [F][BF~4~][SiF~6~]~0.5~ · 3CHCl~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","594","596","","","","0.71073","MoKα","","0.0522","0.048","","","0.1262","0.1294","","","","","","1.077","","","","has coordinates,has disorder","176466","2020-10-21","18:00:00",""
"8101877","5.959","0.005","8.099","0.005","33.942","0.005","90","","90","","90","","1638.1","1.7","173","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1R,5S,8R,9S-8-azidomethyl-2-benzyl-6,6-dimethyl-3,7-dioxa-2-aza- bicyclo[3.3.1]nonan-9-ol","","- C16 H22 N4 O3 -","- C16 H22 N4 O3 -","- C64 H88 N16 O12 -","4","1","","Al-Harrasi, A.; Brüdgam, I.; Hartl, H.; Reißig, H.-U.","Crystal structure of 1R,5S,8R,9S-8-azidomethyl-2-benzyl-6,6-dimethyl- 3,7-dioxa-2-aza-bicyclo[3.3.1]nonan-9-ol, C~16~H~22~N~4~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","599","600","","","","0.71069","MoKα","","0.0733","0.0511","","","0.1055","0.113","","","","","","1.081","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101878","10.169","0.004","18.889","0.007","14.336","0.005","90","","107.747","0.01","90","","2622.6","1.7","301","2","301","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3-(4-methoxy-phenyl)-2-(triphenylphosphoranylimino)acrylic acid ethyl ester","ethyl 3-(4-methoxy-phenyl)-2-(triphenylphosphonioiminoyl)acrylate","","- C30 H28 N O3 P -","- C30 H28 N O3 P -","- C120 H112 N4 O12 P4 -","4","1","","Yang, F.-L.; Guo, G.; Bittner, S.","Crystal structure of ethyl 3-(4-methoxy-phenyl)-2-(triphenylphosphonioiminoyl) acrylate, (C~6~H~5~)~3~PNC(COOC~2~H~5~)(C~7~H~5~OCH~3~)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","601","602","","","","0.71073","MoKα","","0.0877","0.0543","","","0.1402","0.1733","","","","","","1.008","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101879","6.2202","0.0007","9.416","0.0011","10.3386","0.0018","109.186","0.002","105.136","0.002","103.455","0.002","517.27","0.12","296","2","296","2","","","","","","","","6","P 1","P 1","1","","(1,10-phenanthroline)(N-p-tolylsulfonyl-serinato)copper(II)","","- C22 H19 Cu N3 O5 S -","- C22 H19 Cu N3 O5 S -","- C22 H19 Cu N3 O5 S -","1","1","","Wang, J.-G.; Ma, L.-F.; Wang, L.-Y.; Wang, Y.-H.; Liu, R.","Crystal structure of (1,10-phenanthroline)(N-tosylserinato)copper (II), Cu(C~12~H~8~N~2~)(C~10~H~11~NO~5~S)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","606","608","","","","0.71073","MoKα","","0.0229","0.0226","","","0.0591","0.0592","","","","","","1.05","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101880","15.7141","0.0005","12.8573","0.0004","15.7388","0.0005","90","","90","","90","","3179.88","0.17","153","2","153","2","","","","","","","","4","P b c n","-P 2n 2ab","60","BaCp*2Py3","bis(pentamethylcyclopentadienyl)tri(pyridine)barium","","- C35 H45 Ba N3 -","- C35 H45 Ba N3 -","- C140 H180 Ba4 N12 -","4","0.5","","Fichtel, K.; Behrens, U.","Crystal structure of bis(pentamethylcyclopentadienyl)tri(pyridine) barium, Ba(C~5~H~5~N)~3~(C~10~H~15~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","609","610","","","","0.71073","MoKα","","0.0257","0.0195","","","0.0562","0.0578","","","","","","1.068","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101885","11.204","0.005","8.368","0.005","18.817","0.005","90","0.005","99.366","0.005","90","0.005","1740.7","1.4","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","diethyl 4-phenyl-2,6-dimethyl-3,5-pyridinedicarboxylate","","- C19 H21 N O4 -","- C19 H21 N O4 -","- C76 H84 N4 O16 -","4","1","","da Silva, A. F.; de Simone, C. A.; Sant'Ana, A. E. G.; Pereira, M. A.; Malta, V. R. S.","Crystal structure of diethyl 4-phenyl-2,6-dimethyl-3,5-pyridinedicarboxylate, C~19~H~21~NO~4~, an multidrug resistance reversal agent from Jatropha elliptica","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","611","612","","","x-ray","0.71073","MoKα","","0.0784","0.0544","","","0.1364","0.1536","","","","","","1.029","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101886","3.875","0.0001","8.724","0.0003","13.942","0.0005","107.06","0.05","95.9","0.05","95.22","0.05","444.54","0.15","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","dichloro(pyridine-2-aldoxime-N,N')mercury(II)","","- C6 H6 Cl2 Hg N2 O -","- C6 H6 Cl2 Hg N2 O -","- C12 H12 Cl4 Hg2 N4 O2 -","2","1","","Torabi, A. A.; Kian, R.; Souldozi, A.; Welter, R.","Crystal structure of dichloro(pyridine-2-aldoxime-N,N')mercury(II), HgCl~2~(NC~5~H~4~CHNOH)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","613","614","","","","0.71073","MoKα","","0.0479","0.0439","","","0.1246","0.1289","","","","","","1.106","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101887","10.7514","0.0014","7.9539","0.001","38.144","0.005","90","","92.326","0.003","90","","3259.2","0.7","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[3,5-bis(4-octyloxyphenyl)pyrazol-1-yl]pyridine","","- C36 H47 N3 O2 -","- C36 H47 N3 O2 -","- C144 H188 N12 O8 -","4","1","","Torralba, M. C.; Cano, M.; Campo, J. A.; Heras, J. V.; Pinilla, E.","Crystal structure of 2-[3,5-bis(4-octyloxyphenyl)pyrazol-1-yl]pyridine, C~36~H~47~N~3~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","617","619","","","","0.71073","MoKα","","0.1839","0.0644","","","0.1574","0.1988","","","","","","0.788","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101888","7.5577","0.0008","15.6315","0.0017","30.62","0.003","90","","90","","90","","3617.4","0.7","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-hydroxyethylammonium [(2-methoxysalicylaldehydato)benzoylhydrazonato-O,N,O']dioxovanadate(V)","","- C17 H20 N3 O6 V -","- C17 H20 N3 O6 V -","- C136 H160 N24 O48 V8 -","8","1","","Zhou, Y.-Z.; Hu, D.-D.; Chen, R.-J.; Tu, S.-J.","Crystal structure of 2-hydroxyethylammonium [(2-meth-oxysalicylaldehydato) benzoylhydrazonato-O,N,O']-dioxovanadate(V), [C~2~H~8~NO][VO~2~(C~15~H~12~N~2~O~3~)]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","623","624","","","","0.71073","MoKα","","0.0564","0.0373","","","0.0898","0.0991","","","","","","1.04","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101889","10.062","0.0015","12.5851","0.0019","16.476","0.003","100.522","0.002","92.205","0.002","96.007","0.002","2036.5","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","tetramethylammonium bis(1,3-dithiole-2-thione-4,5-dithiolato-S,S')aurate(III)","","- C10 H12 Au N S10 -","- C10 H12 Au N S10 -","- C40 H48 Au4 N4 S40 -","4","2","","Li, T.-B.; Yu, W.-T.; Xu, D.; Quan, R.; Zhang, G.-H.; Wang, X.-Q.","Crystal structure of tetramethylammonium bis(1,3-dithiole-2-thione- 4,5-dithiolato-S,S')aurate(III), [N(CH~3~)~4~][Au(C~3~S~5~)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","625","626","","","","0.71073","MoKα","","0.0601","0.049","","","0.1066","0.1124","","","","","","1.096","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101890","10.149","0.002","10.712","0.002","15.148","0.003","85.51","0.01","88.99","0.02","62.45","0.01","1455.3","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1,1,4,4-tetramethyl-2,2,3,3-tetraphenyl-tetrasilane","","- C28 H34 Si4 -","- C28 H34 Si4 -","- C56 H68 Si8 -","2","1","","Harloff, J.; Reinke, H.; Köckerling, M.; Popowski, E.","Crystal structure of 1,1,4,4-tetramethyl-2,2,3,3-tetraphenyl-tetrasilane, [(CH~3~)~2~(H)Si(C~6~H~5~)~2~Si]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","627","628","","","","0.71073","MoKα","","0.0664","0.0487","","","0.127","0.1397","","","","","","1.044","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101891","10.498","0.009","14.555","0.003","18.546","0.008","96.61","0.04","101.64","0.06","97.86","0.06","2720","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H86 Mo2 N2 O9 S4 -","- C41 H86 Mo2 N2 O9 S4 -","- C82 H172 Mo4 N4 O18 S8 -","2","1","","Liu-González, M.; Sanz-Ruíz, F.; Palanca, P.; Sanz, V.; Pérez-Priede, M.; García-Granda, S.; García-Rodríguez, E.","Crystal structure of bis(tetra-n-butylammonium) tris(2-sulfidopropionato) sulfidodioxodimolybdate(V) monohydrate, [(NC~4~H~9~)~4~]~2~Mo~2~O~2~S (C~2~H~4~SCOO)~3~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","637","640","","","","0.71073","MoKα","","0.1832","0.0773","","","0.167","0.2142","","","","","","1.02","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101892","11.366","0.009","11.429","0.008","20.45","0.012","96.42","0.04","99.88","0.05","101.56","0.1","2534","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H80 Mo2 N2 O6 S4 -","- C38 H80 Mo2 N2 O6 S4 -","- C76 H160 Mo4 N4 O12 S8 -","2","1","","Liu-González, M.; Sanz-Ruíz, F.; Palanca, P.; Sanz, V.; Pérez-Priede, M.; García-Granda, S.; García-Rodríguez, E.","Crystal structure of bis(tetra-n-butylammonium) bis(2-sulfidopropionato) disulfidodioxodimolybdate(V), [(NC~4~H~9~)~4~]~2~Mo~2~O~2~S~2~(C~2~H~4~SCOO) ~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","641","644","","","","0.71073","MoKα","","0.2327","0.0941","","","0.2278","0.3097","","","","","","1.003","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101893","7.607","0.0015","7.711","0.0015","26.981","0.005","90","","97.19","0.03","90","","1570.2","0.5","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","diethyl 2-(4,5-dihydroxy-2-methylsulfanyl-3,4,5,6-tetrahydro- 4H-thiopyranyl)-difluoromethylphosphonate","","- C11 H21 F2 O5 P S2 -","- C11 H21 F2 O5 P S2 -","- C44 H84 F8 O20 P4 S8 -","4","1","","Pfund, E.; Barbey, C.; Lequeux, T.; Navaza, A.","Crystal structure of diethyl 2-(4,5-dihydroxy-2-methyl-sulfanyl-3,4,5,6- tetrahydro-4H-thiopyranyl)difluoro-methylphosphonate, C~11~H~21~F~2~O~5~PS~2~, a thioglycoside analogue bearing a difluorophosphonate group","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","629","630","","","","0.71073","MoKα","","0.0829","0.0579","","","0.1426","0.1608","","","","","","1.005","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101894","7.8213","0.0005","7.8625","0.0005","18.0999","0.0012","90","","107.037","0.005","90","","1064.21","0.12","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-(triaqua-bis(acetato-O,O')gadolinium(III)) chloride","","- C4 H12 Cl Gd O7 -","- C4 H12 Cl Gd O7 -","- C16 H48 Cl4 Gd4 O28 -","4","1","","Cesur, N.; Pantenburg, I.; Meyer, G.","Crystal structure of catena-[triaqua-bis(acetato-O,O')gadolinium(III)] chloride, [Gd(CH~3~COO)~2~(H~2~O)~3~]Cl","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","631","632","","","","0.71073","MoKα","","0.0339","0.0305","","","0.0798","0.0996","","","","","","1.17","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101896","7.204","0.001","19.11","0.002","12.704","0.002","90","","95.897","0.002","90","","1739.7","0.4","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","methanol[4-bromo-N-(2-pyridylmethyl)salicylaldiminato-N,N',O]nickel(II) monoperchlorate","","- C14 H14 Br Cl N2 Ni O6 -","- C14 H14 Br Cl N2 Ni O6 -","- C56 H56 Br4 Cl4 N8 Ni4 O24 -","4","1","","Peng, S.-J.; Yang, D.-W.; Xiao, Z.-L.; Wu, D.-X.; Cao, Z.","Crystal structure of methanol[4-bromo-N-(2-pyridylmethyl)salicylaldiminato- N,N',O]nickel(II) perchlorate, [Ni(CH~3~OH)(C~14~H~14~BrN~2~O~2~)]ClO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","633","634","","","","0.71073","MoKα","","0.0691","0.0417","","","0.0979","0.1093","","","","","","1.039","","","","has coordinates,has disorder","176466","2020-10-21","18:00:00",""
"8101897","10.765","0.002","11.113","0.002","12.441","0.002","113.746","0.002","104.388","0.002","94.983","0.002","1289.9","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","bis[N-cyclohexyl-4-nitrosalicylaldiminato]copper(II)","","- C26 H30 Cu N4 O6 -","- C26 H30 Cu N4 O6 -","- C52 H60 Cu2 N8 O12 -","2","1","","Chen, Q.","Crystal structure of bis[N-cyclohexyl-4-nitrosalicylaldiminato]copper(II), Cu(C~13~H~15~N~2~O~3~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","635","636","","","","0.71073","MoKα","","0.0958","0.0662","","","0.1107","0.1234","","","","","","1.057","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102883","15.925","0.002","11.59","0.001","11.232","0.001","90","","90","","90","","2073.1","0.4","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","diytterbium pentadecanickel nonaboride","","- B9 Ni15 Yb2 -","- B9 Ni15 Yb2 -","- B72 Ni120 Yb16 -","8","","","V. Babizhetskyy; I. Veremchuk; N. Chaban; Yu. Kuz'ma","Crystal structure of diytterbium pentadecanickel nonaboride, Yb~2~Ni~15~B~9~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","1","2","10.1524/ncrs.2005.220.14.1","","","0.71069","MoKα","","0.0501","0.0333","","","0.0514","0.0544","","","","","","1.099","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102884","10.2121","0.0006","10.2121","0.0006","10.2121","0.0006","90","","90","","90","","1064.99","0.11","293","2","293","2","","","","","","","","3","F m -3 m","-F 4 2 3","225","Cs2MoCl6","dicesium hexachloromolybdate(IV)","","- Cl6 Cs2 Mo -","- Cl6 Cs2 Mo -","- Cl24 Cs8 Mo4 -","4","0.0208333","","B. Hu; P. Wang; Y. Xiao; L.-P. Song","Crystal structure of dicesium hexachloromolybdate(IV), Cs~2~[MoCl~6~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","298","298","","","","0.71073","MoKα","","0.0269","0.025","","","0.0662","0.067","","","","","","1.202","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102885","7.3051","0.0008","9.0402","0.001","9.09","0.001","108.868","0.001","97.26","0.001","106.299","0.001","529.4","0.1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","hexagadolinium cobalt decabromide","","- Br10 Co Gd6 -","- Br5 Co0.5 Gd3 -","- Br10 Co Gd6 -","2","1","","C. Lefevre; C. Hoch; R. Eger; A. Simon","Crystal structure of hexagadolinium cobalt decabromide, Gd~6~CoBr~10~, a Y~6~RuI~10~-type structure","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","3","4","","","","0.56086","AgKα","","0.0337","0.0312","","","0.0939","0.0955","","","","","","1.096","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102886","8.993","0.008","5.675","0.006","7.349","0.004","90","","90","","90","","375.1","0.6","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","barium selenate","barium selenate","","- Ba O4 Se -","- Ba O4 Se -","- Ba4 O16 Se4 -","4","0.5","","A. Andara; M. A. Salvadó; Á. Fernández-González; S. García-Granda; M. Prieto","Crystal structure of barium selenate, BaSeO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","5","6","","","","0.71073","MoKα","","0.0452","0.0416","","","0.1137","0.1161","","","","","","1.203","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102887","6.471","0.002","6.645","0.002","8.623","0.003","90","","107.992","0.005","90","","352.7","0.2","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","potassium terbium(III) tetrasulfidogermanate","","- Ge K S4 Tb -","- Ge K S4 Tb -","- Ge2 K2 S8 Tb2 -","2","1","","B. C. Chan; P. K. Dorhout","Crystal structures of potassium terbium(III) tetrasulfidogermanate, KTbGeS~4~, and potassium praseodymium(III) tetraselenidogermanat, KPrGeSe~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","7","8","","","","0.71073","MoKα","","0.0368","0.035","","","0.0853","0.0858","","","","","","1.058","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102888","6.828","0.0008","7.0105","0.0008","8.9868","0.001","90","","108.157","0.002","90","","408.76","0.08","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","potassium praseodymium(III) tetraselenidogermanate","","- Ge K Pr Se4 -","- Ge K Pr Se4 -","- Ge2 K2 Pr2 Se8 -","2","1","","B. C. Chan; P. K. Dorhout","Crystal structures of potassium terbium(III) tetrasulfidogermanate, KTbGeS~4~, and potassium praseodymium(III) tetraselenidogermanat, KPrGeSe~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","7","8","","","","0.71073","MoKα","","0.0381","0.0371","","","0.0893","0.0898","","","","","","1.11","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102889","9.393","0.004","10.954","0.005","9.578","0.004","90","","90","","90","","985.5","0.7","571","2","571","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Tripotassium tetraselenidophosphate","","- K3 P Se4 -","- K3 P Se4 -","- K12 P4 Se16 -","4","0.5","","B. C. Chan; P. L. Feng; Z. Hulvey; P. K. Dorhout","Crystal structure of tripotassium tetraselenidophosphate, K~3~PSe~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","11","11","","","","0.71073","MoKα","","0.0628","0.0294","","","0.0546","0.0629","","","","","","0.934","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102890","13.6637","0.001","12.3993","0.0009","8.7631","0.0007","90","","91.267","0.001","90","","1484.28","0.19","571","2","571","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","tetrapotassium hexaselenidohypodiphosphate","","- K4 P2 Se6 -","- K4 P2 Se6 -","- K16 P8 Se24 -","4","1","","B. C. Chan; P. L. Feng; Z. Hulvey; P. K. Dorhout","Crystal structure of tetrapotassium hexaselenidohypodiphosphate, K~4~P~2~Se~6~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","9","10","","","","0.71073","MoKα","","0.0609","0.0471","","","0.0807","0.0834","","","","","","1.313","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102891","15.148","0.003","7.5988","0.0014","10.0568","0.0018","90","","121.833","0.002","90","","983.5","0.3","298","2","298","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Tetracesium octaselenidodisilicate","","- Cs4 Se8 Si2 -","- Cs4 Se8 Si2 -","- Cs8 Se16 Si4 -","2","0.25","","B. C. Chan; P. L. Feng; Z. Hulvey; L. Polykova; R. F. Hess; K. D. Abney; P. K. Dorhout","Crystal structure of tetracesium octaselenidodisilicate, Cs~4~Si~2~Se~8~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","1","12","12","","","","0.71073","MoKα","","0.0301","0.0278","","","0.0679","0.0683","","","","","","1.595","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102892","8.033","0.001","9.861","0.001","10.048","0.001","108.62","0.02","97.62","0.02","106.02","0.02","703.4","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","hexalanthanum osmium decaiodide","hexalanthanum monoosmium decaiodode","","- I10 La6 Os -","- I10 La6 Os -","- I10 La6 Os -","1","0.5","","Hj. Mattausch; A. Simon","Crystal structure of hexalanthanum osmium decaiodide, La~6~OsI~10~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","121","121","","","","0.56086","AgKα","","0.0304","0.0223","","","0.0515","0.0548","","","","","","1.019","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102893","9.277","0.001","10.935","0.001","9.251","0.001","90","","90","","90","","938.46","0.17","153","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","trirubidium tetrathiophosphate","","- P Rb3 S4 -","- P Rb3 S4 -","- P4 Rb12 S16 -","4","0.5","","L.-B. Wu; F.-Q. Huang","Crystal structure of trirubidium tetrathiophosphate, Rb~3~PS~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","122","122","","","","0.71073","MoKα","","","0.027","","0.046","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102894","8.2482","0.0011","8.2482","0.0011","25.658","0.004","90","","90","","120","","1511.7","0.4","293","2","295.15","","","","","","","","","3","R -3 :H","-R 3","148","","","","- Ag9.8 Ga8.2 Mg54 -","- Ag9.81 Ga8.244 Mg54 -","- Ag9.81 Ga8.244 Mg54 -","1","0.0555556","","Kudla, C.; Orucoglu, E.; Prots, Yu.; Kreiner, G.","Crystal structure of mono(silver, gallium) trimagnesium, Ag~0.55~Ga~0.45~Mg~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","123","124","","","","0.7107","MoKα","","0.035","0.031","","","0.058","0.06","","","","","","1.227","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102895","5.8645","0.0002","11.368","0.0005","3.385","0.0002","90","","90","","90","","225.67","0.018","","","295.15","","","","","","","","","3","P b a m","-P 2 2ab","55","","ytterbium nickel tetraboride","","- B4 Ni Yb -","- B4 Ni Yb -","- B16 Ni4 Yb4 -","4","0.5","","I. Veremchuk; Yu. Prots; A. Leithe-Jasper; Yu. Kuz'ma","Refinement of the crystal structure of ytterbium nickel tetraboride, YbNiB~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","125","126","","","","0.7107","MoKα","","","0.025","","","","0.026","","","","","","1.03","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102896","18.1852","0.001","6.8085","0.0005","6.3518","0.0005","90","","90","","90","","786.44","0.1","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","cesium lead tetrathiophosphate","","- Cs P Pb S4 -","- Cs P Pb S4 -","- Cs4 P4 Pb4 S16 -","4","0.5","","I. Belkyal; M. El Azhari; Y.-D. Wu; W. Bensch; K.-F. Hesse; W. Depmeier","Crystal structure of cesium lead tetrathiophosphate, CsPbPS~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","127","128","","","","0.71073","MoKα","","0.0482","0.0392","","","0.0947","0.101","","","","","","1.027","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102897","11.87","0.002","3.3575","0.0006","5.7556","0.001","90","","113.11","0.01","90","","210.97","0.07","293","2","295.15","","","","","","","","","3","C 1 2/m 1","-C 2y","12","Gadolinium-tricarbomolybdate(III)","Gadolinium-tricarbomolybdate(III)","","- C3 Gd2 Mo2 -","- C3 Gd2 Mo2 -","- C6 Gd4 Mo4 -","2","0.25","","Dashjav, E.; Schnelle, W.; Kreiner, G.; Kniep, R.","Crystal structure of digadolinium tricarbomolybdate(III), Gd~2~[Mo~2~C~3~]","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","129","130","","","","0.71073","MoKα","","0.0381","0.0375","","","0.0892","0.0902","","","","","","1.155","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102898","12.5691","0.0011","5.179","0.0007","16.2106","0.0015","90","","106.04","0.006","90","","1014.15","0.19","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","disamarium undecaoxotetratellurate","","- O11 Sm2 Te4 -","- O11 Sm2 Te4 -","- O44 Sm8 Te16 -","4","0.5","","K. Sugiyama; R. Simura; B. Wedel","Crystal structure of disamarium undecaoxotetratellurate(IV), Sm~2~Te~4~O~11~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","131","132","","","","0.71069","MoKα","","0.0579","0.0352","","","0.071","0.0778","","","","","","1.008","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102899","7.987","0.001","7.987","0.001","8.422","0.001","90","","90","","120","","465.28","0.1","293","2","293","2","","","","","","","","2","P 63 c m","P 6c -2","185","Trimagnesium palladium","Trimagnesium palladium","","- Mg3 Pd -","- Mg3 Pd -","- Mg18 Pd6 -","6","0.5","","Makongo, J. P. A.; Kudla, C.; Prots, Yu.; Niewa, R.; Burkhardt, U.; Kreiner, G.","Crystal structure of trimagnesium monopalladium, Mg~3~Pd","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","289","292","","","","0.71073","MoKα","","0.0232","0.0225","","","0.0445","0.0447","","","","","","1.426","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102900","6.316","0.005","6.557","0.005","8.571","0.007","90","","108.088","0.012","90","","337.4","0.5","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","potassium ytterbium tetrathiosilicate(IV)","","- K S4 Si Yb -","- K S4 Si Yb -","- K2 S8 Si2 Yb2 -","2","1","","A. K. Gray; J. M. Knaust; B. C. Chan; L. A. Polyakova; P. K. Dorhout","Crystal structure of potassium ytterbium(III) tetrathiosilicate, KYbSiS~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","293","293","","","","0.71073","MoKα","","0.0273","0.0254","","","0.0588","0.0594","","","","","","1.044","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102901","7.9743","0.0012","12.3374","0.0019","7.1142","0.0011","90","","107.101","0.003","90","","668.97","0.18","173","2","298","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","nonasodium lanthanum(III) bis[hexaselenodigermante(III)]","","- Ge4 La Na9 Se12 -","- Ge4 La Na9 Se12 -","- Ge4 La Na9 Se12 -","1","0.125","","B. R. Martin; J. M. Knaust; P. K. Dorhout","Crystal structure of nonasodium lanthanum(III) bis[hexaselenodigermanate], Na~9~La[Ge~2~Se~6~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","294","294","","","","0.71073","MoKα","","0.0428","0.0272","","","0.05","0.0531","","","","","","0.958","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102902","7.6481","0.0011","13.2228","0.0019","8.4385","0.0012","90","","107.667","0.003","90","","813.1","0.2","298","2","298","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","octasodium europium bis(hexatellurodisilicate)","","- Eu2 Na8 Si4 Te12 -","- Eu2 Na8 Si4 Te12 -","- Eu2 Na8 Si4 Te12 -","1","0.125","","Knaust, J. M.; Polyakova, L. A.; Dorhout, P. K.","Crystal structures of octasodium dieuropium(II) bis[hexa-tellurodisilicate], Na~8~Eu~2~[Si~2~Te~6~]~2~, octasodium dieuro- pium(II) bis[hexaselenodigermanate], Na~8~Eu~2~[Ge~2~Se~6~]~2~, and nonasodium samarium(III) bis[hexaselenodisilicate], Na~9~Sm[Si~2~Se~6~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","295","297","","","","0.71073","MoKα","","0.0479","0.0292","","","0.0548","0.0593","","","","","","1.003","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102903","7.137","0.002","12.33","0.004","8.019","0.003","90","","107.279","0.005","90","","673.8","0.4","298","2","298","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","octasodium europium(II) bis[hexaselenodigermanate(III)]","","- Eu2 Ge4 Na8 Se12 -","- Eu2 Ge4 Na8 Se12 -","- Eu2 Ge4 Na8 Se12 -","1","0.125","","Knaust, J. M.; Polyakova, L. A.; Dorhout, P. K.","Crystal structures of octasodium dieuropium(II) bis[hexa-tellurodisilicate], Na~8~Eu~2~[Si~2~Te~6~]~2~, octasodium dieuro- pium(II) bis[hexaselenodigermanate], Na~8~Eu~2~[Ge~2~Se~6~]~2~, and nonasodium samarium(III) bis[hexaselenodisilicate], Na~9~Sm[Si~2~Se~6~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","295","297","","","","0.71073","MoKα","","0.0448","0.0343","","","0.0805","0.0868","","","","","","1.027","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102904","7.0109","0.0013","12.098","0.002","7.916","0.0015","90","","107.178","0.003","90","","641.5","0.2","173","2","298","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","nonasodium samarium(III) bis[hexaselenodisilicate(III)]","","- Na9 Se12 Si4 Sm -","- Na9 Se12 Si4 Sm -","- Na9 Se12 Si4 Sm -","1","0.125","","Knaust, J. M.; Polyakova, L. A.; Dorhout, P. K.","Crystal structures of octasodium dieuropium(II) bis[hexa-tellurodisilicate], Na~8~Eu~2~[Si~2~Te~6~]~2~, octasodium dieuro- pium(II) bis[hexaselenodigermanate], Na~8~Eu~2~[Ge~2~Se~6~]~2~, and nonasodium samarium(III) bis[hexaselenodisilicate], Na~9~Sm[Si~2~Se~6~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","295","297","","","","0.71073","MoKα","","0.0557","0.0509","","","0.1156","0.1194","","","","","","1.202","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102905","19.927","0.001","12.636","0.001","19.399","0.001","90","","90.24","0.01","90","","4884.6","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","dodecalanthanum heptadecaiodide triethanide","dodecalanthanum heptadecaiodide triethanide","","- C6 I17 La12 -","- C6 I17 La12 -","- C24 I68 La48 -","4","0.5","","Hj. Mattausch; A. Simon","Crystal structure of dodecalanthanum heptadecaiodide triethanide, La~12~I~17~(C~2~)~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","299","300","","","","0.56086","AgKα","","0.0317","0.0261","","","0.0596","0.0621","","","","","","1.085","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102906","7.9134","0.0013","7.9134","0.0013","7.9134","0.0013","90","","90","","90","","495.55","0.14","293","2","293","2","","","","","","","","4","I m -3 m","-I 4 2 3","229","","strontium octabarium hexakis(dinitridoborate)","","- B12 Ba16 N24 Sr2 -","- B3 Ba4 N6 Sr0.5 -","- B6 Ba8 N12 Sr -","2","0.0208333","","Öztürk. S. S.; Kokal, I.; Somer, M.","Crystal structures of strontium octabarium hexakis(dinitridoborate) and europium octabarium hexakis(dinitridoborate), MBa~8~[BN~2~]~6~ (M = Sr, Eu)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","303","304","","","","0.71073","MoKα","","0.0328","0.0314","","","0.0942","0.0977","","","","","","0.83","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102907","10.678","0.004","10.678","0.004","6.12","0.003","90","","90","","120","","604.3","0.4","293","2","293","2","","","","","","","","4","P 63","P 6c","173","","trilanthanum manganese aluminum heptaselenide","","- Al La3 Mn Se7 -","- Al La3 Mn0.726 Se7 -","- Al2 La6 Mn1.452 Se14 -","2","0.333333","","L.-B. Wu; F.-Q. Huang","Crystal structure of trilanthanum manganese aluminum heptaselenide, La~3~Mn~0.73~AlSe~7~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","305","306","","","","0.71073","MoKα","","0.0199","0.0197","","","0.0358","0.0358","","","","","","1.283","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102908","10.166","0.001","4.255","0.001","9.589","0.001","90","","90","","90","","414.78","0.11","293","2","293","2","","","","","","","synthesis as described","5","P n m a","-P 2ac 2n","62","","lead chloride thiocyanate","","- C Cl N Pb S -","- C Cl N Pb S -","- C4 Cl4 N4 Pb4 S4 -","4","0.5","","A. Gacemi; D. Benbertal; I. Gautier-Luneau; A. Mosset","Crystal structure of lead chloride thiocyanate, PbCl(SCN)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","309","312","","","x-ray","0.56085","AgKα","","0.0293","0.0234","","","0.062","0.0671","","","","","","0.889","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102909","13.172","0.002","13.982","0.001","4.083","0.001","90","","90","","90","","752","0.2","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","tetragadolinium-hexabromide-monosilicide","tetragadolinium hexabromide monosilicide","","- Br6 Gd4 Si -","- Br6 Gd4 Si -","- Br12 Gd8 Si2 -","2","0.25","","Hj. Mattausch; A. Simon","Crystal structure of tetragadolinium monosilicide hexabromide, Gd~4~SiBr~6~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","313","313","","","","0.71073","MoKα","","0.0334","0.0262","","","0.0587","0.0606","","","","","","0.969","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102910","4.6433","0.0004","7.6322","0.0006","7.7341","0.0007","90","","90","","90","","274.09","0.04","","","293","2","","","","","","","","3","I m m b","-I 2a 2a","74","","","","- Eu Ga1.76 Li0.24 -","- Eu Ga1.76 Li0.24 -","- Eu4 Ga7.04 Li0.96 -","4","0.25","","A. Fedorchuk; Yu. Prots; W. Schnelle; Yu. Grin","Crystal structure of europium lithium gallium, EuLi~0.24~Ga~1.76~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","315","316","","","","0.71073","MoKα","","","0.037","","","","0.0978","","","","","","1.188","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102911","4.3831","0.0001","4.3831","0.0001","11.0632","0.0004","90","","90","","90","","212.541","0.01","","","295.15","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Eu Ga3.44 Mg0.56 -","- Eu Ga3.44 Mg0.56 -","- Eu2 Ga6.88 Mg1.12 -","2","0.0625","","Fedorchuk, A.; Prots, Yu.; Grin, Yu.","Crystal structures of europium magnesium gallium, EuMg~x~Ga~4-x~, and europium lithium gallium, EuLi~x~Ga~4-x~ (x » 0.5)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","317","318","","","","0.56087","AgKα","","","0.017","","","","0.033","","","","","","1.03","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102912","4.3456","0.0001","4.3456","0.0001","10.8453","0.0005","90","","90","","90","","204.805","0.012","295","2","295","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","Europium lithium gallium","","- Eu Ga3.46 Li0.54 -","- Eu Ga3.46 Li0.54 -","- Eu2 Ga6.92 Li1.08 -","2","0.0625","","A. Fedorchuk; Yu. Prots; Yu. Grin","Crystal structures of europium magnesium gallium, EuMg~x~Ga~4-x~, and europium lithium gallium, EuLi~x~Ga~4-x~ (x » 0.5)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","317","318","","powder diffraction","x-ray","1.54057","CuKα~1~","","","","","","","","","0.0789","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102913","6.916","0.0003","6.1032","0.0003","11.1679","0.0006","90","","90","","90","","471.39","0.04","293","2","293","2","","","","","","","","4","P m n 21","P 2ac -2","31","","hexaaquanickel(II) hydrogenphosphate monohydrate","","- H7.5 Ni0.5 O5.5 P0.5 -","- H7.5 Ni0.5 O5.5 P0.5 -","- H30 Ni2 O22 P2 -","4","1","","X.-W. Wang; P. Wang; Y.-Q. Zheng","Crystal structure of hexaaquanickel(II) hydrogenphosphate monohydrate, [Ni(H~2~O)~6~][HPO~4~] · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","321","322","","","","0.71073","MoKα","","0.018","0.0178","","","0.0471","0.0472","","","","","","1.1","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102914","10.421","0.002","10.421","0.002","5.785","0.003","90","","90","","120","","544.1","0.3","293","2","293","2","","","","","","","","4","P 63","P 6c","173","","trilanthanum monosilver monosilicon heptasulfide","","- Ag La3 S7 Si -","- Ag La3 S7 Si -","- Ag2 La6 S14 Si2 -","2","0.333333","","L.-B. Wu; F.-Q. Huang","Crystal structure of trilanthanum monosilver monosilicon heptasulfide, La~3~AgSiS~7~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","307","308","","","","0.71073","MoKα","","0.0424","0.0423","","","0.0985","0.0986","","","","","","1.195","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102915","6.0043","0.0004","6.0043","0.0004","6.0043","0.0004","90","","90","","90","","216.46","0.02","293","2","293","2","","","","","","","","3","P m -3 m","-P 4 2 3","221","","tricerium monogallium tribromide","","- Br3 Ce3 Ga -","- Br3 Ce3 Ga -","- Br3 Ce3 Ga -","1","0.0208333","","C. Zheng; Hj. Mattausch; A. Simon","Crystal structure of tricerium monogallium tribromide, Ce~3~GaBr~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","314","314","","","","0.71073","MoKα","","0.0313","0.0313","","","0.0764","0.0764","","","","","","1.127","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102916","5.9536","0.0014","3.5964","0.001","6.856","0.002","90","","90","","90","","146.8","0.07","293","","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Co Si V -","- Co Si V -","- Co4 Si4 V4 -","4","0.5","","Conrad, M.; Herrmann, B.; Harbrecht, B.","Refinement of the crystal structure of monovanadium monocobalt monosilicide, VCoSi","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","319","320","","","","0.71073","MoKα","","0.037","0.0252","","","0.0494","0.0517","","","","","","1.147","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102917","12.784","0.001","12.784","0.001","12.784","0.001","90","","90","","90","","2089.3","0.3","296","2","296","2","","","","","","","","2","P -4 3 n","P -4n 2 3","218","","tetrapotassium tetrahedro-tetragermanide","","- Ge4 K4 -","- Ge4 K4 -","- Ge32 K32 -","8","0.333333","","H. G. von Schnering; J. Llanos; J.-H. Chang; K. Peters; E.-M. Peters; R. Nesper","Refinement of the crystal structures of the tetrahedro-tetragermanides K~4~Ge~4~, Rb~4~Ge~4~ and Cs~4~Ge~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","324","326","","","","0.71073","MoKα","","0.0373","0.0341","","","0.0836","0.0862","","","","","","1.113","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102918","13.198","0.002","13.198","0.002","13.198","0.002","90","","90","","90","","2298.9","0.6","296","2","296","2","","","","","","","","2","P -4 3 n","P -4n 2 3","218","","tetrarubidium tetrahedro-tetragermanide","","- Ge4 Rb4 -","- Ge4 Rb4 -","- Ge32 Rb32 -","8","0.333333","","H. G. von Schnering; J. Llanos; J.-H. Chang; K. Peters; E.-M. Peters; R. Nesper","Refinement of the crystal structures of the tetrahedro-tetragermanides K~4~Ge~4~, Rb~4~Ge~4~ and Cs~4~Ge~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","324","326","","","","0.71073","MoKα","","0.0591","0.0395","","","0.0762","0.0819","","","","","","1.016","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102919","13.654","0.002","13.654","0.002","13.654","0.002","90","","90","","90","","2545.5","0.6","296","2","296","2","","","","","","","","2","P -4 3 n","P -4n 2 3","218","","tetracaesium tetrahedro-tetragermanide","","- Cs4 Ge4 -","- Cs4 Ge4 -","- Cs32 Ge32 -","8","0.333333","","H. G. von Schnering; J. Llanos; J.-H. Chang; K. Peters; E.-M. Peters; R. Nesper","Refinement of the crystal structures of the tetrahedro-tetragermanides K~4~Ge~4~, Rb~4~Ge~4~ and Cs~4~Ge~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","324","326","","","","0.71073","MoKα","","0.0386","0.0356","","","0.0829","0.0852","","","","","","1.035","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102920","4.029","0.0006","4.029","0.0006","22.425","0.004","90","","90","","120","","315.25","0.09","293","2","293","2","","","","","","","","2","R -3 m :H","-R 3 2""","166","Bariumsubnitride","dibarium mononitride","","- Ba2 N -","- Ba2 N -","- Ba6 N3 -","3","0.0833333","","Reckeweg, O.; DiSalvo, F. J.","Crystal structure of dibarium mononitride, Ba~2~N, an alkaline earth metal subnitride","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","519","520","","","","0.71073","MoKα","","0.026","0.026","","","0.0634","0.0634","","","","","","1.295","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102921","12.62","0.001","12.62","0.001","12.62","0.001","90","","90","","90","","2009.9","0.3","293","2","293","2","","","","","","","","2","P -4 3 n","P -4n 2 3","218","","tetrapotassium tetrahedro-tetrasilicide","","- K4 Si4 -","- K4 Si4 -","- K32 Si32 -","8","0.333333","","von Schnering, H. G.; Schwarz, M.; Chang, J.-H.; Peters, K.; Peters, E.-M.; Nesper, R.","Refinement of the crystal structures of the tetrahedro-tetrasilicides K~4~Si~4~, Rb~4~Si~4~ and Cs~4~Si~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","525","527","","","","0.71073","MoKα","","0.0209","0.0172","","","0.0401","0.0414","","","","","","0.999","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102922","13.042","0.001","13.042","0.001","13.042","0.001","90","","90","","90","","2218.4","0.3","293","2","293","2","","","","","","","","2","P -4 3 n","P -4n 2 3","218","","tetrarubidium tetrahedro-tetrasilicide","","- Rb4 Si4 -","- Rb4 Si4 -","- Rb32 Si32 -","8","0.333333","","von Schnering, H. G.; Schwarz, M.; Chang, J.-H.; Peters, K.; Peters, E.-M.; Nesper, R.","Refinement of the crystal structures of the tetrahedro-tetrasilicides K~4~Si~4~, Rb~4~Si~4~ and Cs~4~Si~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","525","527","","","","0.71073","MoKα","","0.0386","0.0267","","","0.0401","0.052","","","","","","0.802","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102923","13.51","0.001","13.51","0.001","13.51","0.001","90","","90","","90","","2465.8","0.3","293","2","293","2","","","","","","","","2","P -4 3 n","P -4n 2 3","218","","tetracaesium tetrahedro-tetragermanide","","- Cs4 Si4 -","- Cs4 Si4 -","- Cs32 Si32 -","8","0.333333","","von Schnering, H. G.; Schwarz, M.; Chang, J.-H.; Peters, K.; Peters, E.-M.; Nesper, R.","Refinement of the crystal structures of the tetrahedro-tetrasilicides K~4~Si~4~, Rb~4~Si~4~ and Cs~4~Si~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","525","527","","","","0.71073","MoKα","","0.023","0.0222","","","0.0519","0.0527","","","","","","0.954","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102924","8.0937","0.0003","8.0937","0.0003","32.129","0.003","90","","90","","90","","2104.7","0.2","293","2","293","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","decacerium pentagallium tetrabromide","","- Br4 Ce10 Ga5 -","- Br4 Ce10 Ga5 -","- Br16 Ce40 Ga20 -","4","0.125","","Li, S.-J.; Zheng, C.; Mattausch, Hj.; Simon, A.","Crystal structure of decacerium pentagallium tetrabromide, Ce~10~Ga~5~Br~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","521","522","","","","0.71073","MoKα","","0.0472","0.047","","","0.1138","0.1139","","","","","","1.496","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102925","11.1723","0.0013","11.1723","0.0013","11.1723","0.0013","90","","90","","90","","1394.5","0.3","213","2","213","2","","","","","","","","2","P a -3","-P 2ac 2ab 3","205","Germaniumtetrabromid","germanium tetrabromide","","- Br4 Ge -","- Br4 Ge -","- Br32 Ge8 -","8","0.333333","","Köhler, J.; Okudera, H.; Reuter, D.; Simon, A.","Crystal structure of germanium tetrabromide, α-GeBr~4~, room temperature modification","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","523","523","","","","0.71073","MoKα","","0.03","0.0269","","","0.0754","0.0765","","","","","","1.486","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102926","10.183","0.002","6.779","0.0014","10.292","0.002","90","","102.53","0.03","90","","693.5","0.3","93","2","293","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","Germaniumtetrabromid","germanium tetrabromide","","- Br4 Ge -","- Br4 Ge -","- Br16 Ge4 -","4","1","","Köhler, J.; Okudera, H.; Simon, A.","Crystal structure of germanium tetrabromide, β-GeBr~4~, low temperature modification","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","524","524","","","","0.71073","MoKα","","0.0755","0.0606","","","0.1313","0.1376","","","","","","1.167","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102927","8.305","0.0017","14.579","0.003","7.059","0.0014","90","","90","","90","","854.7","0.3","295","2","295.15","","","","","","","","","4","P n m a","-P 2ac 2n","62","","dilanthanum tris(monohydrogenphosphate(III)) La~2~(HPO~3~)~3~","","- H3 La2 O9 P3 -","- H3 La2 O9 P3 -","- H12 La8 O36 P12 -","4","0.5","","Ewald, B.; Prots, Yu.; Kniep, R.","Crystal structure of dilanthanum tris(monohydrogenphosphate(III)), La~2~(HPO~3~)~3~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","533","534","","","","0.7107","MoKα","","0.059","0.042","","","0.066","0.069","","","","","","1.16","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102928","4.5134","0.0001","4.5134","0.0001","17.5823","0.0005","90","","90","","90","","358.165","0.015","298","2","295","2","","","","","","","","2","I 4/m m m","-I 4 2","139","","dineodymium antimonide","","- Nd2 Sb -","- Nd2 Sb -","- Nd8 Sb4 -","4","0.125","","Nuss, J.; Jansen, M.","Crystal structure of dineodymium antimonide, Nd~2~Sb","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","529","530","","","x-ray","0.71073","MoKα","","0.0247","0.0245","","","0.0566","0.0567","","","","","","1.475","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102929","10.4928","0.0001","6.0693","0.0001","15.2921","0.0001","90","","90.087","0.002","90","","973.86","0.02","293","","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","tripotassium monosodium ditungstate","","- K3 Na O8 W2 -","- K3 Na O8 W2 -","- K12 Na4 O32 W8 -","4","0.5","","Arumugam, N.; Sofin, M.; Jansen, M.","Crystal structure of tripotassium monosodium ditungstate, K~3~Na[WO~4~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","531","532","","","","0.71069","MoKα","","0.0627","0.0601","","","0.0576","0.0576","","","","10.27","10.27","9.68","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102930","7.7875","0.001","7.7875","0.001","6.9709","0.0013","90","","90","","90","","422.75","0.11","298","2","298","2","","","","","","","","5","P 4/m m m","-P 4 2","123","","dirubidium barium bis(tetracyanoplatinate(II))","","- C8 Ba N8 Pt2 Rb2 -","- C8 Ba N8 Pt2 Rb2 -","- C8 Ba N8 Pt2 Rb2 -","1","0.0625","","Mühle, C.; Nuss, J.; Jansen, M.","Crystal structure of dirubidium barium bis(tetracyanoplatinate(II)), Rb~2~Ba[Pt(CN)~4~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","528","528","","","x-ray","0.71073","MoKα","","0.0753","0.0461","","","0.1081","0.1337","","","","","","1.244","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102931","7.7591","0.0005","14.654","0.001","8.2382","0.0005","90","","90.26","0.01","90","","936.69","0.1","293","2","295.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- B2 Co0.25 H8 Mg0.75 O13 P2 -","- B2 Co0.233 H8 Mg0.767 O13 P2 -","- B8 Co0.932 H32 Mg3.068 O52 P8 -","4","1","","Ewald, B.; Öztan, Y.; Prots, Yu.; Kniep, R.","Crystal structure of diaqua(magnesium,cobalt) bis(hydroxyboro)bisphosphate monohydrate, Mg~1-x~Co~x~(H~2~O)~2~[B~2~P~2~O~8~(OH)~2~] · H~2~O (x ≈ 0.25)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","535","536","","","","0.7107","MoKα","","0.049","0.04","","","0.09","0.098","","","","","","1.21","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103486","7.8394","","7.8394","","7.8394","","90","","90","","90","","481.78","","","","","","","","","","","","","4","I m -3 m","-I 4 2 3","229","","Eu Ba8 (B N2)6","","- B6 Ba8 Eu N12 -","- B6 Ba8 Eu N12 -","- B6 Ba8 Eu N12 -","1","0.0104167","","Öztürk, S. S.; Kokal, I.; Somer, M.","Crystal structures of strontium octabarium hexakis(dinitridoborate) and europium octabarium hexakis(dinitridoborate), MBa~8~[BN~2~]~6~ (M = Sr, Eu)","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","303","304","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""